*HEADER    UNKNOWN FUNCTION                        08-APR-13   2M6Q              
*TITLE     REFINED SOLUTION NMR STRUCTURE OF STAPHYLOCOCCUS AUREUS PROTEIN       
*TITLE    2 SAV1430. NORTHEAST STRUCUTRAL GENOMICS CONSORTIUM TARGET ZR18        
*COMPND    MOL_ID: 1;                                                            
*COMPND   2 MOLECULE: SAV1430;                                                   
*COMPND   3 CHAIN: A;                                                            
*COMPND   4 ENGINEERED: YES                                                      
*SOURCE    MOL_ID: 1;                                                            
*SOURCE   2 ORGANISM_SCIENTIFIC: STAPHYLOCOCCUS AUREUS SUBSP. AUREUS;            
*SOURCE   3 ORGANISM_TAXID: 158878;                                              
*SOURCE   4 STRAIN: MU50;                                                        
*SOURCE   5 GENE: SAV1430;                                                       
*SOURCE   6 EXPRESSION_SYSTEM: ESCHERICHIA COLI;                                 
*SOURCE   7 EXPRESSION_SYSTEM_TAXID: 562;                                        
*SOURCE   8 EXPRESSION_SYSTEM_STRAIN: BL21MGK;                                   
*SOURCE   9 EXPRESSION_SYSTEM_VECTOR_TYPE: PET21;                                
*SOURCE  10 EXPRESSION_SYSTEM_PLASMID: ZR18-21                                   
*KEYWDS    STRUCTURAL GENOMICS, NORTHEAST STRUCTURAL GENOMICS CONSORTIUM, NESG,  
*KEYWDS   2 PSI-BIOLOGY, PROTEIN STRUCTURE INITIATIVE, UNKNOWN FUNCTION          
*EXPDTA    SOLUTION NMR                                                          
*NUMMDL    10                                                                    
*AUTHOR    M.C.BARAN, J.M.ARAMINI, Y.J.HUANG, R.XIAO, T.B.ACTON, L.SHIH,         
*AUTHOR   2 G.T.MONTELIONE, NORTHEAST STRUCTURAL GENOMICS CONSORTIUM (NESG)      
*REVDAT   1   01-MAY-13 2M6Q    0                                                


! Final combined constraints used in the final CNS refinement of ZR18   12-21-2012
! Distance constraints; sum averaging
! NOE-based Distance restraints from AutoStructure
 assign ((resid   1 and name HA   ))   ( (resid   1 and name HG2  ))     4.00  2.20  1.00
 assign ((resid   1 and name HA   ))   ( (resid   1 and name HG1  ))     4.00  2.20  1.00
 assign ((resid   1 and name HA   ))   ( (resid   2 and name HN   ))     3.00  1.20  0.50
 assign ((resid   1 and name HA   ))   ( (resid  20 and name HB#  ))     4.00  2.20  2.00
 assign ((resid   1 and name HA   ))   ( (resid  26 and name HE#  ))     4.00  2.20  2.00
 assign ((resid   1 and name HB#  ))   ( (resid  82 and name HD#  ))     4.00  2.20  4.00
 assign ((resid   1 and name HG#  ))   ( (resid   2 and name HN   ))     4.00  2.20  2.00
 assign ((resid   1 and name HG#  ))   ( (resid  19 and name HD2# ))     4.00  2.20  3.00
 assign ((resid   1 and name HG#  ))   ( (resid  20 and name HN   ))     4.00  2.20  2.00
 assign ((resid   1 and name HG2  ))   ( (resid  26 and name HE#  ))     4.00  2.20  2.00
 assign ((resid   1 and name HG1  ))   ( (resid  26 and name HE#  ))     4.00  2.20  2.00
 assign ((resid   2 and name HN   ))   ( (resid   2 and name HA   ))     4.00  2.20  1.00
 assign ((resid   2 and name HN   ))   ( (resid  20 and name HN   ))     4.00  2.20  1.00
 assign ((resid   2 and name HA   ))   ( (resid   3 and name HN   ))     2.50  0.70  0.40
 assign ((resid   2 and name HB#  ))   ( (resid   2 and name HD#  ))     4.00  2.20  3.00
 assign ((resid   2 and name HB#  ))   ( (resid   2 and name HE#  ))     4.00  2.20  3.00
 assign ((resid   2 and name HB#  ))   ( (resid   3 and name HN   ))     4.00  2.20  2.00
 assign ((resid   2 and name HB#  ))   ( (resid  83 and name HG#  ))     4.00  2.20  3.00
 assign ((resid   2 and name HG2  ))   ( (resid   2 and name HE#  ))     4.00  2.20  2.00
 assign ((resid   2 and name HG1  ))   ( (resid   2 and name HE#  ))     4.00  2.20  2.00
 assign ((resid   2 and name HG#  ))   ( (resid  82 and name HB#  ))     4.00  2.20  3.00
 assign ((resid   2 and name HD#  ))   ( (resid  83 and name HB#  ))     4.00  2.20  3.00
 assign ((resid   2 and name HE#  ))   ( (resid   4 and name HD1# ))     4.00  2.20  3.00
 assign ((resid   3 and name HN   ))   ( (resid   3 and name HA   ))     4.00  2.20  1.00
 assign ((resid   3 and name HN   ))   ( (resid   3 and name HB   ))     3.00  1.20  0.50
 assign ((resid   3 and name HN   ))   ( (resid   3 and name HG12 ))     4.00  2.20  1.00
 assign ((resid   3 and name HN   ))   ( (resid   3 and name HG11 ))     4.00  2.20  1.00
 assign ((resid   3 and name HN   ))   ( (resid   3 and name HG2# ))     4.00  2.20  2.00
 assign ((resid   3 and name HN   ))   ( (resid   3 and name HD1# ))     4.00  2.20  2.00
 assign ((resid   3 and name HN   ))   ( (resid  19 and name HD2# ))     4.00  2.20  2.00
 assign ((resid   3 and name HN   ))   ( (resid  82 and name HB2  ))     4.00  2.20  1.00
 assign ((resid   3 and name HN   ))   ( (resid  82 and name HB1  ))     4.00  2.20  1.00
 assign ((resid   3 and name HA   ))   ( (resid   3 and name HG12 ))     4.00  2.20  1.00
 assign ((resid   3 and name HA   ))   ( (resid   3 and name HG11 ))     4.00  2.20  1.00
 assign ((resid   3 and name HA   ))   ( (resid   3 and name HG2# ))     4.00  2.20  1.60
 assign ((resid   3 and name HA   ))   ( (resid   3 and name HD1# ))     4.00  2.20  2.00
 assign ((resid   3 and name HA   ))   ( (resid   4 and name HN   ))     3.00  1.20  0.50
 assign ((resid   3 and name HA   ))   ( (resid   4 and name HB   ))     4.00  2.20  1.00
 assign ((resid   3 and name HA   ))   ( (resid   5 and name HN   ))     4.00  2.20  1.00
 assign ((resid   3 and name HA   ))   ( (resid  17 and name HG2# ))     4.00  2.20  2.00
 assign ((resid   3 and name HA   ))   ( (resid  19 and name HD2# ))     4.00  2.20  2.00
 assign ((resid   3 and name HB   ))   ( (resid   3 and name HD1# ))     4.00  2.20  2.00
 assign ((resid   3 and name HG1# ))   ( (resid   3 and name HG2# ))     4.00  2.20  3.00
 assign ((resid   3 and name HG1# ))   ( (resid   4 and name HN   ))     4.00  2.20  2.00
 assign ((resid   3 and name HG1# ))   ( (resid   4 and name HD1# ))     4.00  2.20  3.00
 assign ((resid   3 and name HG1# ))   ( (resid  17 and name HG1# ))     4.00  2.20  3.00
 assign ((resid   3 and name HG1# ))   ( (resid  17 and name HG2# ))     4.00  2.20  3.00
 assign ((resid   3 and name HG1# ))   ( (resid  19 and name HD2# ))     4.00  2.20  3.00
 assign ((resid   3 and name HG1# ))   ( (resid  82 and name HN   ))     4.00  2.20  2.00
 assign ((resid   3 and name HG1# ))   ( (resid  82 and name HB2  ))     4.00  2.20  2.00
 assign ((resid   3 and name HG1# ))   ( (resid  82 and name HB1  ))     4.00  2.20  2.00
 assign ((resid   3 and name HG1# ))   ( (resid  82 and name HD#  ))     4.00  2.20  4.00
 assign ((resid   3 and name HG2# ))   ( (resid   3 and name HD1# ))     4.00  2.20  3.00
 assign ((resid   3 and name HG2# ))   ( (resid   4 and name HN   ))     4.00  2.20  2.00
 assign ((resid   3 and name HG2# ))   ( (resid   4 and name HA   ))     4.00  2.20  2.00
 assign ((resid   3 and name HG2# ))   ( (resid   4 and name HG1# ))     4.00  2.20  3.00
 assign ((resid   3 and name HG2# ))   ( (resid   5 and name HN   ))     4.00  2.20  2.00
 assign ((resid   3 and name HG2# ))   ( (resid   6 and name HN   ))     4.00  2.20  2.00
 assign ((resid   3 and name HG2# ))   ( (resid   6 and name HG1# ))     4.00  2.20  3.00
 assign ((resid   3 and name HG2# ))   ( (resid  18 and name HN   ))     4.00  2.20  2.00
 assign ((resid   3 and name HD1# ))   ( (resid  79 and name HA   ))     4.00  2.20  2.00
 assign ((resid   3 and name HD1# ))   ( (resid  79 and name HG2  ))     4.00  2.20  2.00
 assign ((resid   3 and name HD1# ))   ( (resid  79 and name HG1  ))     4.00  2.20  2.00
 assign ((resid   3 and name HD1# ))   ( (resid  82 and name HN   ))     4.00  2.20  2.00
 assign ((resid   3 and name HD1# ))   ( (resid  82 and name HB2  ))     4.00  2.20  2.00
 assign ((resid   3 and name HD1# ))   ( (resid  82 and name HB1  ))     4.00  2.20  2.00
 assign ((resid   3 and name HD1# ))   ( (resid  82 and name HD#  ))     4.00  2.20  4.00
 assign ((resid   3 and name HD1# ))   ( (resid  82 and name HE#  ))     4.00  2.20  4.00
 assign ((resid   3 and name HD1# ))   ( (resid  82 and name HZ   ))     4.00  2.20  2.00
 assign ((resid   4 and name HN   ))   ( (resid   4 and name HA   ))     4.00  2.20  1.00
 assign ((resid   4 and name HN   ))   ( (resid   4 and name HB   ))     3.00  1.20  0.50
 assign ((resid   4 and name HN   ))   ( (resid   4 and name HG12 ))     4.00  2.20  1.00
 assign ((resid   4 and name HN   ))   ( (resid   4 and name HG11 ))     4.00  2.20  1.00
 assign ((resid   4 and name HN   ))   ( (resid   4 and name HG2# ))     4.00  2.20  2.00
 assign ((resid   4 and name HN   ))   ( (resid   4 and name HD1# ))     4.00  2.20  2.00
 assign ((resid   4 and name HN   ))   ( (resid   5 and name HN   ))     3.00  1.20  0.50
 assign ((resid   4 and name HN   ))   ( (resid  18 and name HB   ))     4.00  2.20  1.00
 assign ((resid   4 and name HN   ))   ( (resid  19 and name HA   ))     4.00  2.20  1.00
 assign ((resid   4 and name HN   ))   ( (resid  19 and name HD2# ))     4.00  2.20  2.00
 assign ((resid   4 and name HA   ))   ( (resid   4 and name HG12 ))     4.00  2.20  1.00
 assign ((resid   4 and name HA   ))   ( (resid   4 and name HG11 ))     4.00  2.20  1.00
 assign ((resid   4 and name HA   ))   ( (resid   4 and name HG2# ))     4.00  2.20  1.60
 assign ((resid   4 and name HA   ))   ( (resid   4 and name HD1# ))     4.00  2.20  2.00
 assign ((resid   4 and name HA   ))   ( (resid   5 and name HN   ))     4.00  2.20  1.00
 assign ((resid   4 and name HB   ))   ( (resid   4 and name HD1# ))     4.00  2.20  2.00
 assign ((resid   4 and name HB   ))   ( (resid   5 and name HN   ))     4.00  2.20  1.00
 assign ((resid   4 and name HB   ))   ( (resid   5 and name HB#  ))     4.00  2.20  2.00
 assign ((resid   4 and name HB   ))   ( (resid  18 and name HB   ))     4.00  2.20  1.00
 assign ((resid   4 and name HB   ))   ( (resid  18 and name HG2# ))     4.00  2.20  2.00
 assign ((resid   4 and name HG1# ))   ( (resid   4 and name HG2# ))     4.00  2.20  3.00
 assign ((resid   4 and name HG12 ))   ( (resid   5 and name HN   ))     4.00  2.20  1.00
 assign ((resid   4 and name HG11 ))   ( (resid   5 and name HN   ))     4.00  2.20  1.00
 assign ((resid   4 and name HG12 ))   ( (resid  18 and name HG2# ))     4.00  2.20  2.00
 assign ((resid   4 and name HG11 ))   ( (resid  18 and name HG2# ))     4.00  2.20  2.00
 assign ((resid   4 and name HG12 ))   ( (resid  20 and name HN   ))     4.00  2.20  1.00
 assign ((resid   4 and name HG11 ))   ( (resid  20 and name HN   ))     4.00  2.20  1.00
 assign ((resid   4 and name HG12 ))   ( (resid  20 and name HA   ))     4.00  2.20  1.00
 assign ((resid   4 and name HG11 ))   ( (resid  20 and name HA   ))     4.00  2.20  1.00
 assign ((resid   4 and name HG2# ))   ( (resid   5 and name HN   ))     4.00  2.20  2.00
 assign ((resid   4 and name HG2# ))   ( (resid   5 and name HB#  ))     4.00  2.20  3.00
 assign ((resid   4 and name HG2# ))   ( (resid  18 and name HB   ))     4.00  2.20  2.00
 assign ((resid   4 and name HG2# ))   ( (resid  18 and name HG2# ))     4.00  2.20  3.00
 assign ((resid   4 and name HD1# ))   ( (resid  18 and name HG2# ))     4.00  2.20  3.00
 assign ((resid   4 and name HD1# ))   ( (resid  20 and name HN   ))     4.00  2.20  2.00
 assign ((resid   4 and name HD1# ))   ( (resid  20 and name HA   ))     4.00  2.20  2.00
 assign ((resid   4 and name HD1# ))   ( (resid  20 and name HB#  ))     4.00  2.20  3.00
 assign ((resid   5 and name HN   ))   ( (resid   5 and name HA   ))     3.00  1.20  0.50
 assign ((resid   5 and name HN   ))   ( (resid   5 and name HB#  ))     4.00  2.20  2.00
 assign ((resid   5 and name HN   ))   ( (resid  17 and name HA   ))     4.00  2.20  1.00
 assign ((resid   5 and name HN   ))   ( (resid  18 and name HN   ))     4.00  2.20  1.00
 assign ((resid   5 and name HN   ))   ( (resid  18 and name HA   ))     4.00  2.20  1.00
 assign ((resid   5 and name HN   ))   ( (resid  18 and name HB   ))     3.00  1.20  0.50
 assign ((resid   5 and name HN   ))   ( (resid  18 and name HG2# ))     4.00  2.20  2.00
 assign ((resid   5 and name HA   ))   ( (resid   6 and name HN   ))     4.00  2.20  1.00
 assign ((resid   5 and name HB#  ))   ( (resid   6 and name HN   ))     4.00  2.20  2.00
 assign ((resid   5 and name HB#  ))   ( (resid  18 and name HG2# ))     4.00  2.20  3.00
 assign ((resid   6 and name HN   ))   ( (resid   6 and name HA   ))     3.00  1.20  0.50
 assign ((resid   6 and name HN   ))   ( (resid   6 and name HB   ))     3.00  1.20  0.50
 assign ((resid   6 and name HN   ))   ( (resid   6 and name HG1# ))     4.00  2.20  2.00
 assign ((resid   6 and name HN   ))   ( (resid   6 and name HG2# ))     4.00  2.20  2.00
 assign ((resid   6 and name HN   ))   ( (resid   6 and name HD1# ))     4.00  2.20  2.00
 assign ((resid   6 and name HA   ))   ( (resid   7 and name HN   ))     2.50  0.70  0.40
 assign ((resid   6 and name HB   ))   ( (resid   6 and name HD1# ))     4.00  2.20  2.00
 assign ((resid   6 and name HB   ))   ( (resid   7 and name HN   ))     4.00  2.20  1.00
 assign ((resid   6 and name HG12 ))   ( (resid   6 and name HG2# ))     4.00  2.20  2.00
 assign ((resid   6 and name HG11 ))   ( (resid   6 and name HG2# ))     4.00  2.20  2.00
 assign ((resid   6 and name HG1# ))   ( (resid  15 and name HB#  ))     4.00  2.20  3.00
 assign ((resid   6 and name HG1# ))   ( (resid  17 and name HG1# ))     4.00  2.20  3.00
 assign ((resid   6 and name HG2# ))   ( (resid   7 and name HN   ))     4.00  2.20  2.00
 assign ((resid   6 and name HG2# ))   ( (resid   7 and name HB#  ))     4.00  2.20  3.00
 assign ((resid   6 and name HG2# ))   ( (resid   8 and name HN   ))     4.00  2.20  2.00
 assign ((resid   6 and name HG2# ))   ( (resid  15 and name HB#  ))     4.00  2.20  3.00
 assign ((resid   6 and name HG2# ))   ( (resid  15 and name HG2  ))     4.00  2.20  2.00
 assign ((resid   6 and name HG2# ))   ( (resid  15 and name HG1  ))     4.00  2.20  2.00
 assign ((resid   6 and name HG2# ))   ( (resid  15 and name HE#  ))     4.00  2.20  3.00
 assign ((resid   6 and name HG2# ))   ( (resid  16 and name HN   ))     4.00  2.20  2.00
 assign ((resid   6 and name HD1# ))   ( (resid   7 and name HN   ))     4.00  2.20  2.00
 assign ((resid   7 and name HN   ))   ( (resid   7 and name HA   ))     4.00  2.20  1.00
 assign ((resid   7 and name HN   ))   ( (resid   7 and name HB2  ))     4.00  2.20  1.00
 assign ((resid   7 and name HN   ))   ( (resid   7 and name HB1  ))     4.00  2.20  1.00
 assign ((resid   7 and name HN   ))   ( (resid  15 and name HB#  ))     4.00  2.20  2.00
 assign ((resid   7 and name HN   ))   ( (resid  16 and name HN   ))     4.00  2.20  1.00
 assign ((resid   7 and name HA   ))   ( (resid   8 and name HN   ))     2.50  0.70  0.40
 assign ((resid   7 and name HB2  ))   ( (resid   8 and name HN   ))     4.00  2.20  1.00
 assign ((resid   7 and name HB1  ))   ( (resid   8 and name HN   ))     4.00  2.20  1.00
 assign ((resid   7 and name HB2  ))   ( (resid  16 and name HB#  ))     4.00  2.20  2.00
 assign ((resid   7 and name HB1  ))   ( (resid  16 and name HB#  ))     4.00  2.20  2.00
 assign ((resid   7 and name HB#  ))   ( (resid  16 and name HD#  ))     4.00  2.20  3.00
 assign ((resid   8 and name HN   ))   ( (resid   8 and name HA   ))     3.00  1.20  0.50
 assign ((resid   8 and name HN   ))   ( (resid   8 and name HB2  ))     3.00  1.20  0.50
 assign ((resid   8 and name HN   ))   ( (resid   8 and name HB1  ))     3.00  1.20  0.50
 assign ((resid   8 and name HN   ))   ( (resid   8 and name HG#  ))     4.00  2.20  2.00
 assign ((resid   8 and name HN   ))   ( (resid   9 and name HG2# ))     4.00  2.20  2.00
 assign ((resid   8 and name HA   ))   ( (resid   9 and name HN   ))     2.50  0.70  0.40
 assign ((resid   8 and name HB2  ))   ( (resid   9 and name HN   ))     3.00  1.20  0.50
 assign ((resid   8 and name HB1  ))   ( (resid   9 and name HN   ))     3.00  1.20  0.50
 assign ((resid   8 and name HG#  ))   ( (resid   9 and name HN   ))     4.00  2.20  2.00
 assign ((resid   9 and name HN   ))   ( (resid   9 and name HA   ))     4.00  2.20  1.00
 assign ((resid   9 and name HN   ))   ( (resid   9 and name HG2# ))     4.00  2.20  2.00
 assign ((resid   9 and name HN   ))   ( (resid  10 and name HA   ))     4.00  2.20  1.00
 assign ((resid   9 and name HN   ))   ( (resid  10 and name HD2  ))     4.00  2.20  1.00
 assign ((resid   9 and name HN   ))   ( (resid  10 and name HD1  ))     4.00  2.20  1.00
 assign ((resid   9 and name HB   ))   ( (resid  11 and name HN   ))     4.00  2.20  1.00
 assign ((resid   9 and name HG2# ))   ( (resid  10 and name HA   ))     4.00  2.20  2.00
 assign ((resid   9 and name HG2# ))   ( (resid  10 and name HB#  ))     4.00  2.20  3.00
 assign ((resid   9 and name HG2# ))   ( (resid  10 and name HD#  ))     4.00  2.20  3.00
 assign ((resid   9 and name HG2# ))   ( (resid  11 and name HN   ))     4.00  2.20  2.00
 assign ((resid  10 and name HA   ))   ( (resid  11 and name HN   ))     4.00  2.20  1.00
 assign ((resid  10 and name HB2  ))   ( (resid  11 and name HN   ))     4.00  2.20  1.00
 assign ((resid  10 and name HB1  ))   ( (resid  11 and name HN   ))     4.00  2.20  1.00
 assign ((resid  10 and name HG2  ))   ( (resid  11 and name HN   ))     4.00  2.20  1.00
 assign ((resid  10 and name HG1  ))   ( (resid  11 and name HN   ))     4.00  2.20  1.00
 assign ((resid  10 and name HD2  ))   ( (resid  11 and name HN   ))     4.00  2.20  1.00
 assign ((resid  10 and name HD1  ))   ( (resid  11 and name HN   ))     4.00  2.20  1.00
 assign ((resid  10 and name HD#  ))   ( (resid  11 and name HB#  ))     4.00  2.20  3.00
 assign ((resid  11 and name HN   ))   ( (resid  11 and name HA   ))     4.00  2.20  1.00
 assign ((resid  11 and name HN   ))   ( (resid  11 and name HB2  ))     3.00  1.20  0.50
 assign ((resid  11 and name HN   ))   ( (resid  11 and name HB1  ))     3.00  1.20  0.50
 assign ((resid  11 and name HB2  ))   ( (resid  11 and name HD21 ))     4.00  2.20  1.00
 assign ((resid  11 and name HB1  ))   ( (resid  11 and name HD21 ))     4.00  2.20  1.00
 assign ((resid  12 and name HA   ))   ( (resid  14 and name HN   ))     4.00  2.20  1.00
 assign ((resid  12 and name HA   ))   ( (resid  71 and name HE1  ))     4.00  2.20  1.00
 assign ((resid  12 and name HB#  ))   ( (resid  12 and name HD2  ))     4.00  2.20  2.00
 assign ((resid  12 and name HD2  ))   ( (resid  71 and name HE1  ))     4.00  2.20  1.00
 assign ((resid  13 and name HN   ))   ( (resid  13 and name HA   ))     4.00  2.20  1.00
 assign ((resid  13 and name HN   ))   ( (resid  13 and name HB2  ))     4.00  2.20  1.00
 assign ((resid  13 and name HN   ))   ( (resid  13 and name HB1  ))     4.00  2.20  1.00
 assign ((resid  13 and name HN   ))   ( (resid  14 and name HN   ))     3.00  1.20  0.50
 assign ((resid  13 and name HA   ))   ( (resid  14 and name HN   ))     4.00  2.20  1.00
 assign ((resid  13 and name HA   ))   ( (resid  65 and name HN   ))     4.00  2.20  1.00
 assign ((resid  13 and name HA   ))   ( (resid  71 and name HE1  ))     4.00  2.20  1.00
 assign ((resid  13 and name HB2  ))   ( (resid  13 and name HD21 ))     4.00  2.20  1.00
 assign ((resid  13 and name HB2  ))   ( (resid  13 and name HD22 ))     4.00  2.20  1.00
 assign ((resid  13 and name HB1  ))   ( (resid  13 and name HD21 ))     4.00  2.20  1.00
 assign ((resid  13 and name HB1  ))   ( (resid  13 and name HD22 ))     4.00  2.20  1.00
 assign ((resid  13 and name HB#  ))   ( (resid  14 and name HN   ))     4.00  2.20  2.00
 assign ((resid  13 and name HB2  ))   ( (resid  65 and name HN   ))     4.00  2.20  1.00
 assign ((resid  13 and name HB1  ))   ( (resid  65 and name HN   ))     4.00  2.20  1.00
 assign ((resid  13 and name HD21 ))   ( (resid  67 and name HA   ))     4.00  2.20  1.00
 assign ((resid  13 and name HD22 ))   ( (resid  67 and name HA   ))     4.00  2.20  1.00
 assign ((resid  13 and name HD21 ))   ( (resid  67 and name HB#  ))     4.00  2.20  2.00
 assign ((resid  13 and name HD22 ))   ( (resid  67 and name HB#  ))     4.00  2.20  2.00
 assign ((resid  14 and name HN   ))   ( (resid  14 and name HA   ))     4.00  2.20  1.00
 assign ((resid  14 and name HN   ))   ( (resid  14 and name HB   ))     4.00  2.20  1.00
 assign ((resid  14 and name HN   ))   ( (resid  71 and name HZ2  ))     4.00  2.20  1.00
 assign ((resid  14 and name HA   ))   ( (resid  14 and name HG2# ))     4.00  2.20  1.60
 assign ((resid  14 and name HA   ))   ( (resid  15 and name HN   ))     3.00  1.20  0.50
 assign ((resid  14 and name HA   ))   ( (resid  15 and name HB#  ))     4.00  2.20  2.00
 assign ((resid  14 and name HA   ))   ( (resid  64 and name HA   ))     4.00  2.20  1.00
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 assign ((resid  75 and name HB#  ))   ( (resid  75 and name HD2# ))     4.00  2.20  3.00
 assign ((resid  75 and name HB#  ))   ( (resid  76 and name HD2  ))     4.00  2.20  2.00
 assign ((resid  75 and name HB#  ))   ( (resid  76 and name HD1  ))     4.00  2.20  2.00
 assign ((resid  75 and name HG   ))   ( (resid  76 and name HD#  ))     4.00  2.20  2.00
 assign ((resid  75 and name HD1# ))   ( (resid  76 and name HD#  ))     4.00  2.20  3.00
 assign ((resid  75 and name HD2# ))   ( (resid  76 and name HD#  ))     4.00  2.20  3.00
 assign ((resid  75 and name HD1# ))   ( (resid  78 and name HB   ))     4.00  2.20  2.00
 assign ((resid  75 and name HD2# ))   ( (resid  78 and name HB   ))     4.00  2.20  2.00
 assign ((resid  76 and name HA   ))   ( (resid  77 and name HN   ))     4.00  2.20  1.00
 assign ((resid  76 and name HA   ))   ( (resid  79 and name HN   ))     4.00  2.20  1.00
 assign ((resid  76 and name HA   ))   ( (resid  80 and name HN   ))     4.00  2.20  1.00
 assign ((resid  76 and name HB2  ))   ( (resid  77 and name HN   ))     4.00  2.20  1.00
 assign ((resid  76 and name HB1  ))   ( (resid  77 and name HN   ))     4.00  2.20  1.00
 assign ((resid  76 and name HG#  ))   ( (resid  77 and name HN   ))     4.00  2.20  2.00
 assign ((resid  76 and name HG#  ))   ( (resid  77 and name HD#  ))     4.00  2.20  3.00
 assign ((resid  76 and name HD2  ))   ( (resid  77 and name HN   ))     4.00  2.20  1.00
 assign ((resid  76 and name HD1  ))   ( (resid  77 and name HN   ))     4.00  2.20  1.00
 assign ((resid  77 and name HN   ))   ( (resid  77 and name HA   ))     3.00  1.20  0.50
 assign ((resid  77 and name HN   ))   ( (resid  77 and name HB2  ))     4.00  2.20  1.00
 assign ((resid  77 and name HN   ))   ( (resid  77 and name HB1  ))     4.00  2.20  1.00
 assign ((resid  77 and name HN   ))   ( (resid  77 and name HG2  ))     4.00  2.20  1.00
 assign ((resid  77 and name HN   ))   ( (resid  77 and name HG1  ))     4.00  2.20  1.00
 assign ((resid  77 and name HN   ))   ( (resid  77 and name HD#  ))     4.00  2.20  2.00
 assign ((resid  77 and name HN   ))   ( (resid  78 and name HN   ))     3.00  1.20  0.50
 assign ((resid  77 and name HN   ))   ( (resid  78 and name HG2# ))     4.00  2.20  2.00
 assign ((resid  77 and name HN   ))   ( (resid  79 and name HN   ))     4.00  2.20  1.00
 assign ((resid  77 and name HA   ))   ( (resid  77 and name HG2  ))     4.00  2.20  1.00
 assign ((resid  77 and name HA   ))   ( (resid  77 and name HG1  ))     4.00  2.20  1.00
 assign ((resid  77 and name HA   ))   ( (resid  77 and name HD2  ))     4.00  2.20  1.00
 assign ((resid  77 and name HA   ))   ( (resid  77 and name HD1  ))     4.00  2.20  1.00
 assign ((resid  77 and name HA   ))   ( (resid  78 and name HN   ))     4.00  2.20  1.00
 assign ((resid  77 and name HA   ))   ( (resid  80 and name HN   ))     4.00  2.20  1.00
 assign ((resid  77 and name HA   ))   ( (resid  80 and name HB#  ))     4.00  2.20  2.00
 assign ((resid  77 and name HB#  ))   ( (resid  77 and name HD2  ))     4.00  2.20  2.00
 assign ((resid  77 and name HB#  ))   ( (resid  77 and name HD1  ))     4.00  2.20  2.00
 assign ((resid  77 and name HB2  ))   ( (resid  78 and name HN   ))     4.00  2.20  1.00
 assign ((resid  77 and name HB1  ))   ( (resid  78 and name HN   ))     4.00  2.20  1.00
 assign ((resid  77 and name HB#  ))   ( (resid  78 and name HA   ))     4.00  2.20  2.00
 assign ((resid  77 and name HB#  ))   ( (resid  78 and name HG2# ))     4.00  2.20  3.00
 assign ((resid  77 and name HG2  ))   ( (resid  77 and name HE#  ))     4.00  2.20  2.00
 assign ((resid  77 and name HG1  ))   ( (resid  77 and name HE#  ))     4.00  2.20  2.00
 assign ((resid  78 and name HN   ))   ( (resid  78 and name HA   ))     4.00  2.20  1.00
 assign ((resid  78 and name HN   ))   ( (resid  78 and name HB   ))     3.00  1.20  0.50
 assign ((resid  78 and name HN   ))   ( (resid  78 and name HG1# ))     4.00  2.20  2.00
 assign ((resid  78 and name HN   ))   ( (resid  78 and name HG2# ))     4.00  2.20  2.00
 assign ((resid  78 and name HN   ))   ( (resid  79 and name HN   ))     3.00  1.20  0.50
 assign ((resid  78 and name HA   ))   ( (resid  78 and name HG1# ))     4.00  2.20  2.00
 assign ((resid  78 and name HA   ))   ( (resid  78 and name HG2# ))     4.00  2.20  2.00
 assign ((resid  78 and name HA   ))   ( (resid  79 and name HN   ))     4.00  2.20  1.00
 assign ((resid  78 and name HA   ))   ( (resid  81 and name HN   ))     4.00  2.20  1.00
 assign ((resid  78 and name HA   ))   ( (resid  81 and name HB   ))     4.00  2.20  1.00
 assign ((resid  78 and name HA   ))   ( (resid  81 and name HG1# ))     4.00  2.20  2.00
 assign ((resid  78 and name HA   ))   ( (resid  81 and name HG2# ))     4.00  2.20  2.00
 assign ((resid  78 and name HB   ))   ( (resid  79 and name HN   ))     3.00  1.20  0.50
 assign ((resid  78 and name HG1# ))   ( (resid  79 and name HN   ))     4.00  2.20  2.00
 assign ((resid  78 and name HG2# ))   ( (resid  79 and name HN   ))     4.00  2.20  2.00
 assign ((resid  78 and name HG1# ))   ( (resid  79 and name HA   ))     4.00  2.20  2.00
 assign ((resid  78 and name HG1# ))   ( (resid  81 and name HB   ))     4.00  2.20  2.00
 assign ((resid  78 and name HG1# ))   ( (resid  82 and name HD#  ))     4.00  2.20  4.00
 assign ((resid  78 and name HG1# ))   ( (resid  82 and name HE#  ))     4.00  2.20  4.00
 assign ((resid  78 and name HG1# ))   ( (resid  82 and name HZ   ))     4.00  2.20  2.00
 assign ((resid  79 and name HN   ))   ( (resid  79 and name HA   ))     4.00  2.20  1.00
 assign ((resid  79 and name HN   ))   ( (resid  79 and name HB#  ))     3.00  1.20  1.50
 assign ((resid  79 and name HN   ))   ( (resid  79 and name HG#  ))     4.00  2.20  2.00
 assign ((resid  79 and name HN   ))   ( (resid  80 and name HN   ))     3.00  1.20  0.50
 assign ((resid  79 and name HN   ))   ( (resid  80 and name HB#  ))     4.00  2.20  2.00
 assign ((resid  79 and name HA   ))   ( (resid  79 and name HG2  ))     4.00  2.20  1.00
 assign ((resid  79 and name HA   ))   ( (resid  79 and name HG1  ))     4.00  2.20  1.00
 assign ((resid  79 and name HA   ))   ( (resid  80 and name HN   ))     4.00  2.20  1.00
 assign ((resid  79 and name HA   ))   ( (resid  82 and name HN   ))     4.00  2.20  1.00
 assign ((resid  79 and name HA   ))   ( (resid  82 and name HD#  ))     4.00  2.20  3.00
 assign ((resid  79 and name HB#  ))   ( (resid  80 and name HN   ))     3.00  1.20  1.50
 assign ((resid  79 and name HG#  ))   ( (resid  82 and name HD#  ))     4.00  2.20  4.00
 assign ((resid  79 and name HG#  ))   ( (resid  83 and name HB2  ))     4.00  2.20  2.00
 assign ((resid  79 and name HG#  ))   ( (resid  83 and name HB1  ))     4.00  2.20  2.00
 assign ((resid  79 and name HG#  ))   ( (resid  83 and name HG#  ))     4.00  2.20  3.00
 assign ((resid  80 and name HN   ))   ( (resid  80 and name HA   ))     4.00  2.20  1.00
 assign ((resid  80 and name HN   ))   ( (resid  80 and name HB#  ))     4.00  2.20  1.60
 assign ((resid  80 and name HN   ))   ( (resid  81 and name HN   ))     3.00  1.20  0.50
 assign ((resid  80 and name HA   ))   ( (resid  81 and name HN   ))     4.00  2.20  1.00
 assign ((resid  80 and name HA   ))   ( (resid  83 and name HB2  ))     4.00  2.20  1.00
 assign ((resid  80 and name HA   ))   ( (resid  83 and name HB1  ))     4.00  2.20  1.00
 assign ((resid  80 and name HA   ))   ( (resid  83 and name HG#  ))     4.00  2.20  2.00
 assign ((resid  80 and name HB#  ))   ( (resid  81 and name HN   ))     4.00  2.20  2.00
 assign ((resid  80 and name HB#  ))   ( (resid  81 and name HA   ))     4.00  2.20  2.00
 assign ((resid  80 and name HB#  ))   ( (resid  83 and name HN   ))     4.00  2.20  2.00
 assign ((resid  81 and name HN   ))   ( (resid  81 and name HA   ))     3.00  1.20  0.50
 assign ((resid  81 and name HN   ))   ( (resid  81 and name HB   ))     3.00  1.20  0.50
 assign ((resid  81 and name HN   ))   ( (resid  81 and name HG1# ))     4.00  2.20  2.00
 assign ((resid  81 and name HN   ))   ( (resid  81 and name HG2# ))     4.00  2.20  2.00
 assign ((resid  81 and name HN   ))   ( (resid  82 and name HN   ))     3.00  1.20  0.50
 assign ((resid  81 and name HA   ))   ( (resid  81 and name HG1# ))     4.00  2.20  2.00
 assign ((resid  81 and name HA   ))   ( (resid  81 and name HG2# ))     4.00  2.20  2.00
 assign ((resid  81 and name HA   ))   ( (resid  82 and name HN   ))     4.00  2.20  1.00
 assign ((resid  81 and name HA   ))   ( (resid  84 and name HG   ))     4.00  2.20  1.00
 assign ((resid  81 and name HA   ))   ( (resid  84 and name HD1# ))     4.00  2.20  2.00
 assign ((resid  81 and name HA   ))   ( (resid  84 and name HD2# ))     4.00  2.20  2.00
 assign ((resid  81 and name HB   ))   ( (resid  82 and name HN   ))     4.00  2.20  1.00
 assign ((resid  81 and name HB   ))   ( (resid  82 and name HD#  ))     4.00  2.20  3.00
 assign ((resid  81 and name HB   ))   ( (resid  82 and name HE#  ))     4.00  2.20  3.00
 assign ((resid  81 and name HG1# ))   ( (resid  82 and name HN   ))     4.00  2.20  2.00
 assign ((resid  81 and name HG2# ))   ( (resid  82 and name HN   ))     4.00  2.20  2.00
 assign ((resid  82 and name HN   ))   ( (resid  82 and name HA   ))     3.00  1.20  0.50
 assign ((resid  82 and name HN   ))   ( (resid  82 and name HB2  ))     4.00  2.20  1.00
 assign ((resid  82 and name HN   ))   ( (resid  82 and name HB1  ))     4.00  2.20  1.00
 assign ((resid  82 and name HN   ))   ( (resid  82 and name HD#  ))     4.00  2.20  3.00
 assign ((resid  82 and name HN   ))   ( (resid  82 and name HZ   ))     4.00  2.20  1.00
 assign ((resid  82 and name HN   ))   ( (resid  83 and name HN   ))     3.00  1.20  0.50
 assign ((resid  82 and name HA   ))   ( (resid  82 and name HD#  ))     4.00  2.20  2.00
 assign ((resid  82 and name HA   ))   ( (resid  83 and name HN   ))     4.00  2.20  1.00
 assign ((resid  82 and name HB2  ))   ( (resid  82 and name HD#  ))     4.00  2.20  3.00
 assign ((resid  82 and name HB1  ))   ( (resid  82 and name HD#  ))     4.00  2.20  3.00
 assign ((resid  82 and name HB2  ))   ( (resid  83 and name HN   ))     4.00  2.20  1.00
 assign ((resid  82 and name HB1  ))   ( (resid  83 and name HN   ))     4.00  2.20  1.00
 assign ((resid  82 and name HD#  ))   ( (resid  83 and name HN   ))     4.00  2.20  3.00
 assign ((resid  83 and name HN   ))   ( (resid  83 and name HA   ))     4.00  2.20  1.00
 assign ((resid  83 and name HN   ))   ( (resid  83 and name HB2  ))     4.00  2.20  1.00
 assign ((resid  83 and name HN   ))   ( (resid  83 and name HB1  ))     4.00  2.20  1.00
 assign ((resid  83 and name HN   ))   ( (resid  83 and name HG#  ))     4.00  2.20  2.00
 assign ((resid  83 and name HN   ))   ( (resid  84 and name HN   ))     3.00  1.20  0.50
 assign ((resid  83 and name HN   ))   ( (resid  84 and name HG   ))     4.00  2.20  1.00
 assign ((resid  83 and name HN   ))   ( (resid  84 and name HD2# ))     4.00  2.20  2.00
 assign ((resid  83 and name HA   ))   ( (resid  83 and name HG#  ))     4.00  2.20  2.00
 assign ((resid  83 and name HA   ))   ( (resid  84 and name HN   ))     3.00  1.20  0.50
 assign ((resid  83 and name HB2  ))   ( (resid  84 and name HN   ))     4.00  2.20  1.00
 assign ((resid  83 and name HB1  ))   ( (resid  84 and name HN   ))     4.00  2.20  1.00
 assign ((resid  83 and name HB#  ))   ( (resid  84 and name HB#  ))     4.00  2.20  3.00
 assign ((resid  83 and name HG#  ))   ( (resid  84 and name HN   ))     4.00  2.20  2.00
 assign ((resid  84 and name HN   ))   ( (resid  84 and name HA   ))     3.00  1.20  0.50
 assign ((resid  84 and name HN   ))   ( (resid  84 and name HB2  ))     4.00  2.20  1.00
 assign ((resid  84 and name HN   ))   ( (resid  84 and name HB1  ))     4.00  2.20  1.00
 assign ((resid  84 and name HN   ))   ( (resid  84 and name HG   ))     4.00  2.20  1.00
 assign ((resid  84 and name HN   ))   ( (resid  84 and name HD2# ))     4.00  2.20  2.00
 assign ((resid  84 and name HN   ))   ( (resid  85 and name HN   ))     3.00  1.20  0.50
 assign ((resid  84 and name HA   ))   ( (resid  84 and name HG   ))     4.00  2.20  1.00
 assign ((resid  84 and name HA   ))   ( (resid  84 and name HD1# ))     4.00  2.20  2.00
 assign ((resid  84 and name HA   ))   ( (resid  84 and name HD2# ))     4.00  2.20  2.00
 assign ((resid  84 and name HA   ))   ( (resid  85 and name HN   ))     3.00  1.20  0.50
 assign ((resid  84 and name HB2  ))   ( (resid  84 and name HD1# ))     4.00  2.20  2.00
 assign ((resid  84 and name HB2  ))   ( (resid  84 and name HD2# ))     4.00  2.20  2.00
 assign ((resid  84 and name HB1  ))   ( (resid  84 and name HD1# ))     4.00  2.20  2.00
 assign ((resid  84 and name HB1  ))   ( (resid  84 and name HD2# ))     4.00  2.20  2.00
 assign ((resid  84 and name HB2  ))   ( (resid  85 and name HN   ))     4.00  2.20  1.00
 assign ((resid  84 and name HB1  ))   ( (resid  85 and name HN   ))     4.00  2.20  1.00
 assign ((resid  84 and name HD2# ))   ( (resid  85 and name HN   ))     4.00  2.20  2.00
 assign ((resid  85 and name HN   ))   ( (resid  85 and name HA   ))     3.00  1.20  0.50
 assign ((resid  85 and name HN   ))   ( (resid  85 and name HB#  ))     3.00  1.20  1.50
 assign ((resid  85 and name HN   ))   ( (resid  85 and name HG#  ))     4.00  2.20  2.00
 assign ((resid  85 and name HA   ))   ( (resid  85 and name HG#  ))     4.00  2.20  2.00
 assign ((resid  85 and name HA   ))   ( (resid  86 and name HN   ))     4.00  2.20  1.00
 assign ((resid  85 and name HB#  ))   ( (resid  86 and name HN   ))     4.00  2.20  2.00
 assign ((resid  85 and name HG#  ))   ( (resid  86 and name HN   ))     4.00  2.20  2.00
 assign ((resid  86 and name HN   ))   ( (resid  86 and name HA   ))     4.00  2.20  1.00
 assign ((resid  86 and name HB#  ))   ( (resid  87 and name HN   ))     4.00  2.20  2.00
 assign ((resid  86 and name HB#  ))   ( (resid  87 and name HA   ))     4.00  2.20  2.00
 assign ((resid  87 and name HN   ))   ( (resid  87 and name HA   ))     4.00  2.20  1.00
!
! Dihedral angle constraints from HYPER
!
! ACO file produced by PDBStat
! Version:  5.4-exp Compiled 2011-04-01 on (troberto.site)
!
! dihedral angle restraints from HYPER
!
   assign (resid   2 and name C   )   (resid   3 and name N   )
          (resid   3 and name CA  )   (resid   3 and name C   )   1.0    -40.00   130.00   2 
   assign (resid   3 and name C   )   (resid   4 and name N   )
          (resid   4 and name CA  )   (resid   4 and name C   )   1.0   -120.00    35.00   2 
   assign (resid   4 and name C   )   (resid   5 and name N   )
          (resid   5 and name CA  )   (resid   5 and name C   )   1.0    -35.00   145.00   2 
   assign (resid   5 and name C   )   (resid   6 and name N   )
          (resid   6 and name CA  )   (resid   6 and name C   )   1.0    -42.50   117.50   2 
   assign (resid   6 and name C   )   (resid   7 and name N   )
          (resid   7 and name CA  )   (resid   7 and name C   )   1.0    -47.50   112.50   2 
   assign (resid   8 and name C   )   (resid   9 and name N   )
          (resid   9 and name CA  )   (resid   9 and name C   )   1.0   -120.00    40.00   2 
   assign (resid  10 and name C   )   (resid  11 and name N   )
          (resid  11 and name CA  )   (resid  11 and name C   )   1.0   -120.00    40.00   2 
   assign (resid  12 and name C   )   (resid  13 and name N   )
          (resid  13 and name CA  )   (resid  13 and name C   )   1.0    -40.00   125.00   2 
   assign (resid  13 and name C   )   (resid  14 and name N   )
          (resid  14 and name CA  )   (resid  14 and name C   )   1.0   -120.00    40.00   2 
   assign (resid  14 and name N   )   (resid  14 and name CA  )
          (resid  14 and name C   )   (resid  15 and name N   )   1.0    120.00    60.00   2 
   assign (resid  14 and name C   )   (resid  15 and name N   )
          (resid  15 and name CA  )   (resid  15 and name C   )   1.0   -120.00    35.00   2 
   assign (resid  15 and name N   )   (resid  15 and name CA  )
          (resid  15 and name C   )   (resid  16 and name N   )   1.0    120.00    60.00   2 
   assign (resid  15 and name C   )   (resid  16 and name N   )
          (resid  16 and name CA  )   (resid  16 and name C   )   1.0   -120.00    40.00   2 
   assign (resid  16 and name N   )   (resid  16 and name CA  )
          (resid  16 and name C   )   (resid  17 and name N   )   1.0    120.00    60.00   2 
   assign (resid  16 and name C   )   (resid  17 and name N   )
          (resid  17 and name CA  )   (resid  17 and name C   )   1.0   -120.00    40.00   2 
   assign (resid  17 and name N   )   (resid  17 and name CA  )
          (resid  17 and name C   )   (resid  18 and name N   )   1.0    120.00    60.00   2 
   assign (resid  17 and name C   )   (resid  18 and name N   )
          (resid  18 and name CA  )   (resid  18 and name C   )   1.0    -42.50   122.50   2 
   assign (resid  18 and name C   )   (resid  19 and name N   )
          (resid  19 and name CA  )   (resid  19 and name C   )   1.0   -120.00    40.00   2 
   assign (resid  19 and name C   )   (resid  20 and name N   )
          (resid  20 and name CA  )   (resid  20 and name C   )   1.0     60.00   135.00   2 
   assign (resid  20 and name C   )   (resid  21 and name N   )
          (resid  21 and name CA  )   (resid  21 and name C   )   1.0    -42.50   122.50   2 
   assign (resid  21 and name C   )   (resid  22 and name N   )
          (resid  22 and name CA  )   (resid  22 and name C   )   1.0    -42.50   122.50   2 
   assign (resid  22 and name C   )   (resid  23 and name N   )
          (resid  23 and name CA  )   (resid  23 and name C   )   1.0    -37.50   142.50   2 
   assign (resid  23 and name C   )   (resid  24 and name N   )
          (resid  24 and name CA  )   (resid  24 and name C   )   1.0    -37.50   142.50   2 
   assign (resid  25 and name C   )   (resid  26 and name N   )
          (resid  26 and name CA  )   (resid  26 and name C   )   1.0    -42.50   117.50   2 
   assign (resid  26 and name C   )   (resid  27 and name N   )
          (resid  27 and name CA  )   (resid  27 and name C   )   1.0    -40.00   140.00   2 
   assign (resid  27 and name C   )   (resid  28 and name N   )
          (resid  28 and name CA  )   (resid  28 and name C   )   1.0    -37.50   132.50   2 
   assign (resid  28 and name C   )   (resid  29 and name N   )
          (resid  29 and name CA  )   (resid  29 and name C   )   1.0   -125.00    55.00   2 
   assign (resid  29 and name N   )   (resid  29 and name CA  )
          (resid  29 and name C   )   (resid  30 and name N   )   1.0    120.00    60.00   2 
   assign (resid  29 and name C   )   (resid  30 and name N   )
          (resid  30 and name CA  )   (resid  30 and name C   )   1.0   -120.00    35.00   2 
   assign (resid  30 and name N   )   (resid  30 and name CA  )
          (resid  30 and name C   )   (resid  31 and name N   )   1.0    120.00    60.00   2 
   assign (resid  30 and name C   )   (resid  31 and name N   )
          (resid  31 and name CA  )   (resid  31 and name C   )   1.0   -120.00    35.00   2 
   assign (resid  31 and name N   )   (resid  31 and name CA  )
          (resid  31 and name C   )   (resid  32 and name N   )   1.0    120.00    60.00   2 
   assign (resid  31 and name C   )   (resid  32 and name N   )
          (resid  32 and name CA  )   (resid  32 and name C   )   1.0   -120.00    25.00   2 
   assign (resid  32 and name C   )   (resid  33 and name N   )
          (resid  33 and name CA  )   (resid  33 and name C   )   1.0    -40.00   130.00   2 
   assign (resid  33 and name C   )   (resid  34 and name N   )
          (resid  34 and name CA  )   (resid  34 and name C   )   1.0     60.00   140.00   2 
   assign (resid  34 and name C   )   (resid  35 and name N   )
          (resid  35 and name CA  )   (resid  35 and name C   )   1.0    -37.50   132.50   2 
   assign (resid  39 and name C   )   (resid  40 and name N   )
          (resid  40 and name CA  )   (resid  40 and name C   )   1.0     60.00   120.00   2 
   assign (resid  40 and name C   )   (resid  41 and name N   )
          (resid  41 and name CA  )   (resid  41 and name C   )   1.0     60.00   125.00   2 
   assign (resid  42 and name C   )   (resid  43 and name N   )
          (resid  43 and name CA  )   (resid  43 and name C   )   1.0    -62.50    12.50   2 
   assign (resid  43 and name N   )   (resid  43 and name CA  )
          (resid  43 and name C   )   (resid  44 and name N   )   1.0    -35.00    40.00   2 
   assign (resid  43 and name C   )   (resid  44 and name N   )
          (resid  44 and name CA  )   (resid  44 and name C   )   1.0    -47.50    17.50   2 
   assign (resid  44 and name N   )   (resid  44 and name CA  )
          (resid  44 and name C   )   (resid  45 and name N   )   1.0    -35.00    40.00   2 
   assign (resid  44 and name C   )   (resid  45 and name N   )
          (resid  45 and name CA  )   (resid  45 and name C   )   1.0    -65.00    35.00   2 
   assign (resid  45 and name N   )   (resid  45 and name CA  )
          (resid  45 and name C   )   (resid  46 and name N   )   1.0    -35.00    40.00   2 
   assign (resid  45 and name C   )   (resid  46 and name N   )
          (resid  46 and name CA  )   (resid  46 and name C   )   1.0    -65.00    35.00   2 
   assign (resid  46 and name N   )   (resid  46 and name CA  )
          (resid  46 and name C   )   (resid  47 and name N   )   1.0    -35.00    40.00   2 
   assign (resid  46 and name C   )   (resid  47 and name N   )
          (resid  47 and name CA  )   (resid  47 and name C   )   1.0    -85.00    15.00   2 
   assign (resid  47 and name N   )   (resid  47 and name CA  )
          (resid  47 and name C   )   (resid  48 and name N   )   1.0    -35.00    40.00   2 
   assign (resid  47 and name C   )   (resid  48 and name N   )
          (resid  48 and name CA  )   (resid  48 and name C   )   1.0    -35.00   145.00   2 
   assign (resid  48 and name C   )   (resid  49 and name N   )
          (resid  49 and name CA  )   (resid  49 and name C   )   1.0     60.00   135.00   2 
   assign (resid  50 and name C   )   (resid  51 and name N   )
          (resid  51 and name CA  )   (resid  51 and name C   )   1.0    -40.00   140.00   2 
   assign (resid  51 and name C   )   (resid  52 and name N   )
          (resid  52 and name CA  )   (resid  52 and name C   )   1.0    -42.50   117.50   2 
   assign (resid  52 and name C   )   (resid  53 and name N   )
          (resid  53 and name CA  )   (resid  53 and name C   )   1.0   -125.00    55.00   2 
   assign (resid  53 and name N   )   (resid  53 and name CA  )
          (resid  53 and name C   )   (resid  54 and name N   )   1.0    120.00    60.00   2 
   assign (resid  53 and name C   )   (resid  54 and name N   )
          (resid  54 and name CA  )   (resid  54 and name C   )   1.0   -120.00    35.00   2 
   assign (resid  54 and name N   )   (resid  54 and name CA  )
          (resid  54 and name C   )   (resid  55 and name N   )   1.0    120.00    60.00   2 
   assign (resid  54 and name C   )   (resid  55 and name N   )
          (resid  55 and name CA  )   (resid  55 and name C   )   1.0   -120.00    35.00   2 
   assign (resid  55 and name N   )   (resid  55 and name CA  )
          (resid  55 and name C   )   (resid  56 and name N   )   1.0    120.00    60.00   2 
   assign (resid  55 and name C   )   (resid  56 and name N   )
          (resid  56 and name CA  )   (resid  56 and name C   )   1.0   -120.00    40.00   2 
   assign (resid  56 and name N   )   (resid  56 and name CA  )
          (resid  56 and name C   )   (resid  57 and name N   )   1.0    120.00    60.00   2 
   assign (resid  56 and name C   )   (resid  57 and name N   )
          (resid  57 and name CA  )   (resid  57 and name C   )   1.0    -40.00   135.00   2 
   assign (resid  57 and name C   )   (resid  58 and name N   )
          (resid  58 and name CA  )   (resid  58 and name C   )   1.0    -40.00   140.00   2 
   assign (resid  58 and name C   )   (resid  59 and name N   )
          (resid  59 and name CA  )   (resid  59 and name C   )   1.0   -120.00    40.00   2 
   assign (resid  60 and name C   )   (resid  61 and name N   )
          (resid  61 and name CA  )   (resid  61 and name C   )   1.0   -120.00    35.00   2 
   assign (resid  61 and name N   )   (resid  61 and name CA  )
          (resid  61 and name C   )   (resid  62 and name N   )   1.0    120.00    60.00   2 
   assign (resid  61 and name C   )   (resid  62 and name N   )
          (resid  62 and name CA  )   (resid  62 and name C   )   1.0   -120.00    35.00   2 
   assign (resid  62 and name N   )   (resid  62 and name CA  )
          (resid  62 and name C   )   (resid  63 and name N   )   1.0    120.00    60.00   2 
   assign (resid  62 and name C   )   (resid  63 and name N   )
          (resid  63 and name CA  )   (resid  63 and name C   )   1.0   -120.00    40.00   2 
   assign (resid  63 and name N   )   (resid  63 and name CA  )
          (resid  63 and name C   )   (resid  64 and name N   )   1.0    120.00    60.00   2 
   assign (resid  63 and name C   )   (resid  64 and name N   )
          (resid  64 and name CA  )   (resid  64 and name C   )   1.0   -125.00    55.00   2 
   assign (resid  64 and name N   )   (resid  64 and name CA  )
          (resid  64 and name C   )   (resid  65 and name N   )   1.0    120.00    60.00   2 
   assign (resid  68 and name C   )   (resid  69 and name N   )
          (resid  69 and name CA  )   (resid  69 and name C   )   1.0    -42.50   122.50   2 
   assign (resid  69 and name C   )   (resid  70 and name N   )
          (resid  70 and name CA  )   (resid  70 and name C   )   1.0   -120.00    35.00   2 
   assign (resid  70 and name C   )   (resid  71 and name N   )
          (resid  71 and name CA  )   (resid  71 and name C   )   1.0    -65.00    35.00   2 
   assign (resid  71 and name N   )   (resid  71 and name CA  )
          (resid  71 and name C   )   (resid  72 and name N   )   1.0    -35.00    40.00   2 
   assign (resid  71 and name C   )   (resid  72 and name N   )
          (resid  72 and name CA  )   (resid  72 and name C   )   1.0    -55.00    15.00   2 
   assign (resid  72 and name N   )   (resid  72 and name CA  )
          (resid  72 and name C   )   (resid  73 and name N   )   1.0    -35.00    40.00   2 
   assign (resid  72 and name C   )   (resid  73 and name N   )
          (resid  73 and name CA  )   (resid  73 and name C   )   1.0    -80.00    20.00   2 
   assign (resid  73 and name N   )   (resid  73 and name CA  )
          (resid  73 and name C   )   (resid  74 and name N   )   1.0    -35.00    40.00   2 
   assign (resid  73 and name C   )   (resid  74 and name N   )
          (resid  74 and name CA  )   (resid  74 and name C   )   1.0    -65.00    35.00   2 
   assign (resid  74 and name N   )   (resid  74 and name CA  )
          (resid  74 and name C   )   (resid  75 and name N   )   1.0    -35.00    40.00   2 
   assign (resid  74 and name C   )   (resid  75 and name N   )
          (resid  75 and name CA  )   (resid  75 and name C   )   1.0    -65.00    35.00   2 
   assign (resid  75 and name N   )   (resid  75 and name CA  )
          (resid  75 and name C   )   (resid  76 and name N   )   1.0    -35.00    40.00   2 
   assign (resid  76 and name C   )   (resid  77 and name N   )
          (resid  77 and name CA  )   (resid  77 and name C   )   1.0    -80.00    20.00   2 
   assign (resid  77 and name N   )   (resid  77 and name CA  )
          (resid  77 and name C   )   (resid  78 and name N   )   1.0    -35.00    40.00   2 
   assign (resid  77 and name C   )   (resid  78 and name N   )
          (resid  78 and name CA  )   (resid  78 and name C   )   1.0    -65.00    35.00   2 
   assign (resid  78 and name N   )   (resid  78 and name CA  )
          (resid  78 and name C   )   (resid  79 and name N   )   1.0    -35.00    40.00   2 
   assign (resid  78 and name C   )   (resid  79 and name N   )
          (resid  79 and name CA  )   (resid  79 and name C   )   1.0    -52.50    17.50   2 
   assign (resid  79 and name N   )   (resid  79 and name CA  )
          (resid  79 and name C   )   (resid  80 and name N   )   1.0    -35.00    40.00   2 
   assign (resid  79 and name C   )   (resid  80 and name N   )
          (resid  80 and name CA  )   (resid  80 and name C   )   1.0    -52.50    17.50   2 
   assign (resid  80 and name N   )   (resid  80 and name CA  )
          (resid  80 and name C   )   (resid  81 and name N   )   1.0    -35.00    40.00   2 
   assign (resid  80 and name C   )   (resid  81 and name N   )
          (resid  81 and name CA  )   (resid  81 and name C   )   1.0     60.00   135.00   2 
   assign (resid  81 and name C   )   (resid  82 and name N   )
          (resid  82 and name CA  )   (resid  82 and name C   )   1.0    -40.00   130.00   2 
   assign (resid  82 and name C   )   (resid  83 and name N   )
          (resid  83 and name CA  )   (resid  83 and name C   )   1.0    -40.00   135.00   2 
   assign (resid  83 and name C   )   (resid  84 and name N   )
          (resid  84 and name CA  )   (resid  84 and name C   )   1.0    -40.00   140.00   2 
   assign (resid  84 and name C   )   (resid  85 and name N   )
          (resid  85 and name CA  )   (resid  85 and name C   )   1.0    -37.50   142.50   2 
! 
! dihedral angle restraints from AutoStructure
!
   assign (resid   1 and name C   )   (resid   2 and name N   )
          (resid   2 and name CA  )   (resid   2 and name C   )   1.0   -123.61    60.40   2 
   assign (resid   2 and name N   )   (resid   2 and name CA  )
          (resid   2 and name C   )   (resid   3 and name N   )   1.0   -169.12   145.66   2 
   assign (resid   4 and name C   )   (resid   5 and name N   )
          (resid   5 and name CA  )   (resid   5 and name C   )   1.0   -147.80   115.00   2 
   assign (resid   5 and name N   )   (resid   5 and name CA  )
          (resid   5 and name C   )   (resid   6 and name N   )   1.0    178.49   112.11   2 
   assign (resid   5 and name C   )   (resid   6 and name N   )
          (resid   6 and name CA  )   (resid   6 and name C   )   1.0   -110.70    90.24   2 
   assign (resid   6 and name N   )   (resid   6 and name CA  )
          (resid   6 and name C   )   (resid   7 and name N   )   1.0   -174.19   112.73   2 
   assign (resid  13 and name C   )   (resid  14 and name N   )
          (resid  14 and name CA  )   (resid  14 and name C   )   1.0   -119.50    60.08   2 
   assign (resid  14 and name N   )   (resid  14 and name CA  )
          (resid  14 and name C   )   (resid  15 and name N   )   1.0   -177.00   101.06   2 
   assign (resid  14 and name C   )   (resid  15 and name N   )
          (resid  15 and name CA  )   (resid  15 and name C   )   1.0   -121.17    55.44   2 
   assign (resid  15 and name N   )   (resid  15 and name CA  )
          (resid  15 and name C   )   (resid  16 and name N   )   1.0   -168.64    98.75   2 
   assign (resid  15 and name C   )   (resid  16 and name N   )
          (resid  16 and name CA  )   (resid  16 and name C   )   1.0   -113.12    97.32   2 
   assign (resid  16 and name N   )   (resid  16 and name CA  )
          (resid  16 and name C   )   (resid  17 and name N   )   1.0   -174.18    98.65   2 
   assign (resid  16 and name C   )   (resid  17 and name N   )
          (resid  17 and name CA  )   (resid  17 and name C   )   1.0   -110.88    99.00   2 
   assign (resid  17 and name N   )   (resid  17 and name CA  )
          (resid  17 and name C   )   (resid  18 and name N   )   1.0   -170.46    91.82   2 
   assign (resid  17 and name C   )   (resid  18 and name N   )
          (resid  18 and name CA  )   (resid  18 and name C   )   1.0    -97.27    94.20   2 
   assign (resid  18 and name N   )   (resid  18 and name CA  )
          (resid  18 and name C   )   (resid  19 and name N   )   1.0   -165.02   113.79   2 
   assign (resid  21 and name C   )   (resid  22 and name N   )
          (resid  22 and name CA  )   (resid  22 and name C   )   1.0    -99.43    61.16   2 
   assign (resid  22 and name N   )   (resid  22 and name CA  )
          (resid  22 and name C   )   (resid  23 and name N   )   1.0   -163.21   127.43   2 
   assign (resid  29 and name N   )   (resid  29 and name CA  )
          (resid  29 and name C   )   (resid  30 and name N   )   1.0    176.86   106.40   2 
   assign (resid  29 and name C   )   (resid  30 and name N   )
          (resid  30 and name CA  )   (resid  30 and name C   )   1.0   -106.36    51.12   2 
   assign (resid  30 and name N   )   (resid  30 and name CA  )
          (resid  30 and name C   )   (resid  31 and name N   )   1.0   -173.52   113.48   2 
   assign (resid  37 and name C   )   (resid  38 and name N   )
          (resid  38 and name CA  )   (resid  38 and name C   )   1.0    -89.97    67.48   2 
   assign (resid  38 and name N   )   (resid  38 and name CA  )
          (resid  38 and name C   )   (resid  39 and name N   )   1.0   -157.35   171.62   2 
   assign (resid  40 and name C   )   (resid  41 and name N   )
          (resid  41 and name CA  )   (resid  41 and name C   )   1.0    -79.98    68.20   2 
   assign (resid  41 and name N   )   (resid  41 and name CA  )
          (resid  41 and name C   )   (resid  42 and name N   )   1.0    -52.12    58.67   2 
   assign (resid  42 and name C   )   (resid  43 and name N   )
          (resid  43 and name CA  )   (resid  43 and name C   )   1.0    -66.68    23.24   2 
   assign (resid  43 and name N   )   (resid  43 and name CA  )
          (resid  43 and name C   )   (resid  44 and name N   )   1.0    -53.64    20.08   2 
   assign (resid  43 and name C   )   (resid  44 and name N   )
          (resid  44 and name CA  )   (resid  44 and name C   )   1.0    -62.02    23.96   2 
   assign (resid  44 and name N   )   (resid  44 and name CA  )
          (resid  44 and name C   )   (resid  45 and name N   )   1.0    -52.71    16.21   2 
   assign (resid  44 and name C   )   (resid  45 and name N   )
          (resid  45 and name CA  )   (resid  45 and name C   )   1.0    -65.91    26.64   2 
   assign (resid  45 and name N   )   (resid  45 and name CA  )
          (resid  45 and name C   )   (resid  46 and name N   )   1.0    -53.83    20.81   2 
   assign (resid  45 and name C   )   (resid  46 and name N   )
          (resid  46 and name CA  )   (resid  46 and name C   )   1.0    -64.39    29.76   2 
   assign (resid  46 and name N   )   (resid  46 and name CA  )
          (resid  46 and name C   )   (resid  47 and name N   )   1.0    -51.03    13.24   2 
   assign (resid  47 and name C   )   (resid  48 and name N   )
          (resid  48 and name CA  )   (resid  48 and name C   )   1.0    -80.11    78.12   2 
   assign (resid  48 and name N   )   (resid  48 and name CA  )
          (resid  48 and name C   )   (resid  49 and name N   )   1.0   -158.60   137.61   2 
   assign (resid  50 and name C   )   (resid  51 and name N   )
          (resid  51 and name CA  )   (resid  51 and name C   )   1.0    -81.10    69.52   2 
   assign (resid  51 and name N   )   (resid  51 and name CA  )
          (resid  51 and name C   )   (resid  52 and name N   )   1.0   -155.91   127.49   2 
   assign (resid  53 and name C   )   (resid  54 and name N   )
          (resid  54 and name CA  )   (resid  54 and name C   )   1.0   -131.75    45.88   2 
   assign (resid  54 and name N   )   (resid  54 and name CA  )
          (resid  54 and name C   )   (resid  55 and name N   )   1.0    177.07   139.38   2 
   assign (resid  54 and name C   )   (resid  55 and name N   )
          (resid  55 and name CA  )   (resid  55 and name C   )   1.0   -116.11    68.00   2 
   assign (resid  55 and name N   )   (resid  55 and name CA  )
          (resid  55 and name C   )   (resid  56 and name N   )   1.0   -173.86    93.62   2 
   assign (resid  55 and name C   )   (resid  56 and name N   )
          (resid  56 and name CA  )   (resid  56 and name C   )   1.0   -117.32    93.48   2 
   assign (resid  56 and name N   )   (resid  56 and name CA  )
          (resid  56 and name C   )   (resid  57 and name N   )   1.0   -172.16   114.52   2 
   assign (resid  56 and name C   )   (resid  57 and name N   )
          (resid  57 and name CA  )   (resid  57 and name C   )   1.0   -117.09    95.20   2 
   assign (resid  57 and name N   )   (resid  57 and name CA  )
          (resid  57 and name C   )   (resid  58 and name N   )   1.0   -167.26   134.16   2 
   assign (resid  59 and name C   )   (resid  60 and name N   )
          (resid  60 and name CA  )   (resid  60 and name C   )   1.0   -134.29    62.72   2 
   assign (resid  60 and name N   )   (resid  60 and name CA  )
          (resid  60 and name C   )   (resid  61 and name N   )   1.0   -169.45    97.36   2 
   assign (resid  60 and name C   )   (resid  61 and name N   )
          (resid  61 and name CA  )   (resid  61 and name C   )   1.0   -120.67    81.84   2 
   assign (resid  61 and name N   )   (resid  61 and name CA  )
          (resid  61 and name C   )   (resid  62 and name N   )   1.0   -170.98   122.51   2 
   assign (resid  62 and name C   )   (resid  63 and name N   )
          (resid  63 and name CA  )   (resid  63 and name C   )   1.0   -122.08    61.96   2 
   assign (resid  63 and name N   )   (resid  63 and name CA  )
          (resid  63 and name C   )   (resid  64 and name N   )   1.0   -178.54    95.21   2 
   assign (resid  63 and name C   )   (resid  64 and name N   )
          (resid  64 and name CA  )   (resid  64 and name C   )   1.0   -106.32    95.68   2 
   assign (resid  64 and name N   )   (resid  64 and name CA  )
          (resid  64 and name C   )   (resid  65 and name N   )   1.0   -164.46   116.06   2 
   assign (resid  65 and name C   )   (resid  66 and name N   )
          (resid  66 and name CA  )   (resid  66 and name C   )   1.0    -77.56    89.12   2 
   assign (resid  66 and name N   )   (resid  66 and name CA  )
          (resid  66 and name C   )   (resid  67 and name N   )   1.0   -144.54   134.54   2 
   assign (resid  66 and name C   )   (resid  67 and name N   )
          (resid  67 and name CA  )   (resid  67 and name C   )   1.0    -60.42    39.24   2 
   assign (resid  67 and name N   )   (resid  67 and name CA  )
          (resid  67 and name C   )   (resid  68 and name N   )   1.0    -45.59    22.69   2 
   assign (resid  67 and name C   )   (resid  68 and name N   )
          (resid  68 and name CA  )   (resid  68 and name C   )   1.0    -93.33    67.04   2 
   assign (resid  68 and name N   )   (resid  68 and name CA  )
          (resid  68 and name C   )   (resid  69 and name N   )   1.0    -43.58     9.29   2 
   assign (resid  69 and name C   )   (resid  70 and name N   )
          (resid  70 and name CA  )   (resid  70 and name C   )   1.0   -103.05    74.44   2 
   assign (resid  70 and name N   )   (resid  70 and name CA  )
          (resid  70 and name C   )   (resid  71 and name N   )   1.0   -168.32   145.39   2 
   assign (resid  71 and name C   )   (resid  72 and name N   )
          (resid  72 and name CA  )   (resid  72 and name C   )   1.0    -66.99    32.68   2 
   assign (resid  72 and name N   )   (resid  72 and name CA  )
          (resid  72 and name C   )   (resid  73 and name N   )   1.0    -51.97    29.30   2 
   assign (resid  72 and name C   )   (resid  73 and name N   )
          (resid  73 and name CA  )   (resid  73 and name C   )   1.0    -66.97    44.36   2 
   assign (resid  73 and name N   )   (resid  73 and name CA  )
          (resid  73 and name C   )   (resid  74 and name N   )   1.0    -53.08     6.67   2 
   assign (resid  73 and name C   )   (resid  74 and name N   )
          (resid  74 and name CA  )   (resid  74 and name C   )   1.0    -67.55    21.20   2 
   assign (resid  74 and name N   )   (resid  74 and name CA  )
          (resid  74 and name C   )   (resid  75 and name N   )   1.0    -54.17    14.69   2 
   assign (resid  74 and name C   )   (resid  75 and name N   )
          (resid  75 and name CA  )   (resid  75 and name C   )   1.0    -67.02    17.48   2 
   assign (resid  75 and name N   )   (resid  75 and name CA  )
          (resid  75 and name C   )   (resid  76 and name N   )   1.0    -48.65    15.03   2 
   assign (resid  76 and name N   )   (resid  76 and name CA  )
          (resid  76 and name C   )   (resid  77 and name N   )   1.0    -48.25    16.45   2 
   assign (resid  76 and name C   )   (resid  77 and name N   )
          (resid  77 and name CA  )   (resid  77 and name C   )   1.0    -68.13    17.92   2 
   assign (resid  77 and name N   )   (resid  77 and name CA  )
          (resid  77 and name C   )   (resid  78 and name N   )   1.0    -55.42    13.96   2 
   assign (resid  77 and name C   )   (resid  78 and name N   )
          (resid  78 and name CA  )   (resid  78 and name C   )   1.0    -67.46    38.96   2 
   assign (resid  78 and name N   )   (resid  78 and name CA  )
          (resid  78 and name C   )   (resid  79 and name N   )   1.0    -54.88    21.26   2 
   assign (resid  78 and name C   )   (resid  79 and name N   )
          (resid  79 and name CA  )   (resid  79 and name C   )   1.0    -61.86    25.92   2 
   assign (resid  79 and name N   )   (resid  79 and name CA  )
          (resid  79 and name C   )   (resid  80 and name N   )   1.0    -48.83    30.18   2 
   assign (resid  79 and name C   )   (resid  80 and name N   )
          (resid  80 and name CA  )   (resid  80 and name C   )   1.0    -65.91    23.04   2 
   assign (resid  80 and name N   )   (resid  80 and name CA  )
          (resid  80 and name C   )   (resid  81 and name N   )   1.0    -53.62    19.07   2 
   assign (resid  80 and name C   )   (resid  81 and name N   )
          (resid  81 and name CA  )   (resid  81 and name C   )   1.0    -71.46    30.12   2 
   assign (resid  81 and name N   )   (resid  81 and name CA  )
          (resid  81 and name C   )   (resid  82 and name N   )   1.0    -52.53    22.12   2 
   assign (resid  85 and name C   )   (resid  86 and name N   )
          (resid  86 and name CA  )   (resid  86 and name C   )   1.0    -76.29    43.48   2 
! H-bond restraints from AutoStructure
 assign ((resid   5 and name O    ))   ( (resid  18 and name N    ))     2.80  0.40  0.50
 assign ((resid   5 and name O    ))   ( (resid  18 and name HN   ))     1.80  0.30  0.50
 assign ((resid  13 and name O    ))   ( (resid  65 and name N    ))     2.80  0.40  0.50
 assign ((resid  13 and name O    ))   ( (resid  65 and name HN   ))     1.80  0.30  0.50
 assign ((resid  15 and name O    ))   ( (resid  63 and name N    ))     2.80  0.40  0.50
 assign ((resid  15 and name O    ))   ( (resid  63 and name HN   ))     1.80  0.30  0.50
 assign ((resid  17 and name O    ))   ( (resid  61 and name N    ))     2.80  0.40  0.50
 assign ((resid  17 and name O    ))   ( (resid  61 and name HN   ))     1.80  0.30  0.50
 assign ((resid  18 and name O    ))   ( (resid   4 and name N    ))     2.80  0.40  0.50
 assign ((resid  18 and name O    ))   ( (resid   4 and name HN   ))     1.80  0.30  0.50
 assign ((resid  29 and name O    ))   ( (resid  56 and name N    ))     2.80  0.40  0.50
 assign ((resid  29 and name O    ))   ( (resid  56 and name HN   ))     1.80  0.30  0.50
 assign ((resid  31 and name O    ))   ( (resid  54 and name N    ))     2.80  0.40  0.50
 assign ((resid  31 and name O    ))   ( (resid  54 and name HN   ))     1.80  0.30  0.50
 assign ((resid  39 and name O    ))   ( (resid  42 and name N    ))     2.80  0.40  0.50
 assign ((resid  39 and name O    ))   ( (resid  42 and name HN   ))     1.80  0.30  0.50
 assign ((resid  40 and name O    ))   ( (resid  43 and name N    ))     2.80  0.40  0.50
 assign ((resid  40 and name O    ))   ( (resid  43 and name HN   ))     1.80  0.30  0.50
 assign ((resid  42 and name O    ))   ( (resid  46 and name N    ))     2.80  0.40  0.50
 assign ((resid  42 and name O    ))   ( (resid  46 and name HN   ))     1.80  0.30  0.50
 assign ((resid  43 and name O    ))   ( (resid  47 and name N    ))     2.80  0.40  0.50
 assign ((resid  43 and name O    ))   ( (resid  47 and name HN   ))     1.80  0.30  0.50
 assign ((resid  45 and name O    ))   ( (resid  48 and name N    ))     2.80  0.40  0.50
 assign ((resid  45 and name O    ))   ( (resid  48 and name HN   ))     1.80  0.30  0.50
 assign ((resid  48 and name O    ))   ( (resid  51 and name N    ))     2.80  0.40  0.50
 assign ((resid  48 and name O    ))   ( (resid  51 and name HN   ))     1.80  0.30  0.50
 assign ((resid  50 and name O    ))   ( (resid  66 and name N    ))     2.80  0.40  0.50
 assign ((resid  50 and name O    ))   ( (resid  66 and name HN   ))     1.80  0.30  0.50
 assign ((resid  53 and name O    ))   ( (resid  64 and name N    ))     2.80  0.40  0.50
 assign ((resid  53 and name O    ))   ( (resid  64 and name HN   ))     1.80  0.30  0.50
 assign ((resid  54 and name O    ))   ( (resid  31 and name N    ))     2.80  0.40  0.50
 assign ((resid  54 and name O    ))   ( (resid  31 and name HN   ))     1.80  0.30  0.50
 assign ((resid  55 and name O    ))   ( (resid  62 and name N    ))     2.80  0.40  0.50
 assign ((resid  55 and name O    ))   ( (resid  62 and name HN   ))     1.80  0.30  0.50
 assign ((resid  56 and name O    ))   ( (resid  29 and name N    ))     2.80  0.40  0.50
 assign ((resid  56 and name O    ))   ( (resid  29 and name HN   ))     1.80  0.30  0.50
 assign ((resid  57 and name O    ))   ( (resid  60 and name N    ))     2.80  0.40  0.50
 assign ((resid  57 and name O    ))   ( (resid  60 and name HN   ))     1.80  0.30  0.50
 assign ((resid  60 and name O    ))   ( (resid  57 and name N    ))     2.80  0.40  0.50
 assign ((resid  60 and name O    ))   ( (resid  57 and name HN   ))     1.80  0.30  0.50
 assign ((resid  61 and name O    ))   ( (resid  17 and name N    ))     2.80  0.40  0.50
 assign ((resid  61 and name O    ))   ( (resid  17 and name HN   ))     1.80  0.30  0.50
 assign ((resid  62 and name O    ))   ( (resid  55 and name N    ))     2.80  0.40  0.50
 assign ((resid  62 and name O    ))   ( (resid  55 and name HN   ))     1.80  0.30  0.50
 assign ((resid  63 and name O    ))   ( (resid  15 and name N    ))     2.80  0.40  0.50
 assign ((resid  63 and name O    ))   ( (resid  15 and name HN   ))     1.80  0.30  0.50
 assign ((resid  64 and name O    ))   ( (resid  53 and name N    ))     2.80  0.40  0.50
 assign ((resid  64 and name O    ))   ( (resid  53 and name HN   ))     1.80  0.30  0.50
 assign ((resid  71 and name O    ))   ( (resid  75 and name N    ))     2.80  0.40  0.50
 assign ((resid  71 and name O    ))   ( (resid  75 and name HN   ))     1.80  0.30  0.50
 assign ((resid  75 and name O    ))   ( (resid  79 and name N    ))     2.80  0.40  0.50
 assign ((resid  75 and name O    ))   ( (resid  79 and name HN   ))     1.80  0.30  0.50
 assign ((resid  78 and name O    ))   ( (resid  81 and name N    ))     2.80  0.40  0.50
 assign ((resid  78 and name O    ))   ( (resid  81 and name HN   ))     1.80  0.30  0.50

  Entry H atom name         Submitted Coord H atom name
  Start of MODEL    1
    1    H1   MET   1           1H       MET   1  14.492   1.471  -6.219
    2    H2   MET   1           2H       MET   1  14.565   1.830  -4.569
    3    H3   MET   1           3H       MET   1  14.723   3.068  -5.710
    4    HA   MET   1           HA       MET   1  12.558   3.087  -4.682
    5    HB2  MET   1           2HB      MET   1  12.570   2.332  -7.636
    6    HB3  MET   1           1HB      MET   1  11.191   3.049  -6.812
    7    HG2  MET   1           2HG      MET   1  12.566   5.051  -6.303
    8    HG3  MET   1           1HG      MET   1  13.905   4.330  -7.201
    9    HE1  MET   1           3HE      MET   1  12.605   7.274  -7.811
   10    HE2  MET   1           1HE      MET   1  12.621   7.235  -9.572
   11    HE3  MET   1           2HE      MET   1  14.002   6.616  -8.668
   12    H    LYS   2           H        LYS   2  12.352   1.367  -3.173
   13    HA   LYS   2           HA       LYS   2  10.258  -0.479  -3.777
   14    HB2  LYS   2           2HB      LYS   2  11.386  -2.599  -3.306
   15    HB3  LYS   2           1HB      LYS   2  12.154  -1.828  -4.689
   16    HG2  LYS   2           2HG      LYS   2  14.111  -1.287  -3.460
   17    HG3  LYS   2           1HG      LYS   2  13.310  -1.511  -1.906
   18    HD2  LYS   2           2HD      LYS   2  14.881  -3.359  -2.401
   19    HD3  LYS   2           1HD      LYS   2  13.220  -3.933  -2.244
   20    HE2  LYS   2           2HE      LYS   2  13.033  -3.987  -4.720
   21    HE3  LYS   2           1HE      LYS   2  14.718  -3.461  -4.836
   22    HZ1  LYS   2           3HZ      LYS   2  13.811  -5.961  -3.500
   23    HZ2  LYS   2           1HZ      LYS   2  15.414  -5.474  -3.724
   24    HZ3  LYS   2           2HZ      LYS   2  14.458  -5.884  -5.057
   25    H    ILE   3           H        ILE   3   9.954  -2.037  -1.811
   26    HA   ILE   3           HA       ILE   3   9.974  -0.662   0.702
   27    HB   ILE   3           HB       ILE   3   9.475  -3.619   0.062
   28   HG12  ILE   3          2HG1      ILE   3   7.499  -1.328   0.510
   29   HG13  ILE   3          1HG1      ILE   3   7.819  -2.150  -1.010
   30   HG21  ILE   3          1HG2      ILE   3   8.903  -2.129   2.657
   31   HG22  ILE   3          2HG2      ILE   3  10.141  -3.361   2.414
   32   HG23  ILE   3          3HG2      ILE   3   8.438  -3.795   2.303
   33   HD11  ILE   3          3HD1      ILE   3   5.725  -2.876  -0.065
   34   HD12  ILE   3          1HD1      ILE   3   6.524  -3.371   1.427
   35   HD13  ILE   3          2HD1      ILE   3   6.870  -4.215  -0.085
   36    H    ILE   4           H        ILE   4  11.856  -0.349   1.793
   37    HA   ILE   4           HA       ILE   4  14.062  -2.253   1.711
   38    HB   ILE   4           HB       ILE   4  13.675   0.377   3.205
   39   HG12  ILE   4          2HG1      ILE   4  14.017   0.605   0.780
   40   HG13  ILE   4          1HG1      ILE   4  15.422   1.209   1.645
   41   HG21  ILE   4          1HG2      ILE   4  16.141  -1.403   3.247
   42   HG22  ILE   4          2HG2      ILE   4  15.095  -1.026   4.616
   43   HG23  ILE   4          3HG2      ILE   4  16.065   0.246   3.876
   44   HD11  ILE   4          3HD1      ILE   4  16.628  -0.873   1.104
   45   HD12  ILE   4          1HD1      ILE   4  16.073  -0.020  -0.336
   46   HD13  ILE   4          2HD1      ILE   4  15.210  -1.451   0.224
   47    H    SER   5           H        SER   5  11.647  -1.090   4.072
   48    HA   SER   5           HA       SER   5  11.774  -3.610   5.513
   49    HB2  SER   5           2HB      SER   5  12.267  -2.488   7.725
   50    HB3  SER   5           1HB      SER   5  13.623  -2.458   6.601
   51    HG   SER   5           HG       SER   5  11.813  -0.323   7.109
   52    H    ILE   6           H        ILE   6   9.786  -4.138   6.229
   53    HA   ILE   6           HA       ILE   6   7.592  -2.248   6.340
   54    HB   ILE   6           HB       ILE   6   7.732  -5.130   7.375
   55   HG12  ILE   6          2HG1      ILE   6   8.179  -4.955   4.895
   56   HG13  ILE   6          1HG1      ILE   6   6.730  -5.873   5.277
   57   HG21  ILE   6          1HG2      ILE   6   5.297  -3.389   6.810
   58   HG22  ILE   6          2HG2      ILE   6   5.878  -3.895   8.397
   59   HG23  ILE   6          3HG2      ILE   6   5.253  -5.096   7.269
   60   HD11  ILE   6          3HD1      ILE   6   6.432  -4.440   3.340
   61   HD12  ILE   6          1HD1      ILE   6   6.802  -3.017   4.311
   62   HD13  ILE   6          2HD1      ILE   6   5.349  -3.964   4.647
   63    H    SER   7           H        SER   7   7.690  -0.754   7.957
   64    HA   SER   7           HA       SER   7   9.107  -1.219  10.439
   65    HB2  SER   7           2HB      SER   7   9.217   0.963   9.287
   66    HB3  SER   7           1HB      SER   7   7.478   1.176   9.487
   67    HG   SER   7           HG       SER   7   9.500   1.164  11.462
   68    H    GLU   8           H        GLU   8   8.069  -0.730  12.587
   69    HA   GLU   8           HA       GLU   8   5.837  -2.481  12.978
   70    HB2  GLU   8           2HB      GLU   8   7.258  -0.675  14.979
   71    HB3  GLU   8           1HB      GLU   8   6.135  -1.960  15.386
   72    HG2  GLU   8           2HG      GLU   8   8.869  -2.281  14.128
   73    HG3  GLU   8           1HG      GLU   8   8.419  -2.677  15.783
   74    H    THR   9           H        THR   9   3.977  -1.863  14.370
   75    HA   THR   9           HA       THR   9   2.978   0.856  14.240
   76    HB   THR   9           HB       THR   9   2.404   0.089  11.970
   77    HG1  THR   9           HG1      THR   9  -0.031   0.168  12.309
   78   HG21  THR   9          3HG2      THR   9   0.857  -1.805  11.581
   79   HG22  THR   9          1HG2      THR   9   0.896  -2.192  13.303
   80   HG23  THR   9          2HG2      THR   9   2.359  -2.352  12.329
   81    HA   PRO  10           HA       PRO  10   0.718  -0.970  17.760
   82    HB2  PRO  10           2HB      PRO  10  -0.647   1.199  18.618
   83    HB3  PRO  10           1HB      PRO  10   1.127   1.139  18.742
   84    HG2  PRO  10           2HG      PRO  10  -0.574   2.529  16.689
   85    HG3  PRO  10           1HG      PRO  10   0.874   3.119  17.538
   86    HD2  PRO  10           2HD      PRO  10   0.909   2.045  14.975
   87    HD3  PRO  10           1HD      PRO  10   2.318   2.079  16.059
   88    H    ASN  11           H        ASN  11  -0.664   0.182  14.855
   89    HA   ASN  11           HA       ASN  11  -3.351  -0.913  15.474
   90    HB2  ASN  11           2HB      ASN  11  -3.216   1.609  15.002
   91    HB3  ASN  11           1HB      ASN  11  -2.680   1.208  13.376
   92   HD21  ASN  11          1HD2      ASN  11  -5.008   2.721  14.061
   93   HD22  ASN  11          2HD2      ASN  11  -6.387   1.854  13.481
   94    H    HIS  12           H        HIS  12  -3.617  -2.811  14.492
   95    HA   HIS  12           HA       HIS  12  -1.804  -3.919  12.606
   96    HB2  HIS  12           2HB      HIS  12  -3.034  -5.246  14.319
   97    HB3  HIS  12           1HB      HIS  12  -4.544  -4.932  13.477
   98    HD1  HIS  12           HD1      HIS  12  -5.250  -7.008  12.328
   99    HD2  HIS  12           HD2      HIS  12  -1.124  -6.539  12.176
  100    HE1  HIS  12           HE1      HIS  12  -4.389  -8.983  11.051
  101    HE2  HIS  12           HE2      HIS  12  -1.884  -8.738  11.061
  102    H    ASN  13           H        ASN  13  -4.656  -2.012  12.206
  103    HA   ASN  13           HA       ASN  13  -5.552  -2.906   9.662
  104    HB2  ASN  13           2HB      ASN  13  -6.953  -1.540  11.206
  105    HB3  ASN  13           1HB      ASN  13  -5.896  -0.159  10.941
  106   HD21  ASN  13          1HD2      ASN  13  -8.360  -2.195   9.545
  107   HD22  ASN  13          2HD2      ASN  13  -8.724  -1.176   8.196
  108    H    THR  14           H        THR  14  -3.806   0.131  10.467
  109    HA   THR  14           HA       THR  14  -2.652   0.124   7.740
  110    HB   THR  14           HB       THR  14  -3.968   2.112   8.047
  111    HG1  THR  14           HG1      THR  14  -2.399   3.056   7.019
  112   HG21  THR  14          3HG2      THR  14  -3.549   3.770   9.828
  113   HG22  THR  14          1HG2      THR  14  -2.331   2.716  10.553
  114   HG23  THR  14          2HG2      THR  14  -4.024   2.221  10.528
  115    H    MET  15           H        MET  15  -0.552  -0.209   7.513
  116    HA   MET  15           HA       MET  15   1.239   0.128   9.853
  117    HB2  MET  15           2HB      MET  15   2.536  -1.797   9.146
  118    HB3  MET  15           1HB      MET  15   0.860  -2.270   9.370
  119    HG2  MET  15           2HG      MET  15   0.510  -2.326   6.963
  120    HG3  MET  15           1HG      MET  15   2.150  -1.723   6.687
  121    HE1  MET  15           3HE      MET  15   2.795  -3.701   5.094
  122    HE2  MET  15           1HE      MET  15   1.139  -4.295   5.230
  123    HE3  MET  15           2HE      MET  15   2.494  -5.396   5.472
  124    H    LYS  16           H        LYS  16   3.228   0.962   9.501
  125    HA   LYS  16           HA       LYS  16   3.528   2.607   7.109
  126    HB2  LYS  16           2HB      LYS  16   5.401   3.678   8.438
  127    HB3  LYS  16           1HB      LYS  16   3.796   3.816   9.147
  128    HG2  LYS  16           2HG      LYS  16   4.301   2.003  10.722
  129    HG3  LYS  16           1HG      LYS  16   5.899   1.803  10.002
  130    HD2  LYS  16           2HD      LYS  16   4.904   4.308  11.417
  131    HD3  LYS  16           1HD      LYS  16   5.967   3.091  12.126
  132    HE2  LYS  16           2HE      LYS  16   7.648   3.594  10.356
  133    HE3  LYS  16           1HE      LYS  16   6.595   4.876   9.754
  134    HZ1  LYS  16           3HZ      LYS  16   7.702   4.771  12.509
  135    HZ2  LYS  16           1HZ      LYS  16   6.815   6.032  11.820
  136    HZ3  LYS  16           2HZ      LYS  16   8.360   5.678  11.243
  137    H    ILE  17           H        ILE  17   5.268   2.556   5.744
  138    HA   ILE  17           HA       ILE  17   7.000   0.154   5.756
  139    HB   ILE  17           HB       ILE  17   5.354   1.221   3.401
  140   HG12  ILE  17          2HG1      ILE  17   5.184  -1.473   4.839
  141   HG13  ILE  17          1HG1      ILE  17   4.055  -0.144   5.040
  142   HG21  ILE  17          1HG2      ILE  17   7.364  -1.059   3.438
  143   HG22  ILE  17          2HG2      ILE  17   7.559   0.494   2.623
  144   HG23  ILE  17          3HG2      ILE  17   6.320  -0.634   2.077
  145   HD11  ILE  17          3HD1      ILE  17   3.133  -1.857   3.606
  146   HD12  ILE  17          1HD1      ILE  17   4.505  -1.721   2.505
  147   HD13  ILE  17          2HD1      ILE  17   3.381  -0.372   2.691
  148    H    THR  18           H        THR  18   9.007   0.902   5.811
  149    HA   THR  18           HA       THR  18   9.894   3.473   4.937
  150    HB   THR  18           HB       THR  18  11.514   0.977   5.612
  151    HG1  THR  18           HG1      THR  18  10.828   3.186   7.279
  152   HG21  THR  18          3HG2      THR  18  12.393   3.887   5.544
  153   HG22  THR  18          1HG2      THR  18  12.884   2.635   4.397
  154   HG23  THR  18          2HG2      THR  18  13.375   2.526   6.088
  155    H    LEU  19           H        LEU  19  10.163   4.026   2.849
  156    HA   LEU  19           HA       LEU  19  10.778   2.086   0.753
  157    HB2  LEU  19           2HB      LEU  19  10.358   5.098   0.689
  158    HB3  LEU  19           1HB      LEU  19  10.739   4.142  -0.736
  159    HG   LEU  19           HG       LEU  19   8.208   3.942   0.941
  160   HD11  LEU  19          1HD1      LEU  19   8.628   4.973  -1.881
  161   HD12  LEU  19          2HD1      LEU  19   8.268   5.944  -0.451
  162   HD13  LEU  19          3HD1      LEU  19   7.071   4.805  -1.061
  163   HD21  LEU  19          3HD2      LEU  19   8.985   2.336  -1.525
  164   HD22  LEU  19          1HD2      LEU  19   7.395   2.335  -0.754
  165   HD23  LEU  19          2HD2      LEU  19   8.792   1.714   0.117
  166    H    SER  20           H        SER  20  12.531   2.708  -0.830
  167    HA   SER  20           HA       SER  20  15.083   2.999   0.462
  168    HB2  SER  20           2HB      SER  20  15.944   2.807  -1.911
  169    HB3  SER  20           1HB      SER  20  14.876   1.489  -1.427
  170    HG   SER  20           HG       SER  20  14.104   3.780  -2.921
  171    H    GLU  21           H        GLU  21  12.836   5.050  -1.177
  172    HA   GLU  21           HA       GLU  21  14.659   7.270  -1.564
  173    HB2  GLU  21           2HB      GLU  21  11.625   7.253  -1.850
  174    HB3  GLU  21           1HB      GLU  21  12.755   8.413  -2.543
  175    HG2  GLU  21           2HG      GLU  21  12.333   5.523  -3.353
  176    HG3  GLU  21           1HG      GLU  21  11.995   6.968  -4.303
  177    H    SER  22           H        SER  22  14.954   8.917  -0.113
  178    HA   SER  22           HA       SER  22  13.120   9.439   2.074
  179    HB2  SER  22           2HB      SER  22  14.908   9.025   3.835
  180    HB3  SER  22           1HB      SER  22  14.311   7.563   3.054
  181    HG   SER  22           HG       SER  22  16.174   7.697   1.669
  182    H    ARG  23           H        ARG  23  13.999  11.135   3.539
  183    HA   ARG  23           HA       ARG  23  14.600  13.223   3.965
  184    HB2  ARG  23           2HB      ARG  23  16.770  12.669   1.925
  185    HB3  ARG  23           1HB      ARG  23  16.616  14.252   2.681
  186    HG2  ARG  23           2HG      ARG  23  17.084  11.634   4.158
  187    HG3  ARG  23           1HG      ARG  23  18.316  12.847   3.794
  188    HD2  ARG  23           2HD      ARG  23  16.983  14.506   5.144
  189    HD3  ARG  23           1HD      ARG  23  15.900  13.190   5.612
  190    HE   ARG  23           HE       ARG  23  18.502  12.394   6.237
  191   HH11  ARG  23          1HH1      ARG  23  16.221  14.861   7.295
  192   HH12  ARG  23          2HH1      ARG  23  16.875  14.937   8.900
  193   HH21  ARG  23          1HH2      ARG  23  19.348  12.527   8.339
  194   HH22  ARG  23          2HH2      ARG  23  18.641  13.620   9.490
  195    H    GLU  24           H        GLU  24  14.442  15.395   3.280
  196    HA   GLU  24           HA       GLU  24  13.524  17.167   2.295
  197    HB2  GLU  24           2HB      GLU  24  13.679  15.549  -0.287
  198    HB3  GLU  24           1HB      GLU  24  13.244  17.256  -0.204
  199    HG2  GLU  24           2HG      GLU  24  15.465  17.796   0.712
  200    HG3  GLU  24           1HG      GLU  24  15.900  16.087   0.685
  201    H    GLY  25           H        GLY  25  11.873  14.672   0.346
  202    HA2  GLY  25           2HA      GLY  25   9.727  13.915   1.632
  203    HA3  GLY  25           1HA      GLY  25   9.268  15.590   1.367
  204    H    MET  26           H        MET  26   9.098  12.526   0.129
  205    HA   MET  26           HA       MET  26   8.700  13.078  -2.664
  206    HB2  MET  26           2HB      MET  26   7.668  10.732  -1.000
  207    HB3  MET  26           1HB      MET  26   7.760  10.791  -2.754
  208    HG2  MET  26           2HG      MET  26  10.199  10.783  -2.648
  209    HG3  MET  26           1HG      MET  26  10.141  10.823  -0.884
  210    HE1  MET  26           3HE      MET  26   9.814   8.616  -4.096
  211    HE2  MET  26           1HE      MET  26   8.115   8.742  -3.631
  212    HE3  MET  26           2HE      MET  26   8.954   7.197  -3.498
  213    H    THR  27           H        THR  27   6.247  11.966  -3.289
  214    HA   THR  27           HA       THR  27   4.360  13.996  -2.910
  215    HB   THR  27           HB       THR  27   2.692  12.359  -3.834
  216    HG1  THR  27           HG1      THR  27   4.319  10.344  -4.483
  217   HG21  THR  27          3HG2      THR  27   4.136  13.614  -5.410
  218   HG22  THR  27          1HG2      THR  27   3.798  11.992  -6.021
  219   HG23  THR  27          2HG2      THR  27   5.365  12.353  -5.299
  220    H    SER  28           H        SER  28   3.417  14.558  -1.041
  221    HA   SER  28           HA       SER  28   2.858  12.588   1.075
  222    HB2  SER  28           2HB      SER  28   2.345  14.696   2.446
  223    HB3  SER  28           1HB      SER  28   4.017  14.505   1.927
  224    HG   SER  28           HG       SER  28   2.171  16.011   0.399
  225    H    ASP  29           H        ASP  29   1.114  11.536   0.160
  226    HA   ASP  29           HA       ASP  29  -1.442  12.963  -0.111
  227    HB2  ASP  29           2HB      ASP  29  -0.010  11.512  -2.367
  228    HB3  ASP  29           1HB      ASP  29  -1.764  11.591  -2.347
  229    H    THR  30           H        THR  30  -3.176  11.755   0.408
  230    HA   THR  30           HA       THR  30  -2.869   8.947   1.174
  231    HB   THR  30           HB       THR  30  -5.391  10.679   1.270
  232    HG1  THR  30           HG1      THR  30  -3.523  11.447   2.549
  233   HG21  THR  30          3HG2      THR  30  -4.666   8.120   2.768
  234   HG22  THR  30          1HG2      THR  30  -5.827   8.231   1.439
  235   HG23  THR  30          2HG2      THR  30  -6.155   9.041   2.970
  236    H    TYR  31           H        TYR  31  -2.838   7.622  -0.577
  237    HA   TYR  31           HA       TYR  31  -4.347   8.109  -2.978
  238    HB2  TYR  31           2HB      TYR  31  -2.885   5.529  -2.277
  239    HB3  TYR  31           1HB      TYR  31  -3.310   6.118  -3.880
  240    HD1  TYR  31           HD1      TYR  31  -2.283   8.959  -3.714
  241    HD2  TYR  31           HD2      TYR  31  -0.538   5.290  -2.393
  242    HE1  TYR  31           HE1      TYR  31  -0.044   9.927  -3.969
  243    HE2  TYR  31           HE2      TYR  31   1.697   6.258  -2.635
  244    HH   TYR  31           HH       TYR  31   2.195   9.617  -3.177
  245    H    THR  32           H        THR  32  -6.505   7.888  -2.770
  246    HA   THR  32           HA       THR  32  -7.667   5.446  -1.649
  247    HB   THR  32           HB       THR  32  -7.486   6.871   0.319
  248    HG1  THR  32           HG1      THR  32  -9.648   5.739  -0.416
  249   HG21  THR  32          3HG2      THR  32  -7.356   9.088  -0.739
  250   HG22  THR  32          1HG2      THR  32  -8.621   9.059   0.492
  251   HG23  THR  32          2HG2      THR  32  -9.052   8.978  -1.216
  252    H    LYS  33           H        LYS  33  -8.022   8.398  -3.555
  253    HA   LYS  33           HA       LYS  33 -10.864   7.895  -4.064
  254    HB2  LYS  33           2HB      LYS  33 -10.970  10.124  -4.995
  255    HB3  LYS  33           1HB      LYS  33 -10.016  10.210  -3.517
  256    HG2  LYS  33           2HG      LYS  33  -7.954  10.010  -5.062
  257    HG3  LYS  33           1HG      LYS  33  -9.061  10.371  -6.382
  258    HD2  LYS  33           2HD      LYS  33  -9.608  12.540  -5.369
  259    HD3  LYS  33           1HD      LYS  33  -8.621  12.154  -3.955
  260    HE2  LYS  33           2HE      LYS  33  -6.610  12.065  -5.400
  261    HE3  LYS  33           1HE      LYS  33  -7.604  12.507  -6.791
  262    HZ1  LYS  33           3HZ      LYS  33  -8.117  14.603  -5.711
  263    HZ2  LYS  33           1HZ      LYS  33  -6.442  14.411  -5.861
  264    HZ3  LYS  33           2HZ      LYS  33  -7.192  14.171  -4.365
  265    H    VAL  34           H        VAL  34  -8.266   6.589  -5.278
  266    HA   VAL  34           HA       VAL  34  -7.546   5.542  -7.113
  267    HB   VAL  34           HB       VAL  34 -10.376   5.999  -8.145
  268   HG11  VAL  34          1HG1      VAL  34  -8.255   4.106  -9.236
  269   HG12  VAL  34          2HG1      VAL  34  -8.873   5.551 -10.037
  270   HG13  VAL  34          3HG1      VAL  34  -9.940   4.174  -9.767
  271   HG21  VAL  34          3HG2      VAL  34  -9.158   3.554  -6.797
  272   HG22  VAL  34          1HG2      VAL  34 -10.799   3.657  -7.443
  273   HG23  VAL  34          2HG2      VAL  34 -10.322   4.667  -6.079
  274    H    ASP  35           H        ASP  35  -6.171   6.268  -8.557
  275    HA   ASP  35           HA       ASP  35  -5.054   7.442 -10.103
  276    HB2  ASP  35           2HB      ASP  35  -7.142   7.310 -11.478
  277    HB3  ASP  35           1HB      ASP  35  -7.704   8.810 -10.751
  278    H    ASP  36           H        ASP  36  -4.800   8.055  -7.588
  279    HA   ASP  36           HA       ASP  36  -4.898  10.907  -7.026
  280    HB2  ASP  36           2HB      ASP  36  -3.492   8.676  -5.486
  281    HB3  ASP  36           1HB      ASP  36  -3.879  10.283  -4.881
  282    H    SER  37           H        SER  37  -3.517  10.647  -9.339
  283    HA   SER  37           HA       SER  37  -1.679  10.915 -10.565
  284    HB2  SER  37           2HB      SER  37   0.048  12.454  -9.792
  285    HB3  SER  37           1HB      SER  37  -1.524  13.022  -9.243
  286    HG   SER  37           HG       SER  37  -0.307  11.408  -7.410
  287    H    GLN  38           H        GLN  38  -1.855   8.413  -8.870
  288    HA   GLN  38           HA       GLN  38   0.980   7.614  -8.856
  289    HB2  GLN  38           2HB      GLN  38  -0.179   5.544  -7.515
  290    HB3  GLN  38           1HB      GLN  38   0.420   6.975  -6.734
  291    HG2  GLN  38           2HG      GLN  38  -1.652   6.508  -5.738
  292    HG3  GLN  38           1HG      GLN  38  -1.909   7.907  -6.774
  293   HE21  GLN  38          1HE2      GLN  38  -2.693   4.573  -6.221
  294   HE22  GLN  38          2HE2      GLN  38  -3.934   4.465  -7.408
  295    HA   PRO  39           HA       PRO  39   0.554   5.007 -12.462
  296    HB2  PRO  39           2HB      PRO  39   1.977   2.918 -10.799
  297    HB3  PRO  39           1HB      PRO  39   2.361   3.508 -12.433
  298    HG2  PRO  39           2HG      PRO  39   3.798   4.302 -10.342
  299    HG3  PRO  39           1HG      PRO  39   3.388   5.439 -11.646
  300    HD2  PRO  39           2HD      PRO  39   2.212   5.242  -8.888
  301    HD3  PRO  39           1HD      PRO  39   2.497   6.673  -9.895
  302    H    ALA  40           H        ALA  40  -0.546   3.192 -13.278
  303    HA   ALA  40           HA       ALA  40  -2.945   2.431 -12.117
  304    HB1  ALA  40           3HB      ALA  40  -2.476   2.284 -14.530
  305    HB2  ALA  40           1HB      ALA  40  -3.117   0.760 -13.912
  306    HB3  ALA  40           2HB      ALA  40  -1.390   0.924 -14.246
  307    H    PHE  41           H        PHE  41   0.193   0.892 -11.860
  308    HA   PHE  41           HA       PHE  41  -0.406  -1.583 -10.732
  309    HB2  PHE  41           2HB      PHE  41   1.949   0.265 -10.153
  310    HB3  PHE  41           1HB      PHE  41   1.889  -1.440  -9.727
  311    HD1  PHE  41           HD2      PHE  41   2.143   0.962 -12.548
  312    HD2  PHE  41           HD1      PHE  41   2.285  -3.163 -11.404
  313    HE1  PHE  41           HE2      PHE  41   3.114   0.383 -14.732
  314    HE2  PHE  41           HE1      PHE  41   3.257  -3.728 -13.591
  315    HZ   PHE  41           HZ       PHE  41   3.674  -1.960 -15.256
  316    H    ILE  42           H        ILE  42   0.057   1.574  -9.131
  317    HA   ILE  42           HA       ILE  42  -0.405   0.658  -6.449
  318    HB   ILE  42           HB       ILE  42  -0.571   3.517  -7.539
  319   HG12  ILE  42          2HG1      ILE  42   1.646   2.450  -7.968
  320   HG13  ILE  42          1HG1      ILE  42   1.768   3.789  -6.835
  321   HG21  ILE  42          1HG2      ILE  42  -0.222   2.544  -4.670
  322   HG22  ILE  42          2HG2      ILE  42  -1.647   3.342  -5.338
  323   HG23  ILE  42          3HG2      ILE  42  -0.131   4.230  -5.194
  324   HD11  ILE  42          3HD1      ILE  42   3.181   1.925  -6.173
  325   HD12  ILE  42          1HD1      ILE  42   1.788   0.848  -6.120
  326   HD13  ILE  42          2HD1      ILE  42   1.919   2.183  -4.971
  327    H    ASN  43           H        ASN  43  -2.438   1.757  -9.105
  328    HA   ASN  43           HA       ASN  43  -4.812   2.299  -7.558
  329    HB2  ASN  43           2HB      ASN  43  -4.279   1.914 -10.527
  330    HB3  ASN  43           1HB      ASN  43  -5.916   2.099  -9.917
  331   HD21  ASN  43          1HD2      ASN  43  -2.818   3.687 -10.265
  332   HD22  ASN  43          2HD2      ASN  43  -3.374   5.293  -9.976
  333    H    ASP  44           H        ASP  44  -3.397  -0.465  -9.153
  334    HA   ASP  44           HA       ASP  44  -5.582  -2.243  -9.088
  335    HB2  ASP  44           2HB      ASP  44  -3.584  -2.675 -10.469
  336    HB3  ASP  44           1HB      ASP  44  -2.589  -2.831  -9.025
  337    H    ILE  45           H        ILE  45  -2.959  -1.531  -6.791
  338    HA   ILE  45           HA       ILE  45  -3.563  -3.402  -4.785
  339    HB   ILE  45           HB       ILE  45  -2.430  -0.609  -4.267
  340   HG12  ILE  45          2HG1      ILE  45  -0.853  -3.147  -4.935
  341   HG13  ILE  45          1HG1      ILE  45  -1.107  -1.798  -6.040
  342   HG21  ILE  45          1HG2      ILE  45  -1.369  -1.668  -2.286
  343   HG22  ILE  45          2HG2      ILE  45  -2.140  -3.204  -2.689
  344   HG23  ILE  45          3HG2      ILE  45  -3.127  -1.816  -2.230
  345   HD11  ILE  45          3HD1      ILE  45   1.096  -1.718  -5.026
  346   HD12  ILE  45          1HD1      ILE  45   0.382  -1.659  -3.416
  347   HD13  ILE  45          2HD1      ILE  45   0.134  -0.323  -4.545
  348    H    LEU  46           H        LEU  46  -4.708  -0.036  -5.264
  349    HA   LEU  46           HA       LEU  46  -6.410   0.198  -3.035
  350    HB2  LEU  46           2HB      LEU  46  -6.743   1.470  -5.789
  351    HB3  LEU  46           1HB      LEU  46  -7.607   1.974  -4.343
  352    HG   LEU  46           HG       LEU  46  -4.609   2.204  -4.810
  353   HD11  LEU  46          1HD1      LEU  46  -6.725   4.373  -4.649
  354   HD12  LEU  46          2HD1      LEU  46  -5.889   3.835  -6.108
  355   HD13  LEU  46          3HD1      LEU  46  -4.984   4.627  -4.821
  356   HD21  LEU  46          3HD2      LEU  46  -6.230   3.047  -2.385
  357   HD22  LEU  46          1HD2      LEU  46  -4.527   3.421  -2.668
  358   HD23  LEU  46          2HD2      LEU  46  -5.034   1.749  -2.451
  359    H    LYS  47           H        LYS  47  -6.956  -1.284  -6.191
  360    HA   LYS  47           HA       LYS  47  -9.788  -1.752  -5.821
  361    HB2  LYS  47           2HB      LYS  47  -7.860  -2.826  -7.912
  362    HB3  LYS  47           1HB      LYS  47  -9.613  -3.012  -7.963
  363    HG2  LYS  47           2HG      LYS  47  -9.900  -0.598  -8.193
  364    HG3  LYS  47           1HG      LYS  47  -8.159  -0.348  -8.028
  365    HD2  LYS  47           2HD      LYS  47  -7.817  -1.702 -10.117
  366    HD3  LYS  47           1HD      LYS  47  -9.572  -1.806 -10.294
  367    HE2  LYS  47           2HE      LYS  47  -9.670   0.670 -10.437
  368    HE3  LYS  47           1HE      LYS  47  -7.909   0.730 -10.332
  369    HZ1  LYS  47           3HZ      LYS  47  -7.773  -0.522 -12.384
  370    HZ2  LYS  47           1HZ      LYS  47  -8.695   0.879 -12.617
  371    HZ3  LYS  47           2HZ      LYS  47  -9.460  -0.624 -12.477
  372    H    VAL  48           H        VAL  48  -6.875  -3.461  -4.962
  373    HA   VAL  48           HA       VAL  48  -7.807  -6.125  -4.929
  374    HB   VAL  48           HB       VAL  48  -5.676  -4.788  -3.191
  375   HG11  VAL  48          1HG1      VAL  48  -4.921  -7.065  -2.521
  376   HG12  VAL  48          2HG1      VAL  48  -6.338  -7.762  -3.311
  377   HG13  VAL  48          3HG1      VAL  48  -6.538  -6.704  -1.914
  378   HG21  VAL  48          3HG2      VAL  48  -4.083  -6.027  -4.633
  379   HG22  VAL  48          1HG2      VAL  48  -5.108  -4.950  -5.579
  380   HG23  VAL  48          2HG2      VAL  48  -5.431  -6.682  -5.566
  381    H    GLU  49           H        GLU  49  -9.372  -7.003  -3.796
  382    HA   GLU  49           HA       GLU  49 -10.893  -5.750  -1.779
  383    HB2  GLU  49           2HB      GLU  49 -10.742  -8.696  -2.556
  384    HB3  GLU  49           1HB      GLU  49 -12.003  -7.983  -1.549
  385    HG2  GLU  49           2HG      GLU  49 -12.790  -6.620  -3.407
  386    HG3  GLU  49           1HG      GLU  49 -11.446  -7.148  -4.415
  387    H    GLY  50           H        GLY  50  -9.567  -5.090  -0.149
  388    HA2  GLY  50           2HA      GLY  50  -9.104  -6.433   2.131
  389    HA3  GLY  50           1HA      GLY  50  -7.672  -6.820   1.182
  390    H    VAL  51           H        VAL  51  -7.666  -4.216  -0.191
  391    HA   VAL  51           HA       VAL  51  -6.314  -2.638   1.889
  392    HB   VAL  51           HB       VAL  51  -6.446  -2.180  -1.132
  393   HG11  VAL  51          1HG1      VAL  51  -5.909  -0.107   0.063
  394   HG12  VAL  51          2HG1      VAL  51  -4.502  -0.683  -0.830
  395   HG13  VAL  51          3HG1      VAL  51  -4.592  -0.913   0.920
  396   HG21  VAL  51          3HG2      VAL  51  -4.229  -3.490   0.485
  397   HG22  VAL  51          1HG2      VAL  51  -4.190  -3.152  -1.248
  398   HG23  VAL  51          2HG2      VAL  51  -5.344  -4.317  -0.604
  399    H    LYS  52           H        LYS  52  -7.197  -0.842   2.748
  400    HA   LYS  52           HA       LYS  52  -9.748   0.223   1.809
  401    HB2  LYS  52           2HB      LYS  52  -9.283  -0.085   4.259
  402    HB3  LYS  52           1HB      LYS  52  -8.004   1.120   4.147
  403    HG2  LYS  52           2HG      LYS  52  -9.698   2.820   3.498
  404    HG3  LYS  52           1HG      LYS  52 -10.964   1.600   3.667
  405    HD2  LYS  52           2HD      LYS  52 -10.304   1.344   6.085
  406    HD3  LYS  52           1HD      LYS  52  -9.166   2.678   5.875
  407    HE2  LYS  52           2HE      LYS  52 -12.182   2.830   5.536
  408    HE3  LYS  52           1HE      LYS  52 -11.260   3.453   6.903
  409    HZ1  LYS  52           3HZ      LYS  52 -10.220   5.057   5.492
  410    HZ2  LYS  52           1HZ      LYS  52 -11.890   5.165   5.261
  411    HZ3  LYS  52           2HZ      LYS  52 -10.926   4.399   4.103
  412    H    SER  53           H        SER  53  -6.443   1.405   2.416
  413    HA   SER  53           HA       SER  53  -6.375   3.081   0.091
  414    HB2  SER  53           2HB      SER  53  -6.059   5.250   1.355
  415    HB3  SER  53           1HB      SER  53  -7.694   4.601   1.489
  416    HG   SER  53           HG       SER  53  -5.654   4.191   3.419
  417    H    ILE  54           H        ILE  54  -4.313   4.458   0.153
  418    HA   ILE  54           HA       ILE  54  -2.091   3.197   1.644
  419    HB   ILE  54           HB       ILE  54  -2.041   4.008  -1.310
  420   HG12  ILE  54          2HG1      ILE  54  -1.829   1.186  -0.151
  421   HG13  ILE  54          1HG1      ILE  54  -3.263   1.852  -0.928
  422   HG21  ILE  54          1HG2      ILE  54   0.256   3.098  -1.371
  423   HG22  ILE  54          2HG2      ILE  54   0.170   2.761   0.360
  424   HG23  ILE  54          3HG2      ILE  54   0.115   4.426  -0.217
  425   HD11  ILE  54          3HD1      ILE  54  -1.979   2.108  -3.018
  426   HD12  ILE  54          1HD1      ILE  54  -2.078   0.442  -2.461
  427   HD13  ILE  54          2HD1      ILE  54  -0.589   1.353  -2.232
  428    H    PHE  55           H        PHE  55  -1.786   4.978   3.061
  429    HA   PHE  55           HA       PHE  55  -1.680   7.696   2.012
  430    HB2  PHE  55           2HB      PHE  55  -2.527   7.313   4.294
  431    HB3  PHE  55           1HB      PHE  55  -0.996   6.586   4.766
  432    HD1  PHE  55           HD1      PHE  55  -1.895   9.774   2.962
  433    HD2  PHE  55           HD2      PHE  55   0.112   7.999   6.298
  434    HE1  PHE  55           HE1      PHE  55  -1.114  11.993   3.669
  435    HE2  PHE  55           HE2      PHE  55   0.889  10.226   6.998
  436    HZ   PHE  55           HZ       PHE  55   0.282  12.222   5.687
  437    H    HIS  56           H        HIS  56   0.236   8.930   1.689
  438    HA   HIS  56           HA       HIS  56   2.833   7.596   2.218
  439    HB2  HIS  56           2HB      HIS  56   2.191   7.351  -0.217
  440    HB3  HIS  56           1HB      HIS  56   2.150   9.102  -0.354
  441    HD1  HIS  56           HD1      HIS  56   3.998   8.995  -2.176
  442    HD2  HIS  56           HD2      HIS  56   5.200   7.536   1.535
  443    HE1  HIS  56           HE1      HIS  56   6.485   8.718  -2.325
  444    HE2  HIS  56           HE2      HIS  56   7.207   7.915  -0.048
  445    H    VAL  57           H        VAL  57   4.322   8.924   3.110
  446    HA   VAL  57           HA       VAL  57   4.068  11.832   3.014
  447    HB   VAL  57           HB       VAL  57   2.688  11.405   4.941
  448   HG11  VAL  57          1HG1      VAL  57   3.376  10.067   6.873
  449   HG12  VAL  57          2HG1      VAL  57   4.854   9.605   6.026
  450   HG13  VAL  57          3HG1      VAL  57   3.283   9.104   5.396
  451   HG21  VAL  57          3HG2      VAL  57   4.247  13.290   5.209
  452   HG22  VAL  57          1HG2      VAL  57   5.441  12.218   5.947
  453   HG23  VAL  57          2HG2      VAL  57   3.906  12.529   6.763
  454    H    MET  58           H        MET  58   5.976  12.658   2.709
  455    HA   MET  58           HA       MET  58   8.152  13.039   2.480
  456    HB2  MET  58           2HB      MET  58   7.961  13.373   4.922
  457    HB3  MET  58           1HB      MET  58   8.403  11.694   5.196
  458    HG2  MET  58           2HG      MET  58  10.626  12.076   4.292
  459    HG3  MET  58           1HG      MET  58  10.191  13.719   3.818
  460    HE1  MET  58           3HE      MET  58   9.730  15.436   7.338
  461    HE2  MET  58           1HE      MET  58   8.467  14.634   6.406
  462    HE3  MET  58           2HE      MET  58   9.645  15.666   5.592
  463    H    ASP  59           H        ASP  59   8.715   9.957   4.206
  464    HA   ASP  59           HA       ASP  59   9.962   8.868   1.746
  465    HB2  ASP  59           2HB      ASP  59  11.609   7.726   3.151
  466    HB3  ASP  59           1HB      ASP  59  11.652   9.453   3.469
  467    H    PHE  60           H        PHE  60   7.990   8.234   4.603
  468    HA   PHE  60           HA       PHE  60   7.897   5.360   3.975
  469    HB2  PHE  60           2HB      PHE  60   7.159   4.984   6.268
  470    HB3  PHE  60           1HB      PHE  60   8.627   5.948   6.266
  471    HD1  PHE  60           HD2      PHE  60   8.349   8.537   6.547
  472    HD2  PHE  60           HD1      PHE  60   5.276   5.722   7.541
  473    HE1  PHE  60           HE2      PHE  60   7.274  10.210   7.987
  474    HE2  PHE  60           HE1      PHE  60   4.208   7.408   8.980
  475    HZ   PHE  60           HZ       PHE  60   5.193   9.660   9.187
  476    H    ILE  61           H        ILE  61   6.119   4.344   3.479
  477    HA   ILE  61           HA       ILE  61   3.626   5.725   2.889
  478    HB   ILE  61           HB       ILE  61   4.489   2.803   2.530
  479   HG12  ILE  61          2HG1      ILE  61   4.385   5.102   0.517
  480   HG13  ILE  61          1HG1      ILE  61   5.832   4.309   1.131
  481   HG21  ILE  61          1HG2      ILE  61   2.565   2.533   1.019
  482   HG22  ILE  61          2HG2      ILE  61   2.045   4.184   1.369
  483   HG23  ILE  61          3HG2      ILE  61   2.040   2.968   2.645
  484   HD11  ILE  61          3HD1      ILE  61   3.727   3.076  -0.641
  485   HD12  ILE  61          1HD1      ILE  61   5.128   2.227   0.021
  486   HD13  ILE  61          2HD1      ILE  61   5.357   3.567  -1.100
  487    H    SER  62           H        SER  62   1.561   4.791   3.779
  488    HA   SER  62           HA       SER  62   1.669   3.083   6.137
  489    HB2  SER  62           2HB      SER  62   0.175   5.755   6.104
  490    HB3  SER  62           1HB      SER  62   0.133   4.568   7.407
  491    HG   SER  62           HG       SER  62   2.671   5.085   6.987
  492    H    VAL  63           H        VAL  63   0.824   1.483   4.745
  493    HA   VAL  63           HA       VAL  63  -1.528   1.981   3.105
  494    HB   VAL  63           HB       VAL  63  -0.205  -0.724   3.670
  495   HG11  VAL  63          1HG1      VAL  63  -2.091   0.122   1.428
  496   HG12  VAL  63          2HG1      VAL  63  -2.491  -0.933   2.783
  497   HG13  VAL  63          3HG1      VAL  63  -1.318  -1.462   1.578
  498   HG21  VAL  63          3HG2      VAL  63   0.992  -0.445   1.533
  499   HG22  VAL  63          1HG2      VAL  63   1.428   0.823   2.679
  500   HG23  VAL  63          2HG2      VAL  63   0.317   1.178   1.355
  501    H    ASP  64           H        ASP  64  -3.463   2.074   4.021
  502    HA   ASP  64           HA       ASP  64  -4.175   0.678   6.480
  503    HB2  ASP  64           2HB      ASP  64  -6.094   2.295   4.769
  504    HB3  ASP  64           1HB      ASP  64  -6.185   1.986   6.486
  505    H    LYS  65           H        LYS  65  -5.253  -1.258   6.488
  506    HA   LYS  65           HA       LYS  65  -6.404  -2.314   3.971
  507    HB2  LYS  65           2HB      LYS  65  -6.249  -4.524   4.930
  508    HB3  LYS  65           1HB      LYS  65  -4.707  -3.729   5.230
  509    HG2  LYS  65           2HG      LYS  65  -5.361  -3.291   7.553
  510    HG3  LYS  65           1HG      LYS  65  -6.941  -4.014   7.265
  511    HD2  LYS  65           2HD      LYS  65  -5.815  -6.193   6.780
  512    HD3  LYS  65           1HD      LYS  65  -4.261  -5.447   7.172
  513    HE2  LYS  65           2HE      LYS  65  -5.085  -6.701   9.100
  514    HE3  LYS  65           1HE      LYS  65  -5.098  -4.975   9.469
  515    HZ1  LYS  65           3HZ      LYS  65  -7.491  -4.963   8.921
  516    HZ2  LYS  65           1HZ      LYS  65  -7.129  -5.980  10.224
  517    HZ3  LYS  65           2HZ      LYS  65  -7.438  -6.636   8.699
  518    H    GLU  66           H        GLU  66  -8.359  -3.941   4.715
  519    HA   GLU  66           HA       GLU  66 -10.393  -2.329   6.075
  520    HB2  GLU  66           2HB      GLU  66 -10.639  -5.089   4.795
  521    HB3  GLU  66           1HB      GLU  66 -11.968  -4.040   5.291
  522    HG2  GLU  66           2HG      GLU  66 -11.339  -2.404   3.562
  523    HG3  GLU  66           1HG      GLU  66  -9.972  -3.410   3.088
  524    H    ASN  67           H        ASN  67 -11.794  -3.512   7.730
  525    HA   ASN  67           HA       ASN  67 -10.171  -4.039   9.956
  526    HB2  ASN  67           2HB      ASN  67 -12.266  -4.480  11.202
  527    HB3  ASN  67           1HB      ASN  67 -12.376  -3.027  10.222
  528   HD21  ASN  67          1HD2      ASN  67 -14.494  -4.742  11.319
  529   HD22  ASN  67          2HD2      ASN  67 -15.455  -5.230   9.968
  530    H    ASP  68           H        ASP  68 -12.125  -6.350   8.027
  531    HA   ASP  68           HA       ASP  68 -11.334  -8.643   9.627
  532    HB2  ASP  68           2HB      ASP  68 -13.579  -8.546   8.631
  533    HB3  ASP  68           1HB      ASP  68 -12.895  -8.457   7.013
  534    H    ALA  69           H        ALA  69 -10.388  -7.162   6.604
  535    HA   ALA  69           HA       ALA  69  -9.161  -9.162   5.174
  536    HB1  ALA  69           3HB      ALA  69  -9.544  -6.881   4.338
  537    HB2  ALA  69           1HB      ALA  69  -7.875  -7.382   4.063
  538    HB3  ALA  69           2HB      ALA  69  -8.260  -6.265   5.379
  539    H    ASN  70           H        ASN  70  -7.130 -10.098   5.084
  540    HA   ASN  70           HA       ASN  70  -5.345  -9.763   7.426
  541    HB2  ASN  70           2HB      ASN  70  -5.882 -12.168   5.631
  542    HB3  ASN  70           1HB      ASN  70  -4.572 -12.125   6.810
  543   HD21  ASN  70          1HD2      ASN  70  -5.069 -12.238   9.001
  544   HD22  ASN  70          2HD2      ASN  70  -6.631 -12.705   9.579
  545    H    TRP  71           H        TRP  71  -3.325  -8.995   7.043
  546    HA   TRP  71           HA       TRP  71  -2.249  -8.331   4.536
  547    HB2  TRP  71           2HB      TRP  71  -0.855  -8.809   7.192
  548    HB3  TRP  71           1HB      TRP  71  -0.029  -8.183   5.773
  549    HD1  TRP  71           HD1      TRP  71  -1.721  -6.992   8.805
  550    HE1  TRP  71           HE1      TRP  71  -2.203  -4.475   8.640
  551    HE3  TRP  71           HE3      TRP  71  -0.989  -6.325   3.781
  552    HZ2  TRP  71           HZ2      TRP  71  -2.273  -2.479   6.677
  553    HZ3  TRP  71           HZ3      TRP  71  -1.292  -4.070   2.842
  554    HH2  TRP  71           HH2      TRP  71  -1.925  -2.186   4.266
  555    H    GLU  72           H        GLU  72  -2.379 -11.391   6.123
  556    HA   GLU  72           HA       GLU  72  -0.279 -12.811   4.962
  557    HB2  GLU  72           2HB      GLU  72  -3.076 -13.741   5.748
  558    HB3  GLU  72           1HB      GLU  72  -1.835 -14.849   5.184
  559    HG2  GLU  72           2HG      GLU  72  -1.926 -14.944   7.588
  560    HG3  GLU  72           1HG      GLU  72  -0.399 -14.213   7.105
  561    H    THR  73           H        THR  73  -3.441 -11.916   3.600
  562    HA   THR  73           HA       THR  73  -2.650 -13.016   0.978
  563    HB   THR  73           HB       THR  73  -4.890 -13.711   1.646
  564    HG1  THR  73           HG1      THR  73  -6.031 -12.761  -0.234
  565   HG21  THR  73          3HG2      THR  73  -6.777 -12.130   1.844
  566   HG22  THR  73          1HG2      THR  73  -5.659 -10.770   1.706
  567   HG23  THR  73          2HG2      THR  73  -5.576 -11.842   3.106
  568    H    VAL  74           H        VAL  74  -3.487  -9.962   2.583
  569    HA   VAL  74           HA       VAL  74  -3.787  -8.394   0.226
  570    HB   VAL  74           HB       VAL  74  -3.494  -7.578   3.148
  571   HG11  VAL  74          1HG1      VAL  74  -4.328  -5.831   0.808
  572   HG12  VAL  74          2HG1      VAL  74  -2.852  -5.674   1.760
  573   HG13  VAL  74          3HG1      VAL  74  -4.417  -5.368   2.512
  574   HG21  VAL  74          3HG2      VAL  74  -5.977  -7.801   1.400
  575   HG22  VAL  74          1HG2      VAL  74  -5.946  -7.265   3.084
  576   HG23  VAL  74          2HG2      VAL  74  -5.503  -8.923   2.676
  577    H    LEU  75           H        LEU  75  -1.077  -8.658   2.598
  578    HA   LEU  75           HA       LEU  75   0.437  -6.503   1.596
  579    HB2  LEU  75           2HB      LEU  75   0.899  -7.295   3.817
  580    HB3  LEU  75           1HB      LEU  75   1.302  -8.897   3.237
  581    HG   LEU  75           HG       LEU  75   3.386  -8.068   2.235
  582   HD11  LEU  75          1HD1      LEU  75   4.183  -5.753   2.574
  583   HD12  LEU  75          2HD1      LEU  75   2.601  -5.314   3.221
  584   HD13  LEU  75          3HD1      LEU  75   2.754  -5.837   1.546
  585   HD21  LEU  75          3HD2      LEU  75   4.634  -7.522   4.275
  586   HD22  LEU  75          1HD2      LEU  75   3.462  -8.803   4.579
  587   HD23  LEU  75          2HD2      LEU  75   3.130  -7.157   5.123
  588    HA   PRO  76           HA       PRO  76   2.816  -9.978  -1.239
  589    HB2  PRO  76           2HB      PRO  76   0.144 -11.292  -1.823
  590    HB3  PRO  76           1HB      PRO  76   1.784 -11.971  -1.954
  591    HG2  PRO  76           2HG      PRO  76   0.284 -12.566   0.149
  592    HG3  PRO  76           1HG      PRO  76   2.019 -12.228   0.355
  593    HD2  PRO  76           2HD      PRO  76  -0.328 -10.512   1.062
  594    HD3  PRO  76           1HD      PRO  76   1.269 -10.613   1.831
  595    H    LYS  77           H        LYS  77  -0.468  -8.632  -1.633
  596    HA   LYS  77           HA       LYS  77  -0.197  -8.072  -4.450
  597    HB2  LYS  77           2HB      LYS  77  -2.269  -7.365  -2.351
  598    HB3  LYS  77           1HB      LYS  77  -2.321  -6.585  -3.925
  599    HG2  LYS  77           2HG      LYS  77  -3.855  -8.462  -3.875
  600    HG3  LYS  77           1HG      LYS  77  -2.555  -8.770  -5.023
  601    HD2  LYS  77           2HD      LYS  77  -1.438 -10.212  -3.320
  602    HD3  LYS  77           1HD      LYS  77  -2.800  -9.937  -2.231
  603    HE2  LYS  77           2HE      LYS  77  -3.023 -12.096  -3.361
  604    HE3  LYS  77           1HE      LYS  77  -4.312 -11.006  -3.874
  605    HZ1  LYS  77           3HZ      LYS  77  -3.369 -12.202  -5.743
  606    HZ2  LYS  77           1HZ      LYS  77  -1.831 -11.594  -5.399
  607    HZ3  LYS  77           2HZ      LYS  77  -3.059 -10.547  -5.900
  608    H    VAL  78           H        VAL  78   0.112  -6.176  -1.463
  609    HA   VAL  78           HA       VAL  78   0.455  -3.610  -2.649
  610    HB   VAL  78           HB       VAL  78   1.562  -4.572   0.043
  611   HG11  VAL  78          1HG1      VAL  78   1.464  -2.199   0.726
  612   HG12  VAL  78          2HG1      VAL  78   0.908  -1.749  -0.888
  613   HG13  VAL  78          3HG1      VAL  78   2.522  -2.426  -0.668
  614   HG21  VAL  78          3HG2      VAL  78  -1.174  -3.348  -0.508
  615   HG22  VAL  78          1HG2      VAL  78  -0.514  -3.722   1.088
  616   HG23  VAL  78          2HG2      VAL  78  -0.856  -5.023  -0.053
  617    H    GLU  79           H        GLU  79   2.766  -5.884  -1.240
  618    HA   GLU  79           HA       GLU  79   5.171  -4.602  -1.772
  619    HB2  GLU  79           2HB      GLU  79   4.819  -6.386  -0.087
  620    HB3  GLU  79           1HB      GLU  79   4.598  -7.566  -1.375
  621    HG2  GLU  79           2HG      GLU  79   6.946  -7.187  -2.092
  622    HG3  GLU  79           1HG      GLU  79   7.153  -6.039  -0.769
  623    H    ALA  80           H        ALA  80   3.233  -6.715  -3.793
  624    HA   ALA  80           HA       ALA  80   5.043  -7.756  -5.612
  625    HB1  ALA  80           3HB      ALA  80   2.186  -6.887  -6.189
  626    HB2  ALA  80           1HB      ALA  80   2.681  -8.438  -5.511
  627    HB3  ALA  80           2HB      ALA  80   3.144  -8.015  -7.157
  628    H    VAL  81           H        VAL  81   3.663  -4.503  -5.520
  629    HA   VAL  81           HA       VAL  81   4.432  -3.761  -8.208
  630    HB   VAL  81           HB       VAL  81   3.469  -2.088  -5.840
  631   HG11  VAL  81          1HG1      VAL  81   4.770  -0.633  -7.311
  632   HG12  VAL  81          2HG1      VAL  81   3.055  -0.261  -7.482
  633   HG13  VAL  81          3HG1      VAL  81   3.881  -1.205  -8.725
  634   HG21  VAL  81          3HG2      VAL  81   2.005  -3.067  -8.329
  635   HG22  VAL  81          1HG2      VAL  81   1.316  -2.036  -7.071
  636   HG23  VAL  81          2HG2      VAL  81   1.801  -3.687  -6.689
  637    H    PHE  82           H        PHE  82   5.615  -2.920  -4.946
  638    HA   PHE  82           HA       PHE  82   7.896  -1.428  -5.800
  639    HB2  PHE  82           2HB      PHE  82   7.535  -2.833  -3.116
  640    HB3  PHE  82           1HB      PHE  82   8.517  -1.405  -3.452
  641    HD1  PHE  82           HD2      PHE  82   7.302   0.754  -4.180
  642    HD2  PHE  82           HD1      PHE  82   5.248  -2.601  -2.494
  643    HE1  PHE  82           HE2      PHE  82   5.345   2.166  -3.714
  644    HE2  PHE  82           HE1      PHE  82   3.301  -1.183  -2.042
  645    HZ   PHE  82           HZ       PHE  82   3.348   1.186  -2.659
  646    H    GLU  83           H        GLU  83   7.302  -4.808  -5.446
  647    HA   GLU  83           HA       GLU  83  10.159  -5.472  -5.836
  648    HB2  GLU  83           2HB      GLU  83   9.217  -6.036  -3.517
  649    HB3  GLU  83           1HB      GLU  83   8.147  -7.181  -4.308
  650    HG2  GLU  83           2HG      GLU  83  10.025  -8.384  -3.415
  651    HG3  GLU  83           1HG      GLU  83  10.150  -8.407  -5.174
  652    H    LEU  84           H        LEU  84   9.491  -5.227  -8.104
  653    HA   LEU  84           HA       LEU  84   8.978  -7.877  -9.172
  654    HB2  LEU  84           2HB      LEU  84   7.552  -6.998 -11.031
  655    HB3  LEU  84           1HB      LEU  84   6.790  -6.910  -9.460
  656    HG   LEU  84           HG       LEU  84   7.432  -4.384  -9.477
  657   HD11  LEU  84          1HD1      LEU  84   7.761  -4.905 -12.445
  658   HD12  LEU  84          2HD1      LEU  84   9.012  -4.361 -11.326
  659   HD13  LEU  84          3HD1      LEU  84   7.641  -3.315 -11.681
  660   HD21  LEU  84          3HD2      LEU  84   5.401  -3.775 -10.723
  661   HD22  LEU  84          1HD2      LEU  84   5.124  -5.183  -9.701
  662   HD23  LEU  84          2HD2      LEU  84   5.341  -5.387 -11.441
  663    H    GLU  85           H        GLU  85   9.674  -7.942 -11.488
  664    HA   GLU  85           HA       GLU  85  12.298  -6.891 -11.815
  665    HB2  GLU  85           2HB      GLU  85  11.625  -9.055 -12.788
  666    HB3  GLU  85           1HB      GLU  85  10.462  -8.255 -13.832
  667    HG2  GLU  85           2HG      GLU  85  12.447  -8.883 -15.094
  668    HG3  GLU  85           1HG      GLU  85  12.293  -7.129 -15.039
  669    H    HIS  86           H        HIS  86  12.402  -4.711 -11.883
  670    HA   HIS  86           HA       HIS  86  10.513  -3.079 -13.367
  671    HB2  HIS  86           2HB      HIS  86  12.899  -2.411 -11.601
  672    HB3  HIS  86           1HB      HIS  86  12.040  -1.171 -12.509
  673    HD1  HIS  86           HD1      HIS  86  11.635  -3.482  -9.555
  674    HD2  HIS  86           HD2      HIS  86   9.517  -0.462 -11.488
  675    HE1  HIS  86           HE1      HIS  86   9.754  -2.866  -8.007
  676    HE2  HIS  86           HE2      HIS  86   8.528  -0.996  -9.162
  677    H    HIS  87           H        HIS  87  10.770  -3.291 -15.539
  678    HA   HIS  87           HA       HIS  87  13.131  -1.914 -16.652
  679    HB2  HIS  87           2HB      HIS  87  11.837  -4.407 -17.848
  680    HB3  HIS  87           1HB      HIS  87  12.886  -3.336 -18.767
  681    HD1  HIS  87           HD1      HIS  87  15.404  -3.081 -17.671
  682    HD2  HIS  87           HD2      HIS  87  13.189  -6.432 -16.625
  683    HE1  HIS  87           HE1      HIS  87  17.064  -4.741 -16.793
  684    HE2  HIS  87           HE2      HIS  87  15.673  -6.675 -15.985
  685    H    HIS  88           H        HIS  88  12.661  -0.728 -18.589
  686    HA   HIS  88           HA       HIS  88  10.044   0.491 -18.622
  687    HB2  HIS  88           2HB      HIS  88  12.121   1.825 -18.935
  688    HB3  HIS  88           1HB      HIS  88  12.471   0.948 -20.420
  689    HD1  HIS  88           HD1      HIS  88  10.158   3.562 -19.000
  690    HD2  HIS  88           HD2      HIS  88  11.062   1.854 -22.680
  691    HE1  HIS  88           HE1      HIS  88   8.988   4.973 -20.710
  692    HE2  HIS  88           HE2      HIS  88   9.581   3.944 -22.929
  693    H    HIS  89           H        HIS  89   8.535   0.402 -20.272
  694    HA   HIS  89           HA       HIS  89   8.837  -1.657 -22.376
  695    HB2  HIS  89           2HB      HIS  89   6.325  -1.003 -20.771
  696    HB3  HIS  89           1HB      HIS  89   6.402  -2.146 -22.110
  697    HD1  HIS  89           HD1      HIS  89   7.047  -1.822 -18.480
  698    HD2  HIS  89           HD2      HIS  89   7.819  -4.580 -21.491
  699    HE1  HIS  89           HE1      HIS  89   7.705  -3.936 -17.308
  700    HE2  HIS  89           HE2      HIS  89   8.197  -5.584 -19.144
  701    H    HIS  90           H        HIS  90   8.773  -0.742 -24.335
  702    HA   HIS  90           HA       HIS  90   6.777   1.266 -25.016
  703    HB2  HIS  90           2HB      HIS  90   8.710   2.646 -24.253
  704    HB3  HIS  90           1HB      HIS  90   9.756   1.835 -25.417
  705    HD1  HIS  90           HD1      HIS  90   6.783   4.179 -25.272
  706    HD2  HIS  90           HD2      HIS  90   9.709   2.953 -27.967
  707    HE1  HIS  90           HE1      HIS  90   6.523   5.661 -27.281
  708    HE2  HIS  90           HE2      HIS  90   8.228   4.837 -28.928
  709    H    HIS  91           H        HIS  91   9.610  -0.598 -26.064
  710    HA   HIS  91           HA       HIS  91  10.201  -1.719 -27.911
  711    HB2  HIS  91           2HB      HIS  91   8.085  -2.949 -27.789
  712    HB3  HIS  91           1HB      HIS  91   7.229  -1.642 -28.599
  713    HD1  HIS  91           HD1      HIS  91   7.494  -1.436 -31.153
  714    HD2  HIS  91           HD2      HIS  91   9.586  -4.631 -29.516
  715    HE1  HIS  91           HE1      HIS  91   8.211  -2.846 -33.097
  716    HE2  HIS  91           HE2      HIS  91   9.618  -4.672 -32.096
  Start of MODEL    2
    1    H1   MET   1           1H       MET   1  13.646  -0.090  -3.903
    2    H2   MET   1           2H       MET   1  13.203   1.395  -4.569
    3    H3   MET   1           3H       MET   1  12.397  -0.010  -5.034
    4    HA   MET   1           HA       MET   1  12.374   1.200  -2.341
    5    HB2  MET   1           2HB      MET   1  10.194   1.054  -4.470
    6    HB3  MET   1           1HB      MET   1   9.920   1.580  -2.811
    7    HG2  MET   1           2HG      MET   1  10.111   3.504  -4.277
    8    HG3  MET   1           1HG      MET   1  11.481   3.468  -3.163
    9    HE1  MET   1           3HE      MET   1  13.078   5.062  -4.545
   10    HE2  MET   1           1HE      MET   1  11.685   5.376  -5.585
   11    HE3  MET   1           2HE      MET   1  13.246   4.967  -6.297
   12    H    LYS   2           H        LYS   2  11.928  -0.212  -0.731
   13    HA   LYS   2           HA       LYS   2  10.492  -2.724  -1.242
   14    HB2  LYS   2           2HB      LYS   2  12.876  -3.261  -1.674
   15    HB3  LYS   2           1HB      LYS   2  13.324  -2.620  -0.102
   16    HG2  LYS   2           2HG      LYS   2  13.300  -5.095  -0.148
   17    HG3  LYS   2           1HG      LYS   2  12.166  -4.436   1.033
   18    HD2  LYS   2           2HD      LYS   2  11.155  -6.334  -0.177
   19    HD3  LYS   2           1HD      LYS   2  10.288  -4.838  -0.526
   20    HE2  LYS   2           2HE      LYS   2  10.517  -6.029  -2.599
   21    HE3  LYS   2           1HE      LYS   2  11.625  -4.664  -2.667
   22    HZ1  LYS   2           3HZ      LYS   2  13.434  -6.160  -2.112
   23    HZ2  LYS   2           1HZ      LYS   2  12.630  -6.677  -3.508
   24    HZ3  LYS   2           2HZ      LYS   2  12.367  -7.464  -2.032
   25    H    ILE   3           H        ILE   3   9.479  -3.563   0.575
   26    HA   ILE   3           HA       ILE   3   8.941  -1.764   2.739
   27    HB   ILE   3           HB       ILE   3   8.096  -4.696   2.592
   28   HG12  ILE   3          2HG1      ILE   3   6.619  -2.311   1.366
   29   HG13  ILE   3          1HG1      ILE   3   7.461  -3.554   0.450
   30   HG21  ILE   3          1HG2      ILE   3   6.194  -3.965   3.988
   31   HG22  ILE   3          2HG2      ILE   3   6.808  -2.310   3.976
   32   HG23  ILE   3          3HG2      ILE   3   7.732  -3.589   4.769
   33   HD11  ILE   3          3HD1      ILE   3   5.869  -5.227   1.309
   34   HD12  ILE   3          1HD1      ILE   3   5.084  -3.929   0.409
   35   HD13  ILE   3          2HD1      ILE   3   5.014  -3.944   2.170
   36    H    ILE   4           H        ILE   4  10.786  -1.462   3.935
   37    HA   ILE   4           HA       ILE   4  12.413  -3.635   4.966
   38    HB   ILE   4           HB       ILE   4  12.543  -0.643   5.575
   39   HG12  ILE   4          2HG1      ILE   4  12.887  -1.043   3.171
   40   HG13  ILE   4          1HG1      ILE   4  14.392  -0.543   3.923
   41   HG21  ILE   4          1HG2      ILE   4  14.858  -1.062   6.344
   42   HG22  ILE   4          2HG2      ILE   4  14.630  -2.796   6.100
   43   HG23  ILE   4          3HG2      ILE   4  13.677  -1.942   7.317
   44   HD11  ILE   4          3HD1      ILE   4  14.786  -2.285   2.292
   45   HD12  ILE   4          1HD1      ILE   4  13.650  -3.359   3.110
   46   HD13  ILE   4          2HD1      ILE   4  15.157  -2.891   3.904
   47    H    SER   5           H        SER   5   9.934  -1.402   6.175
   48    HA   SER   5           HA       SER   5   9.678  -3.050   8.621
   49    HB2  SER   5           2HB      SER   5  10.870  -1.013   9.297
   50    HB3  SER   5           1HB      SER   5   9.648  -0.004   8.538
   51    HG   SER   5           HG       SER   5   9.054  -1.825  10.629
   52    H    ILE   6           H        ILE   6   7.662  -3.337   9.396
   53    HA   ILE   6           HA       ILE   6   5.294  -2.141   8.069
   54    HB   ILE   6           HB       ILE   6   5.665  -5.039   8.995
   55   HG12  ILE   6          2HG1      ILE   6   5.169  -3.937   6.193
   56   HG13  ILE   6          1HG1      ILE   6   6.688  -4.600   6.785
   57   HG21  ILE   6          1HG2      ILE   6   3.390  -4.264   9.546
   58   HG22  ILE   6          2HG2      ILE   6   3.350  -5.475   8.266
   59   HG23  ILE   6          3HG2      ILE   6   3.143  -3.769   7.869
   60   HD11  ILE   6          3HD1      ILE   6   4.111  -6.096   6.352
   61   HD12  ILE   6          1HD1      ILE   6   5.576  -6.792   7.055
   62   HD13  ILE   6          2HD1      ILE   6   5.588  -6.201   5.395
   63    H    SER   7           H        SER   7   3.804  -1.320   9.558
   64    HA   SER   7           HA       SER   7   4.451  -1.570  12.425
   65    HB2  SER   7           2HB      SER   7   3.104   0.475  12.731
   66    HB3  SER   7           1HB      SER   7   4.344   0.730  11.502
   67    HG   SER   7           HG       SER   7   1.586   0.181  11.056
   68    H    GLU   8           H        GLU   8   3.341  -3.863  11.596
   69    HA   GLU   8           HA       GLU   8   0.540  -3.814  12.480
   70    HB2  GLU   8           2HB      GLU   8   2.197  -5.778  10.910
   71    HB3  GLU   8           1HB      GLU   8   0.758  -6.330  11.743
   72    HG2  GLU   8           2HG      GLU   8   0.822  -4.123   9.671
   73    HG3  GLU   8           1HG      GLU   8   0.373  -5.797   9.351
   74    H    THR   9           H        THR   9   3.595  -4.600  13.548
   75    HA   THR   9           HA       THR   9   2.722  -6.250  15.783
   76    HB   THR   9           HB       THR   9   5.574  -5.277  15.255
   77    HG1  THR   9           HG1      THR   9   5.731  -7.552  14.467
   78   HG21  THR   9          3HG2      THR   9   6.210  -7.185  16.703
   79   HG22  THR   9          1HG2      THR   9   4.505  -7.577  16.950
   80   HG23  THR   9          2HG2      THR   9   5.165  -6.065  17.578
   81    HA   PRO  10           HA       PRO  10   3.901  -2.293  18.234
   82    HB2  PRO  10           2HB      PRO  10   4.907  -0.050  17.132
   83    HB3  PRO  10           1HB      PRO  10   5.939  -1.478  17.378
   84    HG2  PRO  10           2HG      PRO  10   4.592  -0.536  14.866
   85    HG3  PRO  10           1HG      PRO  10   6.253  -1.129  15.095
   86    HD2  PRO  10           2HD      PRO  10   4.177  -2.703  14.166
   87    HD3  PRO  10           1HD      PRO  10   5.616  -3.342  14.989
   88    H    ASN  11           H        ASN  11   2.068  -2.090  15.385
   89    HA   ASN  11           HA       ASN  11   0.011  -0.413  16.616
   90    HB2  ASN  11           2HB      ASN  11   1.693   0.975  15.091
   91    HB3  ASN  11           1HB      ASN  11   0.842   0.221  13.754
   92   HD21  ASN  11          1HD2      ASN  11   1.025   3.039  14.432
   93   HD22  ASN  11          2HD2      ASN  11  -0.593   3.596  14.671
   94    H    HIS  12           H        HIS  12  -1.647  -0.409  14.204
   95    HA   HIS  12           HA       HIS  12  -1.860  -3.014  13.037
   96    HB2  HIS  12           2HB      HIS  12  -2.594  -3.575  15.365
   97    HB3  HIS  12           1HB      HIS  12  -3.841  -2.338  15.278
   98    HD1  HIS  12           HD1      HIS  12  -5.937  -3.668  15.339
   99    HD2  HIS  12           HD2      HIS  12  -3.197  -5.270  12.656
  100    HE1  HIS  12           HE1      HIS  12  -7.135  -5.558  14.213
  101    HE2  HIS  12           HE2      HIS  12  -5.391  -6.634  12.762
  102    H    ASN  13           H        ASN  13  -3.392  -3.082  11.436
  103    HA   ASN  13           HA       ASN  13  -4.898  -2.479   9.895
  104    HB2  ASN  13           2HB      ASN  13  -5.876  -0.513  11.995
  105    HB3  ASN  13           1HB      ASN  13  -6.702  -0.801  10.463
  106   HD21  ASN  13          1HD2      ASN  13  -7.514  -1.305  13.300
  107   HD22  ASN  13          2HD2      ASN  13  -7.982  -2.971  13.330
  108    H    THR  14           H        THR  14  -2.252  -1.154  10.301
  109    HA   THR  14           HA       THR  14  -2.380   0.441   7.929
  110    HB   THR  14           HB       THR  14  -2.958   2.197   9.605
  111    HG1  THR  14           HG1      THR  14  -1.854   3.484   8.361
  112   HG21  THR  14          3HG2      THR  14  -1.285   2.961  11.270
  113   HG22  THR  14          1HG2      THR  14  -0.234   1.610  10.839
  114   HG23  THR  14          2HG2      THR  14  -1.796   1.304  11.603
  115    H    MET  15           H        MET  15  -0.381   0.423   6.887
  116    HA   MET  15           HA       MET  15   1.905  -0.786   8.338
  117    HB2  MET  15           2HB      MET  15   1.266  -0.938   5.360
  118    HB3  MET  15           1HB      MET  15   2.773  -1.493   6.083
  119    HG2  MET  15           2HG      MET  15   1.419  -3.080   7.481
  120    HG3  MET  15           1HG      MET  15   0.016  -2.606   6.531
  121    HE1  MET  15           3HE      MET  15   1.605  -2.231   3.607
  122    HE2  MET  15           1HE      MET  15  -0.007  -2.934   3.752
  123    HE3  MET  15           2HE      MET  15   1.264  -3.808   2.899
  124    H    LYS  16           H        LYS  16   3.085   0.856   8.949
  125    HA   LYS  16           HA       LYS  16   3.887   3.085   7.305
  126    HB2  LYS  16           2HB      LYS  16   4.087   3.576   9.606
  127    HB3  LYS  16           1HB      LYS  16   4.605   1.962  10.024
  128    HG2  LYS  16           2HG      LYS  16   6.415   3.425  10.514
  129    HG3  LYS  16           1HG      LYS  16   6.877   2.506   9.086
  130    HD2  LYS  16           2HD      LYS  16   6.371   4.456   7.661
  131    HD3  LYS  16           1HD      LYS  16   5.861   5.374   9.080
  132    HE2  LYS  16           2HE      LYS  16   8.158   5.197  10.012
  133    HE3  LYS  16           1HE      LYS  16   8.665   4.286   8.593
  134    HZ1  LYS  16           3HZ      LYS  16   7.707   7.102   8.577
  135    HZ2  LYS  16           1HZ      LYS  16   8.245   6.231   7.229
  136    HZ3  LYS  16           2HZ      LYS  16   9.317   6.607   8.472
  137    H    ILE  17           H        ILE  17   4.413   2.000   5.377
  138    HA   ILE  17           HA       ILE  17   6.427  -0.080   5.295
  139    HB   ILE  17           HB       ILE  17   5.074   1.541   3.080
  140   HG12  ILE  17          2HG1      ILE  17   4.744  -1.381   3.925
  141   HG13  ILE  17          1HG1      ILE  17   3.597  -0.081   4.233
  142   HG21  ILE  17          1HG2      ILE  17   6.095  -0.004   1.426
  143   HG22  ILE  17          2HG2      ILE  17   7.040  -0.749   2.715
  144   HG23  ILE  17          3HG2      ILE  17   7.314   0.939   2.286
  145   HD11  ILE  17          3HD1      ILE  17   2.851  -1.470   2.403
  146   HD12  ILE  17          1HD1      ILE  17   4.357  -1.191   1.529
  147   HD13  ILE  17          2HD1      ILE  17   3.234   0.144   1.808
  148    H    THR  18           H        THR  18   8.184   0.733   6.265
  149    HA   THR  18           HA       THR  18   9.418   3.244   5.477
  150    HB   THR  18           HB       THR  18  10.630   0.937   7.078
  151    HG1  THR  18           HG1      THR  18   8.755   1.768   8.086
  152   HG21  THR  18          3HG2      THR  18  12.156   2.658   7.987
  153   HG22  THR  18          1HG2      THR  18  11.435   3.871   6.923
  154   HG23  THR  18          2HG2      THR  18  12.336   2.514   6.239
  155    H    LEU  19           H        LEU  19  10.390   3.395   3.553
  156    HA   LEU  19           HA       LEU  19  11.451   1.084   2.125
  157    HB2  LEU  19           2HB      LEU  19  11.405   4.055   1.414
  158    HB3  LEU  19           1HB      LEU  19  11.832   2.750   0.316
  159    HG   LEU  19           HG       LEU  19   9.075   3.137   1.569
  160   HD11  LEU  19          1HD1      LEU  19   9.963   3.729  -1.273
  161   HD12  LEU  19          2HD1      LEU  19   9.539   4.920  -0.041
  162   HD13  LEU  19          3HD1      LEU  19   8.308   3.825  -0.661
  163   HD21  LEU  19          3HD2      LEU  19   8.312   1.401  -0.022
  164   HD22  LEU  19          1HD2      LEU  19   9.512   0.772   1.106
  165   HD23  LEU  19          2HD2      LEU  19   9.978   1.151  -0.553
  166    H    SER  20           H        SER  20  13.695   2.640   0.918
  167    HA   SER  20           HA       SER  20  15.749   2.267   2.910
  168    HB2  SER  20           2HB      SER  20  17.248   3.131   1.049
  169    HB3  SER  20           1HB      SER  20  16.253   1.747   0.602
  170    HG   SER  20           HG       SER  20  16.249   4.293  -0.386
  171    H    GLU  21           H        GLU  21  13.584   4.492   3.120
  172    HA   GLU  21           HA       GLU  21  13.256   6.480   4.018
  173    HB2  GLU  21           2HB      GLU  21  16.222   6.408   4.673
  174    HB3  GLU  21           1HB      GLU  21  15.102   7.637   5.259
  175    HG2  GLU  21           2HG      GLU  21  13.829   5.923   6.471
  176    HG3  GLU  21           1HG      GLU  21  14.912   4.667   5.859
  177    H    SER  22           H        SER  22  12.612   7.408   2.123
  178    HA   SER  22           HA       SER  22  14.373   8.813   0.343
  179    HB2  SER  22           2HB      SER  22  12.118   8.069  -0.386
  180    HB3  SER  22           1HB      SER  22  11.371   9.146   0.790
  181    HG   SER  22           HG       SER  22  13.066   9.990  -1.331
  182    H    ARG  23           H        ARG  23  15.157  10.853   0.553
  183    HA   ARG  23           HA       ARG  23  14.904  12.260   3.059
  184    HB2  ARG  23           2HB      ARG  23  16.326  13.141   0.502
  185    HB3  ARG  23           1HB      ARG  23  16.535  13.849   2.105
  186    HG2  ARG  23           2HG      ARG  23  17.442  11.630   2.889
  187    HG3  ARG  23           1HG      ARG  23  17.354  11.059   1.218
  188    HD2  ARG  23           2HD      ARG  23  19.631  11.779   1.707
  189    HD3  ARG  23           1HD      ARG  23  18.912  12.901   0.552
  190    HE   ARG  23           HE       ARG  23  18.887  14.564   2.162
  191   HH11  ARG  23          1HH1      ARG  23  20.073  11.584   3.604
  192   HH12  ARG  23          2HH1      ARG  23  20.667  12.373   5.026
  193   HH21  ARG  23          1HH2      ARG  23  19.633  15.575   4.066
  194   HH22  ARG  23          2HH2      ARG  23  20.419  14.621   5.285
  195    H    GLU  24           H        GLU  24  12.564  12.563   2.911
  196    HA   GLU  24           HA       GLU  24  10.729  13.890   2.798
  197    HB2  GLU  24           2HB      GLU  24  12.448  15.588   3.548
  198    HB3  GLU  24           1HB      GLU  24  12.671  16.056   1.868
  199    HG2  GLU  24           2HG      GLU  24  10.327  16.858   1.782
  200    HG3  GLU  24           1HG      GLU  24  10.105  16.360   3.465
  201    H    GLY  25           H        GLY  25  11.880  12.502   0.283
  202    HA2  GLY  25           2HA      GLY  25  11.138  14.097  -1.999
  203    HA3  GLY  25           1HA      GLY  25  11.679  12.423  -2.005
  204    H    MET  26           H        MET  26   9.569  11.656  -0.048
  205    HA   MET  26           HA       MET  26   7.429  11.107  -1.932
  206    HB2  MET  26           2HB      MET  26   7.626  10.397   1.037
  207    HB3  MET  26           1HB      MET  26   6.485   9.726  -0.123
  208    HG2  MET  26           2HG      MET  26   9.483   9.335  -0.134
  209    HG3  MET  26           1HG      MET  26   8.267   8.142   0.332
  210    HE1  MET  26           3HE      MET  26   9.748   6.770  -3.090
  211    HE2  MET  26           1HE      MET  26   9.548   6.448  -1.367
  212    HE3  MET  26           2HE      MET  26  10.656   7.709  -1.906
  213    H    THR  27           H        THR  27   6.070  12.807  -2.332
  214    HA   THR  27           HA       THR  27   5.415  14.821  -0.381
  215    HB   THR  27           HB       THR  27   3.769  15.614  -2.164
  216    HG1  THR  27           HG1      THR  27   3.322  13.744  -3.283
  217   HG21  THR  27          3HG2      THR  27   6.631  15.205  -3.110
  218   HG22  THR  27          1HG2      THR  27   6.073  16.523  -2.075
  219   HG23  THR  27          2HG2      THR  27   5.493  16.400  -3.737
  220    H    SER  28           H        SER  28   3.277  15.280   0.463
  221    HA   SER  28           HA       SER  28   1.924  12.986   1.481
  222    HB2  SER  28           2HB      SER  28   0.364  14.675   2.531
  223    HB3  SER  28           1HB      SER  28   2.067  14.963   2.879
  224    HG   SER  28           HG       SER  28   0.307  16.617   1.772
  225    H    ASP  29           H        ASP  29   1.010  11.777  -0.090
  226    HA   ASP  29           HA       ASP  29  -1.195  12.905  -1.700
  227    HB2  ASP  29           2HB      ASP  29   0.512  10.469  -2.358
  228    HB3  ASP  29           1HB      ASP  29  -0.761  11.155  -3.360
  229    H    THR  30           H        THR  30  -3.065  12.358  -0.708
  230    HA   THR  30           HA       THR  30  -3.328   9.791   0.695
  231    HB   THR  30           HB       THR  30  -5.452  11.962   0.388
  232    HG1  THR  30           HG1      THR  30  -3.180  12.256   1.603
  233   HG21  THR  30          3HG2      THR  30  -6.312   9.765   1.143
  234   HG22  THR  30          1HG2      THR  30  -6.397  10.959   2.442
  235   HG23  THR  30          2HG2      THR  30  -5.119   9.742   2.445
  236    H    TYR  31           H        TYR  31  -3.423   8.245  -0.883
  237    HA   TYR  31           HA       TYR  31  -5.084   8.462  -3.241
  238    HB2  TYR  31           2HB      TYR  31  -3.610   6.016  -2.165
  239    HB3  TYR  31           1HB      TYR  31  -4.257   6.217  -3.790
  240    HD1  TYR  31           HD1      TYR  31  -3.296   8.853  -4.640
  241    HD2  TYR  31           HD2      TYR  31  -1.276   5.873  -2.337
  242    HE1  TYR  31           HE1      TYR  31  -1.129   9.714  -5.415
  243    HE2  TYR  31           HE2      TYR  31   0.886   6.736  -3.115
  244    HH   TYR  31           HH       TYR  31   1.219   9.716  -4.725
  245    H    THR  32           H        THR  32  -7.191   8.413  -2.841
  246    HA   THR  32           HA       THR  32  -8.419   6.581  -0.884
  247    HB   THR  32           HB       THR  32 -10.455   8.040  -1.127
  248    HG1  THR  32           HG1      THR  32  -8.786   9.721  -2.715
  249   HG21  THR  32          3HG2      THR  32  -8.829   8.602   0.651
  250   HG22  THR  32          1HG2      THR  32  -9.574  10.063  -0.005
  251   HG23  THR  32          2HG2      THR  32  -7.933   9.620  -0.480
  252    H    LYS  33           H        LYS  33  -7.443   5.349  -2.950
  253    HA   LYS  33           HA       LYS  33  -7.645   3.897  -4.563
  254    HB2  LYS  33           2HB      LYS  33  -9.607   2.404  -4.664
  255    HB3  LYS  33           1HB      LYS  33  -8.994   2.659  -3.045
  256    HG2  LYS  33           2HG      LYS  33 -11.248   2.698  -2.614
  257    HG3  LYS  33           1HG      LYS  33 -10.976   4.414  -2.899
  258    HD2  LYS  33           2HD      LYS  33 -11.680   3.942  -5.348
  259    HD3  LYS  33           1HD      LYS  33 -12.235   2.374  -4.766
  260    HE2  LYS  33           2HE      LYS  33 -14.076   4.037  -4.879
  261    HE3  LYS  33           1HE      LYS  33 -13.805   3.475  -3.227
  262    HZ1  LYS  33           3HZ      LYS  33 -14.112   5.910  -3.426
  263    HZ2  LYS  33           1HZ      LYS  33 -12.688   5.998  -4.328
  264    HZ3  LYS  33           2HZ      LYS  33 -12.636   5.485  -2.721
  265    H    VAL  34           H        VAL  34  -7.192   4.716  -6.429
  266    HA   VAL  34           HA       VAL  34  -7.254   5.649  -8.481
  267    HB   VAL  34           HB       VAL  34 -10.030   4.416  -8.660
  268   HG11  VAL  34          1HG1      VAL  34  -7.994   4.991 -10.855
  269   HG12  VAL  34          2HG1      VAL  34  -9.514   5.849 -10.588
  270   HG13  VAL  34          3HG1      VAL  34  -9.535   4.155 -11.078
  271   HG21  VAL  34          3HG2      VAL  34  -7.351   3.040  -9.112
  272   HG22  VAL  34          1HG2      VAL  34  -8.937   2.330  -9.429
  273   HG23  VAL  34          2HG2      VAL  34  -8.469   2.741  -7.779
  274    H    ASP  35           H        ASP  35  -7.226   7.872  -7.879
  275    HA   ASP  35           HA       ASP  35  -9.726   9.375  -8.019
  276    HB2  ASP  35           2HB      ASP  35  -9.487  10.289  -5.709
  277    HB3  ASP  35           1HB      ASP  35  -9.783   8.555  -5.715
  278    H    ASP  36           H        ASP  36  -6.250   9.549  -7.166
  279    HA   ASP  36           HA       ASP  36  -6.244  12.411  -7.896
  280    HB2  ASP  36           2HB      ASP  36  -5.647  11.860  -5.552
  281    HB3  ASP  36           1HB      ASP  36  -4.331  10.836  -6.117
  282    H    SER  37           H        SER  37  -3.305  10.486  -7.671
  283    HA   SER  37           HA       SER  37  -2.834  10.223 -10.482
  284    HB2  SER  37           2HB      SER  37  -2.500  12.706 -10.163
  285    HB3  SER  37           1HB      SER  37  -1.248  12.357  -8.970
  286    HG   SER  37           HG       SER  37  -1.246  11.796 -11.748
  287    H    GLN  38           H        GLN  38  -2.464   8.139  -9.789
  288    HA   GLN  38           HA       GLN  38   0.148   7.597  -8.599
  289    HB2  GLN  38           2HB      GLN  38  -0.805   5.712  -7.264
  290    HB3  GLN  38           1HB      GLN  38  -1.361   7.267  -6.704
  291    HG2  GLN  38           2HG      GLN  38  -3.093   5.744  -8.614
  292    HG3  GLN  38           1HG      GLN  38  -2.975   5.158  -6.960
  293   HE21  GLN  38          1HE2      GLN  38  -5.176   5.568  -6.681
  294   HE22  GLN  38          2HE2      GLN  38  -5.769   7.150  -6.397
  295    HA   PRO  39           HA       PRO  39   0.508   4.790 -12.131
  296    HB2  PRO  39           2HB      PRO  39   1.910   3.004 -10.118
  297    HB3  PRO  39           1HB      PRO  39   2.439   3.514 -11.739
  298    HG2  PRO  39           2HG      PRO  39   3.509   4.630  -9.583
  299    HG3  PRO  39           1HG      PRO  39   3.127   5.615 -11.015
  300    HD2  PRO  39           2HD      PRO  39   1.642   5.432  -8.408
  301    HD3  PRO  39           1HD      PRO  39   1.921   6.837  -9.458
  302    H    ALA  40           H        ALA  40  -0.464   2.905 -12.902
  303    HA   ALA  40           HA       ALA  40  -2.846   2.011 -11.812
  304    HB1  ALA  40           3HB      ALA  40  -2.766   0.208 -13.491
  305    HB2  ALA  40           1HB      ALA  40  -1.051   0.526 -13.767
  306    HB3  ALA  40           2HB      ALA  40  -2.258   1.750 -14.182
  307    H    PHE  41           H        PHE  41   0.391   0.761 -11.415
  308    HA   PHE  41           HA       PHE  41  -0.026  -1.674 -10.139
  309    HB2  PHE  41           2HB      PHE  41   2.213   0.350  -9.694
  310    HB3  PHE  41           1HB      PHE  41   2.280  -1.357  -9.257
  311    HD1  PHE  41           HD1      PHE  41   2.266  -3.106 -11.069
  312    HD2  PHE  41           HD2      PHE  41   2.646   1.053 -11.981
  313    HE1  PHE  41           HE1      PHE  41   3.087  -3.672 -13.317
  314    HE2  PHE  41           HE2      PHE  41   3.474   0.477 -14.228
  315    HZ   PHE  41           HZ       PHE  41   3.689  -1.884 -14.901
  316    H    ILE  42           H        ILE  42   0.304   1.590  -8.673
  317    HA   ILE  42           HA       ILE  42  -0.192   0.807  -5.965
  318    HB   ILE  42           HB       ILE  42  -0.516   3.548  -7.283
  319   HG12  ILE  42          2HG1      ILE  42   1.813   2.674  -7.380
  320   HG13  ILE  42          1HG1      ILE  42   1.703   4.080  -6.330
  321   HG21  ILE  42          1HG2      ILE  42  -1.841   3.495  -5.219
  322   HG22  ILE  42          2HG2      ILE  42  -0.423   4.519  -4.996
  323   HG23  ILE  42          3HG2      ILE  42  -0.452   2.893  -4.309
  324   HD11  ILE  42          3HD1      ILE  42   3.173   2.390  -5.387
  325   HD12  ILE  42          1HD1      ILE  42   1.874   1.200  -5.424
  326   HD13  ILE  42          2HD1      ILE  42   1.757   2.604  -4.360
  327    H    ASN  43           H        ASN  43  -2.255   1.607  -8.686
  328    HA   ASN  43           HA       ASN  43  -4.680   2.075  -7.227
  329    HB2  ASN  43           2HB      ASN  43  -4.026   1.652 -10.163
  330    HB3  ASN  43           1HB      ASN  43  -5.695   1.716  -9.622
  331   HD21  ASN  43          1HD2      ASN  43  -3.490   3.589 -11.038
  332   HD22  ASN  43          2HD2      ASN  43  -3.944   5.135 -10.423
  333    H    ASP  44           H        ASP  44  -3.129  -0.756  -8.649
  334    HA   ASP  44           HA       ASP  44  -5.291  -2.569  -8.385
  335    HB2  ASP  44           2HB      ASP  44  -2.300  -2.878  -8.742
  336    HB3  ASP  44           1HB      ASP  44  -3.243  -4.296  -8.291
  337    H    ILE  45           H        ILE  45  -2.695  -1.601  -6.148
  338    HA   ILE  45           HA       ILE  45  -3.260  -3.371  -4.004
  339    HB   ILE  45           HB       ILE  45  -2.241  -0.494  -3.768
  340   HG12  ILE  45          2HG1      ILE  45  -0.582  -3.046  -4.034
  341   HG13  ILE  45          1HG1      ILE  45  -0.850  -1.885  -5.329
  342   HG21  ILE  45          1HG2      ILE  45  -1.210  -1.229  -1.628
  343   HG22  ILE  45          2HG2      ILE  45  -1.959  -2.816  -1.815
  344   HG23  ILE  45          3HG2      ILE  45  -2.967  -1.384  -1.595
  345   HD11  ILE  45          3HD1      ILE  45   1.331  -1.589  -4.331
  346   HD12  ILE  45          1HD1      ILE  45   0.608  -1.346  -2.742
  347   HD13  ILE  45          2HD1      ILE  45   0.330  -0.170  -4.030
  348    H    LEU  46           H        LEU  46  -4.409  -0.151  -4.762
  349    HA   LEU  46           HA       LEU  46  -6.229   0.289  -2.672
  350    HB2  LEU  46           2HB      LEU  46  -6.049   1.355  -5.508
  351    HB3  LEU  46           1HB      LEU  46  -7.206   1.969  -4.343
  352    HG   LEU  46           HG       LEU  46  -4.209   2.022  -3.824
  353   HD11  LEU  46          1HD1      LEU  46  -4.198   4.385  -4.499
  354   HD12  LEU  46          2HD1      LEU  46  -5.871   4.247  -5.046
  355   HD13  LEU  46          3HD1      LEU  46  -4.599   3.324  -5.848
  356   HD21  LEU  46          3HD2      LEU  46  -5.635   2.217  -1.818
  357   HD22  LEU  46          1HD2      LEU  46  -6.486   3.585  -2.543
  358   HD23  LEU  46          2HD2      LEU  46  -4.773   3.720  -2.135
  359    H    LYS  47           H        LYS  47  -6.578  -1.394  -5.752
  360    HA   LYS  47           HA       LYS  47  -9.443  -1.804  -5.507
  361    HB2  LYS  47           2HB      LYS  47  -7.395  -2.819  -7.510
  362    HB3  LYS  47           1HB      LYS  47  -9.096  -3.278  -7.568
  363    HG2  LYS  47           2HG      LYS  47  -9.739  -0.925  -7.886
  364    HG3  LYS  47           1HG      LYS  47  -8.041  -0.438  -7.799
  365    HD2  LYS  47           2HD      LYS  47  -7.536  -1.706  -9.836
  366    HD3  LYS  47           1HD      LYS  47  -9.192  -2.323  -9.902
  367    HE2  LYS  47           2HE      LYS  47  -8.375   0.591 -10.177
  368    HE3  LYS  47           1HE      LYS  47  -8.845  -0.482 -11.496
  369    HZ1  LYS  47           3HZ      LYS  47 -10.595   0.309  -9.228
  370    HZ2  LYS  47           1HZ      LYS  47 -11.037  -0.680 -10.525
  371    HZ3  LYS  47           2HZ      LYS  47 -10.665   0.946 -10.790
  372    H    VAL  48           H        VAL  48  -6.706  -3.397  -4.176
  373    HA   VAL  48           HA       VAL  48  -7.851  -6.029  -3.963
  374    HB   VAL  48           HB       VAL  48  -5.790  -4.738  -2.095
  375   HG11  VAL  48          1HG1      VAL  48  -5.237  -7.064  -1.418
  376   HG12  VAL  48          2HG1      VAL  48  -6.556  -7.670  -2.423
  377   HG13  VAL  48          3HG1      VAL  48  -6.906  -6.649  -1.026
  378   HG21  VAL  48          3HG2      VAL  48  -4.909  -4.836  -4.376
  379   HG22  VAL  48          1HG2      VAL  48  -5.340  -6.543  -4.504
  380   HG23  VAL  48          2HG2      VAL  48  -4.087  -6.029  -3.371
  381    H    GLU  49           H        GLU  49  -9.799  -6.246  -3.091
  382    HA   GLU  49           HA       GLU  49 -11.070  -4.343  -1.419
  383    HB2  GLU  49           2HB      GLU  49 -11.873  -7.204  -2.089
  384    HB3  GLU  49           1HB      GLU  49 -12.934  -5.998  -1.362
  385    HG2  GLU  49           2HG      GLU  49 -12.805  -4.623  -3.380
  386    HG3  GLU  49           1HG      GLU  49 -11.651  -5.743  -4.104
  387    H    GLY  50           H        GLY  50 -10.066  -4.006   0.461
  388    HA2  GLY  50           2HA      GLY  50 -10.384  -5.341   2.810
  389    HA3  GLY  50           1HA      GLY  50  -8.925  -6.074   2.134
  390    H    VAL  51           H        VAL  51  -7.927  -3.835   0.771
  391    HA   VAL  51           HA       VAL  51  -6.804  -2.118   2.789
  392    HB   VAL  51           HB       VAL  51  -6.760  -1.849  -0.264
  393   HG11  VAL  51          1HG1      VAL  51  -4.811  -0.356   0.037
  394   HG12  VAL  51          2HG1      VAL  51  -4.992  -0.462   1.790
  395   HG13  VAL  51          3HG1      VAL  51  -6.251   0.303   0.817
  396   HG21  VAL  51          3HG2      VAL  51  -4.513  -2.863  -0.177
  397   HG22  VAL  51          1HG2      VAL  51  -5.734  -3.964   0.466
  398   HG23  VAL  51          2HG2      VAL  51  -4.668  -3.087   1.568
  399    H    LYS  52           H        LYS  52  -7.674  -0.231   3.541
  400    HA   LYS  52           HA       LYS  52 -10.154   0.824   2.498
  401    HB2  LYS  52           2HB      LYS  52  -9.672   0.858   4.942
  402    HB3  LYS  52           1HB      LYS  52  -8.302   1.927   4.659
  403    HG2  LYS  52           2HG      LYS  52  -9.881   3.648   3.763
  404    HG3  LYS  52           1HG      LYS  52 -11.231   2.587   4.167
  405    HD2  LYS  52           2HD      LYS  52  -9.244   3.674   6.210
  406    HD3  LYS  52           1HD      LYS  52 -10.780   4.445   5.827
  407    HE2  LYS  52           2HE      LYS  52 -11.074   3.177   7.849
  408    HE3  LYS  52           1HE      LYS  52 -11.947   2.348   6.566
  409    HZ1  LYS  52           3HZ      LYS  52 -10.313   0.683   6.458
  410    HZ2  LYS  52           1HZ      LYS  52 -10.632   0.909   8.098
  411    HZ3  LYS  52           2HZ      LYS  52  -9.220   1.546   7.417
  412    H    SER  53           H        SER  53  -6.812   2.088   2.884
  413    HA   SER  53           HA       SER  53  -6.827   3.477   0.365
  414    HB2  SER  53           2HB      SER  53  -6.590   5.813   1.430
  415    HB3  SER  53           1HB      SER  53  -8.215   5.128   1.454
  416    HG   SER  53           HG       SER  53  -6.882   4.392   3.685
  417    H    ILE  54           H        ILE  54  -4.854   5.115   0.384
  418    HA   ILE  54           HA       ILE  54  -2.571   4.046   1.937
  419    HB   ILE  54           HB       ILE  54  -2.562   4.669  -1.060
  420   HG12  ILE  54          2HG1      ILE  54  -2.102   2.004   0.365
  421   HG13  ILE  54          1HG1      ILE  54  -3.557   2.440  -0.521
  422   HG21  ILE  54          1HG2      ILE  54  -0.462   5.416  -0.023
  423   HG22  ILE  54          2HG2      ILE  54  -0.176   4.001  -1.034
  424   HG23  ILE  54          3HG2      ILE  54  -0.242   3.828   0.720
  425   HD11  ILE  54          3HD1      ILE  54  -2.244   2.556  -2.592
  426   HD12  ILE  54          1HD1      ILE  54  -2.157   0.974  -1.820
  427   HD13  ILE  54          2HD1      ILE  54  -0.799   2.088  -1.689
  428    H    PHE  55           H        PHE  55  -1.836   5.737   3.126
  429    HA   PHE  55           HA       PHE  55  -1.877   8.476   2.038
  430    HB2  PHE  55           2HB      PHE  55  -2.955   8.143   4.253
  431    HB3  PHE  55           1HB      PHE  55  -1.440   7.532   4.907
  432    HD1  PHE  55           HD1      PHE  55  -2.658  10.547   3.004
  433    HD2  PHE  55           HD2      PHE  55  -0.194   9.084   6.177
  434    HE1  PHE  55           HE1      PHE  55  -2.010  12.849   3.569
  435    HE2  PHE  55           HE2      PHE  55   0.442  11.396   6.739
  436    HZ   PHE  55           HZ       PHE  55  -0.464  13.278   5.434
  437    H    HIS  56           H        HIS  56  -0.130   8.584   0.789
  438    HA   HIS  56           HA       HIS  56   2.512   7.564   1.529
  439    HB2  HIS  56           2HB      HIS  56   1.767   7.209  -0.737
  440    HB3  HIS  56           1HB      HIS  56   1.260   8.881  -0.919
  441    HD1  HIS  56           HD1      HIS  56   2.781  10.243  -2.269
  442    HD2  HIS  56           HD2      HIS  56   4.796   7.092  -0.464
  443    HE1  HIS  56           HE1      HIS  56   5.074  10.267  -3.258
  444    HE2  HIS  56           HE2      HIS  56   6.209   8.244  -2.301
  445    H    VAL  57           H        VAL  57   4.139   8.875   2.426
  446    HA   VAL  57           HA       VAL  57   4.496  11.622   1.800
  447    HB   VAL  57           HB       VAL  57   2.503  11.901   3.303
  448   HG11  VAL  57          1HG1      VAL  57   4.257  10.844   5.520
  449   HG12  VAL  57          2HG1      VAL  57   2.852  10.035   4.820
  450   HG13  VAL  57          3HG1      VAL  57   2.648  11.544   5.713
  451   HG21  VAL  57          3HG2      VAL  57   3.383  13.742   4.699
  452   HG22  VAL  57          1HG2      VAL  57   4.097  13.775   3.084
  453   HG23  VAL  57          2HG2      VAL  57   5.030  13.156   4.449
  454    H    MET  58           H        MET  58   6.373  12.547   2.717
  455    HA   MET  58           HA       MET  58   8.372  12.818   3.650
  456    HB2  MET  58           2HB      MET  58   7.165  12.423   5.774
  457    HB3  MET  58           1HB      MET  58   7.513  10.703   5.665
  458    HG2  MET  58           2HG      MET  58   9.910  11.153   5.909
  459    HG3  MET  58           1HG      MET  58   9.596  12.892   5.919
  460    HE1  MET  58           3HE      MET  58  10.636  12.188   9.648
  461    HE2  MET  58           1HE      MET  58  10.951  13.170   8.218
  462    HE3  MET  58           2HE      MET  58  11.301  11.440   8.195
  463    H    ASP  59           H        ASP  59   8.276   9.355   4.431
  464    HA   ASP  59           HA       ASP  59  10.414   8.786   2.450
  465    HB2  ASP  59           2HB      ASP  59  11.649   7.488   4.108
  466    HB3  ASP  59           1HB      ASP  59  11.406   9.110   4.748
  467    H    PHE  60           H        PHE  60   7.393   7.994   3.722
  468    HA   PHE  60           HA       PHE  60   7.671   5.094   3.248
  469    HB2  PHE  60           2HB      PHE  60   6.353   4.653   5.240
  470    HB3  PHE  60           1HB      PHE  60   7.737   5.644   5.673
  471    HD1  PHE  60           HD2      PHE  60   7.379   8.125   6.135
  472    HD2  PHE  60           HD1      PHE  60   4.109   5.404   5.701
  473    HE1  PHE  60           HE2      PHE  60   5.891   9.724   7.260
  474    HE2  PHE  60           HE1      PHE  60   2.632   7.018   6.831
  475    HZ   PHE  60           HZ       PHE  60   3.514   9.179   7.595
  476    H    ILE  61           H        ILE  61   5.587   3.988   3.210
  477    HA   ILE  61           HA       ILE  61   3.410   5.488   1.865
  478    HB   ILE  61           HB       ILE  61   4.438   2.667   1.214
  479   HG12  ILE  61          2HG1      ILE  61   4.627   5.230  -0.450
  480   HG13  ILE  61          1HG1      ILE  61   5.971   4.440   0.365
  481   HG21  ILE  61          1HG2      ILE  61   2.808   2.648  -0.629
  482   HG22  ILE  61          2HG2      ILE  61   2.215   4.236  -0.139
  483   HG23  ILE  61          3HG2      ILE  61   1.996   2.847   0.924
  484   HD11  ILE  61          3HD1      ILE  61   5.692   2.493  -1.113
  485   HD12  ILE  61          1HD1      ILE  61   6.020   3.984  -1.994
  486   HD13  ILE  61          2HD1      ILE  61   4.383   3.334  -1.947
  487    H    SER  62           H        SER  62   1.898   5.581   3.522
  488    HA   SER  62           HA       SER  62   1.625   3.393   5.426
  489    HB2  SER  62           2HB      SER  62   1.569   5.732   6.245
  490    HB3  SER  62           1HB      SER  62   0.096   6.019   5.325
  491    HG   SER  62           HG       SER  62   0.234   3.887   7.174
  492    H    VAL  63           H        VAL  63   0.773   1.704   4.200
  493    HA   VAL  63           HA       VAL  63  -1.780   2.078   2.789
  494    HB   VAL  63           HB       VAL  63  -0.204  -0.526   3.129
  495   HG11  VAL  63          1HG1      VAL  63  -2.570  -0.845   2.484
  496   HG12  VAL  63          2HG1      VAL  63  -1.479  -1.317   1.184
  497   HG13  VAL  63          3HG1      VAL  63  -2.342   0.219   1.092
  498   HG21  VAL  63          3HG2      VAL  63   0.749  -0.128   0.891
  499   HG22  VAL  63          1HG2      VAL  63   1.216   1.153   2.011
  500   HG23  VAL  63          2HG2      VAL  63  -0.048   1.447   0.813
  501    H    ASP  64           H        ASP  64  -3.543   2.157   4.114
  502    HA   ASP  64           HA       ASP  64  -3.632   0.425   6.518
  503    HB2  ASP  64           2HB      ASP  64  -5.116   1.995   7.543
  504    HB3  ASP  64           1HB      ASP  64  -3.792   2.924   6.864
  505    H    LYS  65           H        LYS  65  -5.834  -0.343   7.146
  506    HA   LYS  65           HA       LYS  65  -7.296  -1.438   4.823
  507    HB2  LYS  65           2HB      LYS  65  -6.889  -3.741   5.651
  508    HB3  LYS  65           1HB      LYS  65  -5.369  -2.938   5.257
  509    HG2  LYS  65           2HG      LYS  65  -4.850  -2.562   7.572
  510    HG3  LYS  65           1HG      LYS  65  -6.472  -3.038   8.083
  511    HD2  LYS  65           2HD      LYS  65  -6.028  -5.353   7.388
  512    HD3  LYS  65           1HD      LYS  65  -4.412  -4.891   6.836
  513    HE2  LYS  65           2HE      LYS  65  -3.830  -4.223   9.154
  514    HE3  LYS  65           1HE      LYS  65  -5.437  -4.726   9.693
  515    HZ1  LYS  65           3HZ      LYS  65  -3.451  -6.512   8.422
  516    HZ2  LYS  65           1HZ      LYS  65  -4.936  -6.963   9.093
  517    HZ3  LYS  65           2HZ      LYS  65  -3.698  -6.378  10.086
  518    H    GLU  66           H        GLU  66  -8.785  -3.323   5.933
  519    HA   GLU  66           HA       GLU  66 -10.441  -2.133   8.011
  520    HB2  GLU  66           2HB      GLU  66 -10.745  -4.784   6.533
  521    HB3  GLU  66           1HB      GLU  66 -11.956  -4.041   7.577
  522    HG2  GLU  66           2HG      GLU  66 -10.982  -3.071   4.876
  523    HG3  GLU  66           1HG      GLU  66 -12.598  -3.631   5.306
  524    H    ASN  67           H        ASN  67 -11.154  -3.519   9.847
  525    HA   ASN  67           HA       ASN  67  -8.887  -4.075  11.448
  526    HB2  ASN  67           2HB      ASN  67 -10.487  -4.493  13.258
  527    HB3  ASN  67           1HB      ASN  67 -10.962  -3.074  12.337
  528   HD21  ASN  67          1HD2      ASN  67 -11.826  -6.269  13.293
  529   HD22  ASN  67          2HD2      ASN  67 -13.397  -6.301  12.574
  530    H    ASP  68           H        ASP  68 -10.960  -6.174   9.614
  531    HA   ASP  68           HA       ASP  68  -9.845  -8.610  10.828
  532    HB2  ASP  68           2HB      ASP  68 -12.172  -8.192   8.927
  533    HB3  ASP  68           1HB      ASP  68 -11.555  -9.789   9.338
  534    H    ALA  69           H        ALA  69  -9.649  -6.704   7.918
  535    HA   ALA  69           HA       ALA  69  -8.811  -8.476   5.973
  536    HB1  ALA  69           3HB      ALA  69  -9.285  -6.098   5.545
  537    HB2  ALA  69           1HB      ALA  69  -7.712  -6.554   4.884
  538    HB3  ALA  69           2HB      ALA  69  -7.805  -5.638   6.390
  539    H    ASN  70           H        ASN  70  -6.997  -9.641   5.533
  540    HA   ASN  70           HA       ASN  70  -4.724  -9.513   7.443
  541    HB2  ASN  70           2HB      ASN  70  -5.760 -11.761   5.670
  542    HB3  ASN  70           1HB      ASN  70  -4.224 -11.852   6.529
  543   HD21  ASN  70          1HD2      ASN  70  -4.222 -12.148   8.749
  544   HD22  ASN  70          2HD2      ASN  70  -5.642 -12.562   9.643
  545    H    TRP  71           H        TRP  71  -2.798  -8.792   6.747
  546    HA   TRP  71           HA       TRP  71  -2.336  -8.009   4.032
  547    HB2  TRP  71           2HB      TRP  71  -0.419  -8.167   6.385
  548    HB3  TRP  71           1HB      TRP  71   0.013  -7.512   4.808
  549    HD1  TRP  71           HD1      TRP  71  -0.933  -6.325   8.056
  550    HE1  TRP  71           HE1      TRP  71  -1.853  -3.928   8.001
  551    HE3  TRP  71           HE3      TRP  71  -1.914  -5.975   3.053
  552    HZ2  TRP  71           HZ2      TRP  71  -2.853  -2.133   6.084
  553    HZ3  TRP  71           HZ3      TRP  71  -2.865  -3.877   2.192
  554    HH2  TRP  71           HH2      TRP  71  -3.326  -1.997   3.680
  555    H    GLU  72           H        GLU  72  -1.910 -10.999   5.692
  556    HA   GLU  72           HA       GLU  72   0.312 -12.092   4.369
  557    HB2  GLU  72           2HB      GLU  72  -0.855 -13.111   6.341
  558    HB3  GLU  72           1HB      GLU  72  -2.186 -13.583   5.291
  559    HG2  GLU  72           2HG      GLU  72  -0.593 -15.003   3.991
  560    HG3  GLU  72           1HG      GLU  72   0.679 -14.578   5.137
  561    H    THR  73           H        THR  73  -3.029 -11.765   3.355
  562    HA   THR  73           HA       THR  73  -2.758 -13.278   0.901
  563    HB   THR  73           HB       THR  73  -5.031 -11.465   1.829
  564    HG1  THR  73           HG1      THR  73  -4.609 -14.267   2.213
  565   HG21  THR  73          3HG2      THR  73  -6.444 -12.829   0.322
  566   HG22  THR  73          1HG2      THR  73  -5.023 -13.735  -0.201
  567   HG23  THR  73          2HG2      THR  73  -5.165 -12.018  -0.583
  568    H    VAL  74           H        VAL  74  -2.939  -9.871   1.900
  569    HA   VAL  74           HA       VAL  74  -3.273  -8.783  -0.732
  570    HB   VAL  74           HB       VAL  74  -2.565  -7.336   1.861
  571   HG11  VAL  74          1HG1      VAL  74  -3.761  -6.214  -0.710
  572   HG12  VAL  74          2HG1      VAL  74  -2.130  -5.921  -0.108
  573   HG13  VAL  74          3HG1      VAL  74  -3.516  -5.319   0.794
  574   HG21  VAL  74          3HG2      VAL  74  -4.972  -6.900   2.113
  575   HG22  VAL  74          1HG2      VAL  74  -4.645  -8.635   2.103
  576   HG23  VAL  74          2HG2      VAL  74  -5.316  -7.856   0.669
  577    H    LEU  75           H        LEU  75  -0.522  -9.209   1.418
  578    HA   LEU  75           HA       LEU  75   1.158  -7.176   0.491
  579    HB2  LEU  75           2HB      LEU  75   1.261  -8.613   2.687
  580    HB3  LEU  75           1HB      LEU  75   2.294  -9.676   1.766
  581    HG   LEU  75           HG       LEU  75   2.908  -6.733   2.296
  582   HD11  LEU  75          1HD1      LEU  75   4.504  -7.519   4.009
  583   HD12  LEU  75          2HD1      LEU  75   3.958  -9.180   3.761
  584   HD13  LEU  75          3HD1      LEU  75   2.846  -7.970   4.405
  585   HD21  LEU  75          3HD2      LEU  75   5.226  -7.284   1.630
  586   HD22  LEU  75          1HD2      LEU  75   4.094  -7.566   0.311
  587   HD23  LEU  75          2HD2      LEU  75   4.727  -8.931   1.233
  588    HA   PRO  76           HA       PRO  76   3.370 -10.738  -2.357
  589    HB2  PRO  76           2HB      PRO  76   0.680 -11.910  -3.145
  590    HB3  PRO  76           1HB      PRO  76   2.289 -12.673  -3.142
  591    HG2  PRO  76           2HG      PRO  76   0.609 -13.208  -1.187
  592    HG3  PRO  76           1HG      PRO  76   2.327 -12.922  -0.821
  593    HD2  PRO  76           2HD      PRO  76  -0.022 -11.100  -0.390
  594    HD3  PRO  76           1HD      PRO  76   1.433 -11.315   0.603
  595    H    LYS  77           H        LYS  77   0.250  -9.143  -2.879
  596    HA   LYS  77           HA       LYS  77   0.713  -8.587  -5.698
  597    HB2  LYS  77           2HB      LYS  77  -1.510  -7.688  -3.811
  598    HB3  LYS  77           1HB      LYS  77  -1.452  -7.284  -5.521
  599    HG2  LYS  77           2HG      LYS  77  -2.978  -9.104  -5.318
  600    HG3  LYS  77           1HG      LYS  77  -1.505  -9.769  -6.027
  601    HD2  LYS  77           2HD      LYS  77  -0.854 -10.617  -3.753
  602    HD3  LYS  77           1HD      LYS  77  -2.392 -10.024  -3.121
  603    HE2  LYS  77           2HE      LYS  77  -2.090 -12.122  -5.303
  604    HE3  LYS  77           1HE      LYS  77  -2.418 -12.465  -3.606
  605    HZ1  LYS  77           3HZ      LYS  77  -4.497 -11.251  -3.805
  606    HZ2  LYS  77           1HZ      LYS  77  -4.425 -12.517  -4.920
  607    HZ3  LYS  77           2HZ      LYS  77  -4.177 -10.928  -5.431
  608    H    VAL  78           H        VAL  78   0.717  -6.801  -2.630
  609    HA   VAL  78           HA       VAL  78   1.370  -4.203  -3.589
  610    HB   VAL  78           HB       VAL  78   2.067  -5.468  -0.886
  611   HG11  VAL  78          1HG1      VAL  78   2.060  -3.171   0.022
  612   HG12  VAL  78          2HG1      VAL  78   1.796  -2.525  -1.599
  613   HG13  VAL  78          3HG1      VAL  78   3.293  -3.377  -1.222
  614   HG21  VAL  78          3HG2      VAL  78  -0.455  -3.954  -1.662
  615   HG22  VAL  78          1HG2      VAL  78  -0.053  -4.521  -0.037
  616   HG23  VAL  78          2HG2      VAL  78  -0.336  -5.685  -1.334
  617    H    GLU  79           H        GLU  79   3.251  -6.991  -2.729
  618    HA   GLU  79           HA       GLU  79   5.887  -6.000  -2.628
  619    HB2  GLU  79           2HB      GLU  79   5.174  -8.173  -1.662
  620    HB3  GLU  79           1HB      GLU  79   4.776  -8.784  -3.260
  621    HG2  GLU  79           2HG      GLU  79   6.824  -9.792  -2.660
  622    HG3  GLU  79           1HG      GLU  79   7.234  -8.548  -3.842
  623    H    ALA  80           H        ALA  80   3.990  -7.627  -5.102
  624    HA   ALA  80           HA       ALA  80   5.758  -7.778  -7.239
  625    HB1  ALA  80           3HB      ALA  80   3.600  -8.965  -7.136
  626    HB2  ALA  80           1HB      ALA  80   3.745  -8.051  -8.641
  627    HB3  ALA  80           2HB      ALA  80   2.739  -7.437  -7.326
  628    H    VAL  81           H        VAL  81   3.885  -5.049  -6.061
  629    HA   VAL  81           HA       VAL  81   4.058  -3.376  -8.379
  630    HB   VAL  81           HB       VAL  81   3.477  -2.775  -5.451
  631   HG11  VAL  81          1HG1      VAL  81   3.320  -0.800  -7.754
  632   HG12  VAL  81          2HG1      VAL  81   4.377  -0.706  -6.347
  633   HG13  VAL  81          3HG1      VAL  81   2.634  -0.539  -6.150
  634   HG21  VAL  81          3HG2      VAL  81   1.141  -2.555  -6.208
  635   HG22  VAL  81          1HG2      VAL  81   1.792  -4.148  -6.591
  636   HG23  VAL  81          2HG2      VAL  81   1.629  -2.931  -7.860
  637    H    PHE  82           H        PHE  82   5.789  -3.247  -5.227
  638    HA   PHE  82           HA       PHE  82   7.725  -1.341  -6.009
  639    HB2  PHE  82           2HB      PHE  82   7.985  -3.460  -3.837
  640    HB3  PHE  82           1HB      PHE  82   8.883  -1.944  -3.937
  641    HD1  PHE  82           HD1      PHE  82   6.861   0.044  -4.610
  642    HD2  PHE  82           HD2      PHE  82   6.578  -3.289  -1.943
  643    HE1  PHE  82           HE1      PHE  82   5.055   1.172  -3.386
  644    HE2  PHE  82           HE2      PHE  82   4.778  -2.140  -0.728
  645    HZ   PHE  82           HZ       PHE  82   4.010   0.064  -1.470
  646    H    GLU  83           H        GLU  83   7.672  -4.825  -6.450
  647    HA   GLU  83           HA       GLU  83  10.467  -5.074  -7.150
  648    HB2  GLU  83           2HB      GLU  83   8.115  -6.993  -7.314
  649    HB3  GLU  83           1HB      GLU  83   9.719  -7.426  -7.901
  650    HG2  GLU  83           2HG      GLU  83   9.164  -6.551  -5.053
  651    HG3  GLU  83           1HG      GLU  83   9.142  -8.234  -5.580
  652    H    LEU  84           H        LEU  84   7.441  -4.618  -8.889
  653    HA   LEU  84           HA       LEU  84   6.753  -4.839 -11.039
  654    HB2  LEU  84           2HB      LEU  84   9.541  -3.731 -11.588
  655    HB3  LEU  84           1HB      LEU  84   8.281  -3.861 -12.809
  656    HG   LEU  84           HG       LEU  84   8.204  -2.093 -10.326
  657   HD11  LEU  84          1HD1      LEU  84   8.383  -1.319 -13.258
  658   HD12  LEU  84          2HD1      LEU  84   9.692  -1.228 -12.074
  659   HD13  LEU  84          3HD1      LEU  84   8.267  -0.213 -11.885
  660   HD21  LEU  84          3HD2      LEU  84   6.067  -1.211 -11.179
  661   HD22  LEU  84          1HD2      LEU  84   5.948  -2.931 -10.811
  662   HD23  LEU  84          2HD2      LEU  84   6.086  -2.397 -12.489
  663    H    GLU  85           H        GLU  85   7.499  -7.152  -9.868
  664    HA   GLU  85           HA       GLU  85   8.397  -9.222  -9.933
  665    HB2  GLU  85           2HB      GLU  85   7.890  -8.850 -12.919
  666    HB3  GLU  85           1HB      GLU  85   8.299 -10.390 -12.192
  667    HG2  GLU  85           2HG      GLU  85   5.945 -10.367 -12.589
  668    HG3  GLU  85           1HG      GLU  85   6.189 -10.265 -10.846
  669    H    HIS  86           H        HIS  86  10.100 -10.121 -12.446
  670    HA   HIS  86           HA       HIS  86  12.447  -8.338 -12.085
  671    HB2  HIS  86           2HB      HIS  86  12.416 -11.312 -12.792
  672    HB3  HIS  86           1HB      HIS  86  13.854 -10.296 -12.835
  673    HD1  HIS  86           HD1      HIS  86  14.385  -9.113 -10.382
  674    HD2  HIS  86           HD2      HIS  86  12.087 -12.573 -10.399
  675    HE1  HIS  86           HE1      HIS  86  14.512 -10.018  -8.041
  676    HE2  HIS  86           HE2      HIS  86  12.912 -11.955  -8.034
  677    H    HIS  87           H        HIS  87  10.502  -7.454 -13.691
  678    HA   HIS  87           HA       HIS  87  11.141  -8.021 -16.485
  679    HB2  HIS  87           2HB      HIS  87   9.324  -5.987 -15.122
  680    HB3  HIS  87           1HB      HIS  87   9.594  -5.981 -16.862
  681    HD1  HIS  87           HD1      HIS  87   8.723  -8.109 -18.196
  682    HD2  HIS  87           HD2      HIS  87   7.461  -7.835 -14.242
  683    HE1  HIS  87           HE1      HIS  87   6.789  -9.702 -17.989
  684    HE2  HIS  87           HE2      HIS  87   6.171  -9.648 -15.552
  685    H    HIS  88           H        HIS  88  11.226  -5.495 -17.642
  686    HA   HIS  88           HA       HIS  88  13.914  -4.656 -17.104
  687    HB2  HIS  88           2HB      HIS  88  13.594  -2.991 -18.901
  688    HB3  HIS  88           1HB      HIS  88  13.067  -4.586 -19.409
  689    HD1  HIS  88           HD1      HIS  88  11.930  -1.103 -19.082
  690    HD2  HIS  88           HD2      HIS  88  10.163  -4.827 -19.633
  691    HE1  HIS  88           HE1      HIS  88   9.600  -0.633 -19.904
  692    HE2  HIS  88           HE2      HIS  88   8.589  -2.896 -20.310
  693    H    HIS  89           H        HIS  89  13.769  -4.167 -14.921
  694    HA   HIS  89           HA       HIS  89  12.374  -1.698 -14.074
  695    HB2  HIS  89           2HB      HIS  89  12.029  -3.931 -12.853
  696    HB3  HIS  89           1HB      HIS  89  13.715  -3.856 -12.358
  697    HD1  HIS  89           HD1      HIS  89  12.438  -4.026  -9.946
  698    HD2  HIS  89           HD2      HIS  89  12.123  -0.391 -11.957
  699    HE1  HIS  89           HE1      HIS  89  11.727  -2.349  -8.214
  700    HE2  HIS  89           HE2      HIS  89  11.751  -0.142  -9.410
  701    H    HIS  90           H        HIS  90  14.886  -1.959 -15.710
  702    HA   HIS  90           HA       HIS  90  16.918  -1.056 -16.043
  703    HB2  HIS  90           2HB      HIS  90  16.271   0.648 -13.605
  704    HB3  HIS  90           1HB      HIS  90  17.602   0.957 -14.720
  705    HD1  HIS  90           HD1      HIS  90  17.001   1.960 -17.039
  706    HD2  HIS  90           HD2      HIS  90  13.699   1.318 -14.591
  707    HE1  HIS  90           HE1      HIS  90  15.080   3.117 -18.177
  708    HE2  HIS  90           HE2      HIS  90  13.111   2.769 -16.645
  709    H    HIS  91           H        HIS  91  16.355  -3.185 -13.848
  710    HA   HIS  91           HA       HIS  91  18.870  -4.129 -13.267
  711    HB2  HIS  91           2HB      HIS  91  19.151  -2.099 -11.827
  712    HB3  HIS  91           1HB      HIS  91  17.698  -2.525 -10.933
  713    HD1  HIS  91           HD1      HIS  91  21.218  -3.788 -11.559
  714    HD2  HIS  91           HD2      HIS  91  18.136  -4.249  -8.798
  715    HE1  HIS  91           HE1      HIS  91  22.198  -5.127  -9.671
  716    HE2  HIS  91           HE2      HIS  91  20.268  -5.557  -8.118
  Start of MODEL    3
    1    H1   MET   1           1H       MET   1  13.402   2.163  -5.957
    2    H2   MET   1           2H       MET   1  13.048   3.809  -5.848
    3    H3   MET   1           3H       MET   1  11.990   2.770  -6.656
    4    HA   MET   1           HA       MET   1  12.610   2.723  -3.767
    5    HB2  MET   1           2HB      MET   1  10.024   3.482  -5.192
    6    HB3  MET   1           1HB      MET   1  10.253   3.418  -3.450
    7    HG2  MET   1           2HG      MET   1  11.833   5.281  -3.571
    8    HG3  MET   1           1HG      MET   1  11.659   5.336  -5.325
    9    HE1  MET   1           3HE      MET   1   8.397   4.736  -5.531
   10    HE2  MET   1           1HE      MET   1   9.284   5.883  -6.538
   11    HE3  MET   1           2HE      MET   1   7.849   6.407  -5.657
   12    H    LYS   2           H        LYS   2  12.416   0.741  -2.942
   13    HA   LYS   2           HA       LYS   2  10.298  -1.079  -3.933
   14    HB2  LYS   2           2HB      LYS   2  13.072  -1.907  -2.938
   15    HB3  LYS   2           1HB      LYS   2  11.777  -3.015  -3.377
   16    HG2  LYS   2           2HG      LYS   2  11.881  -2.084  -5.725
   17    HG3  LYS   2           1HG      LYS   2  13.303  -1.164  -5.233
   18    HD2  LYS   2           2HD      LYS   2  13.040  -4.199  -5.327
   19    HD3  LYS   2           1HD      LYS   2  14.009  -3.190  -6.401
   20    HE2  LYS   2           2HE      LYS   2  14.472  -3.612  -3.433
   21    HE3  LYS   2           1HE      LYS   2  15.435  -4.286  -4.744
   22    HZ1  LYS   2           3HZ      LYS   2  15.141  -1.389  -4.159
   23    HZ2  LYS   2           1HZ      LYS   2  16.123  -2.066  -5.356
   24    HZ3  LYS   2           2HZ      LYS   2  16.463  -2.339  -3.724
   25    H    ILE   3           H        ILE   3  10.097  -2.898  -2.029
   26    HA   ILE   3           HA       ILE   3   9.461  -1.570   0.459
   27    HB   ILE   3           HB       ILE   3   9.605  -4.574  -0.120
   28   HG12  ILE   3          2HG1      ILE   3   7.163  -2.734  -0.167
   29   HG13  ILE   3          1HG1      ILE   3   7.952  -3.403  -1.587
   30   HG21  ILE   3          1HG2      ILE   3   8.263  -3.115   2.199
   31   HG22  ILE   3          2HG2      ILE   3   9.740  -4.075   2.297
   32   HG23  ILE   3          3HG2      ILE   3   8.208  -4.856   1.908
   33   HD11  ILE   3          3HD1      ILE   3   5.916  -4.597  -1.091
   34   HD12  ILE   3          1HD1      ILE   3   6.486  -4.966   0.536
   35   HD13  ILE   3          2HD1      ILE   3   7.303  -5.662  -0.865
   36    H    ILE   4           H        ILE   4  11.143  -0.852   1.650
   37    HA   ILE   4           HA       ILE   4  13.733  -2.176   1.728
   38    HB   ILE   4           HB       ILE   4  12.615   0.431   2.782
   39   HG12  ILE   4          2HG1      ILE   4  14.563   1.437   1.680
   40   HG13  ILE   4          1HG1      ILE   4  15.244  -0.144   1.357
   41   HG21  ILE   4          1HG2      ILE   4  14.643   0.939   4.100
   42   HG22  ILE   4          2HG2      ILE   4  15.188  -0.728   3.900
   43   HG23  ILE   4          3HG2      ILE   4  13.709  -0.384   4.800
   44   HD11  ILE   4          3HD1      ILE   4  13.437  -0.607  -0.210
   45   HD12  ILE   4          1HD1      ILE   4  14.309   0.867  -0.626
   46   HD13  ILE   4          2HD1      ILE   4  12.728   0.971   0.145
   47    H    SER   5           H        SER   5  11.149  -1.373   4.049
   48    HA   SER   5           HA       SER   5  11.331  -3.922   5.358
   49    HB2  SER   5           2HB      SER   5  11.878  -3.012   7.640
   50    HB3  SER   5           1HB      SER   5  13.221  -2.845   6.507
   51    HG   SER   5           HG       SER   5  12.909  -0.925   7.668
   52    H    ILE   6           H        ILE   6   9.485  -4.391   6.539
   53    HA   ILE   6           HA       ILE   6   7.318  -2.413   6.659
   54    HB   ILE   6           HB       ILE   6   7.310  -5.288   7.707
   55   HG12  ILE   6          2HG1      ILE   6   6.256  -4.328   5.002
   56   HG13  ILE   6          1HG1      ILE   6   7.752  -5.227   5.224
   57   HG21  ILE   6          1HG2      ILE   6   4.840  -5.063   7.635
   58   HG22  ILE   6          2HG2      ILE   6   5.004  -3.396   7.081
   59   HG23  ILE   6          3HG2      ILE   6   5.567  -3.850   8.691
   60   HD11  ILE   6          3HD1      ILE   6   6.470  -7.152   6.050
   61   HD12  ILE   6          1HD1      ILE   6   5.959  -6.661   4.434
   62   HD13  ILE   6          2HD1      ILE   6   4.972  -6.243   5.832
   63    H    SER   7           H        SER   7   7.859  -0.952   8.196
   64    HA   SER   7           HA       SER   7   9.254  -1.679  10.635
   65    HB2  SER   7           2HB      SER   7   9.133   0.886  10.959
   66    HB3  SER   7           1HB      SER   7  10.072   0.286   9.592
   67    HG   SER   7           HG       SER   7   7.354   0.881   9.223
   68    H    GLU   8           H        GLU   8   8.184   0.303  12.390
   69    HA   GLU   8           HA       GLU   8   6.551  -1.401  13.858
   70    HB2  GLU   8           2HB      GLU   8   6.853   1.591  14.269
   71    HB3  GLU   8           1HB      GLU   8   6.343   0.425  15.471
   72    HG2  GLU   8           2HG      GLU   8   9.086   0.545  14.202
   73    HG3  GLU   8           1HG      GLU   8   8.667   1.151  15.803
   74    H    THR   9           H        THR   9   4.483  -1.166  14.667
   75    HA   THR   9           HA       THR   9   2.510   0.637  13.582
   76    HB   THR   9           HB       THR   9   2.383  -0.924  11.781
   77    HG1  THR   9           HG1      THR   9   0.340  -0.390  12.428
   78   HG21  THR   9          3HG2      THR   9   3.599  -2.834  12.714
   79   HG22  THR   9          1HG2      THR   9   2.060  -3.363  12.035
   80   HG23  THR   9          2HG2      THR   9   2.243  -3.200  13.784
   81    HA   PRO  10           HA       PRO  10   2.089  -0.974  18.017
   82    HB2  PRO  10           2HB      PRO  10   2.212   1.426  19.320
   83    HB3  PRO  10           1HB      PRO  10   3.671   0.546  18.817
   84    HG2  PRO  10           2HG      PRO  10   2.304   2.838  17.444
   85    HG3  PRO  10           1HG      PRO  10   4.035   2.601  17.781
   86    HD2  PRO  10           2HD      PRO  10   2.970   2.052  15.348
   87    HD3  PRO  10           1HD      PRO  10   4.315   1.105  16.018
   88    H    ASN  11           H        ASN  11   0.374   1.225  15.992
   89    HA   ASN  11           HA       ASN  11  -1.982   1.453  17.702
   90    HB2  ASN  11           2HB      ASN  11  -1.346   3.337  16.196
   91    HB3  ASN  11           1HB      ASN  11  -1.569   2.301  14.794
   92   HD21  ASN  11          1HD2      ASN  11  -3.196   4.028  17.379
   93   HD22  ASN  11          2HD2      ASN  11  -4.777   3.978  16.681
   94    H    HIS  12           H        HIS  12  -0.776  -0.510  15.078
   95    HA   HIS  12           HA       HIS  12  -1.489  -2.284  13.892
   96    HB2  HIS  12           2HB      HIS  12  -2.316  -3.106  16.185
   97    HB3  HIS  12           1HB      HIS  12  -3.912  -2.531  15.732
   98    HD1  HIS  12           HD1      HIS  12  -1.376  -5.183  14.893
   99    HD2  HIS  12           HD2      HIS  12  -5.314  -4.252  13.989
  100    HE1  HIS  12           HE1      HIS  12  -2.288  -7.197  13.727
  101    HE2  HIS  12           HE2      HIS  12  -4.727  -6.709  13.429
  102    H    ASN  13           H        ASN  13  -3.339  -3.011  12.414
  103    HA   ASN  13           HA       ASN  13  -4.840  -2.673  10.781
  104    HB2  ASN  13           2HB      ASN  13  -5.631  -0.176  12.322
  105    HB3  ASN  13           1HB      ASN  13  -6.307  -0.531  10.735
  106   HD21  ASN  13          1HD2      ASN  13  -8.397  -0.674  11.647
  107   HD22  ASN  13          2HD2      ASN  13  -8.897  -2.038  12.579
  108    H    THR  14           H        THR  14  -3.112   0.375  11.506
  109    HA   THR  14           HA       THR  14  -2.440   0.593   8.639
  110    HB   THR  14           HB       THR  14  -3.490   2.607   9.281
  111    HG1  THR  14           HG1      THR  14  -1.957   3.583   8.261
  112   HG21  THR  14          3HG2      THR  14  -1.677   2.738  11.739
  113   HG22  THR  14          1HG2      THR  14  -3.407   2.382  11.740
  114   HG23  THR  14          2HG2      THR  14  -2.835   3.976  11.245
  115    H    MET  15           H        MET  15  -0.575  -0.321   8.119
  116    HA   MET  15           HA       MET  15   1.677  -0.328  10.035
  117    HB2  MET  15           2HB      MET  15   1.364  -1.886   7.435
  118    HB3  MET  15           1HB      MET  15   2.754  -1.971   8.507
  119    HG2  MET  15           2HG      MET  15   1.123  -2.771  10.310
  120    HG3  MET  15           1HG      MET  15  -0.037  -2.979   9.000
  121    HE1  MET  15           3HE      MET  15   2.042  -5.567   6.729
  122    HE2  MET  15           1HE      MET  15   2.338  -3.829   6.689
  123    HE3  MET  15           2HE      MET  15   0.684  -4.442   6.736
  124    H    LYS  16           H        LYS  16   3.584   0.569   9.596
  125    HA   LYS  16           HA       LYS  16   3.767   2.607   7.504
  126    HB2  LYS  16           2HB      LYS  16   4.399   3.275   9.756
  127    HB3  LYS  16           1HB      LYS  16   5.487   1.903   9.919
  128    HG2  LYS  16           2HG      LYS  16   6.924   2.903   8.120
  129    HG3  LYS  16           1HG      LYS  16   5.877   4.325   8.127
  130    HD2  LYS  16           2HD      LYS  16   6.562   4.961  10.321
  131    HD3  LYS  16           1HD      LYS  16   7.217   3.360  10.679
  132    HE2  LYS  16           2HE      LYS  16   9.043   4.927  10.336
  133    HE3  LYS  16           1HE      LYS  16   9.026   3.760   9.016
  134    HZ1  LYS  16           3HZ      LYS  16   8.043   5.366   7.599
  135    HZ2  LYS  16           1HZ      LYS  16   9.390   6.077   8.319
  136    HZ3  LYS  16           2HZ      LYS  16   7.836   6.469   8.858
  137    H    ILE  17           H        ILE  17   4.453   1.889   5.577
  138    HA   ILE  17           HA       ILE  17   6.489  -0.204   5.309
  139    HB   ILE  17           HB       ILE  17   4.942   1.332   3.165
  140   HG12  ILE  17          2HG1      ILE  17   4.574  -1.527   4.174
  141   HG13  ILE  17          1HG1      ILE  17   3.507  -0.177   4.529
  142   HG21  ILE  17          1HG2      ILE  17   5.831  -0.338   1.554
  143   HG22  ILE  17          2HG2      ILE  17   6.806  -1.060   2.836
  144   HG23  ILE  17          3HG2      ILE  17   7.132   0.590   2.303
  145   HD11  ILE  17          3HD1      ILE  17   2.559  -1.611   2.828
  146   HD12  ILE  17          1HD1      ILE  17   3.987  -1.406   1.815
  147   HD13  ILE  17          2HD1      ILE  17   2.930  -0.030   2.140
  148    H    THR  18           H        THR  18   8.481   0.491   5.592
  149    HA   THR  18           HA       THR  18   9.427   3.160   5.054
  150    HB   THR  18           HB       THR  18  10.920   0.598   5.790
  151    HG1  THR  18           HG1      THR  18   9.520   1.321   7.404
  152   HG21  THR  18          3HG2      THR  18  11.954   3.460   5.877
  153   HG22  THR  18          1HG2      THR  18  12.467   2.226   4.721
  154   HG23  THR  18          2HG2      THR  18  12.811   2.023   6.439
  155    H    LEU  19           H        LEU  19  10.037   3.888   3.117
  156    HA   LEU  19           HA       LEU  19  10.755   2.032   0.935
  157    HB2  LEU  19           2HB      LEU  19   9.976   4.977   0.849
  158    HB3  LEU  19           1HB      LEU  19  10.352   3.988  -0.552
  159    HG   LEU  19           HG       LEU  19   7.952   3.649   1.293
  160   HD11  LEU  19          1HD1      LEU  19   7.731   5.567  -0.210
  161   HD12  LEU  19          2HD1      LEU  19   6.619   4.283  -0.677
  162   HD13  LEU  19          3HD1      LEU  19   8.097   4.545  -1.605
  163   HD21  LEU  19          3HD2      LEU  19   8.710   1.987  -1.140
  164   HD22  LEU  19          1HD2      LEU  19   7.179   1.889  -0.265
  165   HD23  LEU  19          2HD2      LEU  19   8.681   1.435   0.536
  166    H    SER  20           H        SER  20  12.309   3.523  -0.662
  167    HA   SER  20           HA       SER  20  14.846   3.723   0.656
  168    HB2  SER  20           2HB      SER  20  15.644   4.324  -1.651
  169    HB3  SER  20           1HB      SER  20  14.683   2.845  -1.607
  170    HG   SER  20           HG       SER  20  13.978   5.396  -2.575
  171    H    GLU  21           H        GLU  21  12.438   5.884   0.932
  172    HA   GLU  21           HA       GLU  21  12.185   8.070   1.423
  173    HB2  GLU  21           2HB      GLU  21  15.210   7.957   1.752
  174    HB3  GLU  21           1HB      GLU  21  14.274   9.405   2.105
  175    HG2  GLU  21           2HG      GLU  21  13.043   8.212   3.846
  176    HG3  GLU  21           1HG      GLU  21  13.916   6.730   3.470
  177    H    SER  22           H        SER  22  13.354  10.382   0.842
  178    HA   SER  22           HA       SER  22  14.353  10.550  -1.881
  179    HB2  SER  22           2HB      SER  22  11.815  10.600  -2.081
  180    HB3  SER  22           1HB      SER  22  11.806  12.036  -1.062
  181    HG   SER  22           HG       SER  22  12.304  11.798  -3.710
  182    H    ARG  23           H        ARG  23  14.101  13.391  -2.068
  183    HA   ARG  23           HA       ARG  23  16.203  14.286  -0.360
  184    HB2  ARG  23           2HB      ARG  23  14.352  15.959  -2.114
  185    HB3  ARG  23           1HB      ARG  23  15.939  16.437  -1.518
  186    HG2  ARG  23           2HG      ARG  23  15.404  14.183  -3.476
  187    HG3  ARG  23           1HG      ARG  23  15.953  15.800  -3.911
  188    HD2  ARG  23           2HD      ARG  23  18.064  15.445  -2.742
  189    HD3  ARG  23           1HD      ARG  23  17.496  13.887  -2.130
  190    HE   ARG  23           HE       ARG  23  17.906  12.921  -4.174
  191   HH11  ARG  23          1HH1      ARG  23  18.235  16.415  -4.565
  192   HH12  ARG  23          2HH1      ARG  23  18.930  16.273  -6.150
  193   HH21  ARG  23          1HH2      ARG  23  18.811  12.790  -6.251
  194   HH22  ARG  23          2HH2      ARG  23  19.254  14.248  -7.094
  195    H    GLU  24           H        GLU  24  15.556  14.098   1.753
  196    HA   GLU  24           HA       GLU  24  14.613  14.457   3.749
  197    HB2  GLU  24           2HB      GLU  24  13.509  17.006   2.510
  198    HB3  GLU  24           1HB      GLU  24  13.442  16.625   4.227
  199    HG2  GLU  24           2HG      GLU  24  15.909  16.621   4.320
  200    HG3  GLU  24           1HG      GLU  24  15.971  17.010   2.602
  201    H    GLY  25           H        GLY  25  12.011  15.764   1.710
  202    HA2  GLY  25           2HA      GLY  25  10.336  13.389   2.158
  203    HA3  GLY  25           1HA      GLY  25   9.735  14.937   2.743
  204    H    MET  26           H        MET  26   8.700  13.136   0.654
  205    HA   MET  26           HA       MET  26   8.467  15.061  -1.575
  206    HB2  MET  26           2HB      MET  26   8.394  13.168  -3.198
  207    HB3  MET  26           1HB      MET  26   9.943  13.246  -2.371
  208    HG2  MET  26           2HG      MET  26   9.283  11.395  -0.912
  209    HG3  MET  26           1HG      MET  26   7.698  11.330  -1.685
  210    HE1  MET  26           3HE      MET  26   9.658   8.054  -2.853
  211    HE2  MET  26           1HE      MET  26   8.229   8.638  -2.004
  212    HE3  MET  26           2HE      MET  26   9.831   8.878  -1.305
  213    H    THR  27           H        THR  27   6.445  15.592  -1.922
  214    HA   THR  27           HA       THR  27   4.233  15.821  -1.824
  215    HB   THR  27           HB       THR  27   4.454  14.512  -3.842
  216    HG1  THR  27           HG1      THR  27   2.187  13.229  -3.217
  217   HG21  THR  27          3HG2      THR  27   4.057  12.100  -3.971
  218   HG22  THR  27          1HG2      THR  27   3.942  12.005  -2.213
  219   HG23  THR  27          2HG2      THR  27   5.471  12.448  -2.976
  220    H    SER  28           H        SER  28   1.978  14.658  -1.280
  221    HA   SER  28           HA       SER  28   1.975  13.153   1.193
  222    HB2  SER  28           2HB      SER  28   0.647  14.998   2.404
  223    HB3  SER  28           1HB      SER  28   2.372  15.296   2.197
  224    HG   SER  28           HG       SER  28   1.686  16.479   0.224
  225    H    ASP  29           H        ASP  29   0.643  11.655   0.402
  226    HA   ASP  29           HA       ASP  29  -1.843  12.413  -1.022
  227    HB2  ASP  29           2HB      ASP  29  -0.301   9.791  -1.304
  228    HB3  ASP  29           1HB      ASP  29  -1.628  10.367  -2.307
  229    H    THR  30           H        THR  30  -3.662  11.009  -0.713
  230    HA   THR  30           HA       THR  30  -3.390   8.712   1.093
  231    HB   THR  30           HB       THR  30  -5.881  10.498   1.218
  232    HG1  THR  30           HG1      THR  30  -3.839  11.427   2.134
  233   HG21  THR  30          3HG2      THR  30  -4.920   8.229   3.018
  234   HG22  THR  30          1HG2      THR  30  -6.230   8.123   1.835
  235   HG23  THR  30          2HG2      THR  30  -6.397   9.170   3.244
  236    H    TYR  31           H        TYR  31  -3.438   7.313  -0.586
  237    HA   TYR  31           HA       TYR  31  -5.279   7.539  -2.818
  238    HB2  TYR  31           2HB      TYR  31  -3.460   5.196  -2.080
  239    HB3  TYR  31           1HB      TYR  31  -4.191   5.509  -3.644
  240    HD1  TYR  31           HD1      TYR  31  -3.492   8.010  -4.597
  241    HD2  TYR  31           HD2      TYR  31  -1.154   5.609  -1.956
  242    HE1  TYR  31           HE1      TYR  31  -1.456   9.150  -5.357
  243    HE2  TYR  31           HE2      TYR  31   0.886   6.747  -2.714
  244    HH   TYR  31           HH       TYR  31   0.850   9.605  -4.502
  245    H    THR  32           H        THR  32  -7.397   7.001  -2.423
  246    HA   THR  32           HA       THR  32  -8.003   4.615  -0.760
  247    HB   THR  32           HB       THR  32 -10.216   5.783  -0.224
  248    HG1  THR  32           HG1      THR  32 -10.089   8.142  -0.462
  249   HG21  THR  32          3HG2      THR  32  -9.276   7.238   1.536
  250   HG22  THR  32          1HG2      THR  32  -7.694   7.172   0.755
  251   HG23  THR  32          2HG2      THR  32  -8.399   5.710   1.446
  252    H    LYS  33           H        LYS  33  -9.840   6.716  -3.001
  253    HA   LYS  33           HA       LYS  33 -10.701   4.309  -4.514
  254    HB2  LYS  33           2HB      LYS  33 -12.695   5.697  -5.187
  255    HB3  LYS  33           1HB      LYS  33 -12.619   5.369  -3.463
  256    HG2  LYS  33           2HG      LYS  33 -11.902   7.622  -2.986
  257    HG3  LYS  33           1HG      LYS  33 -11.692   7.974  -4.702
  258    HD2  LYS  33           2HD      LYS  33 -14.137   7.733  -5.051
  259    HD3  LYS  33           1HD      LYS  33 -14.346   7.376  -3.333
  260    HE2  LYS  33           2HE      LYS  33 -14.914   9.729  -3.885
  261    HE3  LYS  33           1HE      LYS  33 -13.577   9.625  -2.740
  262    HZ1  LYS  33           3HZ      LYS  33 -12.042  10.011  -4.583
  263    HZ2  LYS  33           1HZ      LYS  33 -13.147  11.280  -4.432
  264    HZ3  LYS  33           2HZ      LYS  33 -13.334  10.134  -5.660
  265    H    VAL  34           H        VAL  34  -8.265   5.192  -5.088
  266    HA   VAL  34           HA       VAL  34  -6.811   5.801  -6.667
  267    HB   VAL  34           HB       VAL  34  -9.266   5.980  -8.459
  268   HG11  VAL  34          1HG1      VAL  34  -7.528   7.432  -9.452
  269   HG12  VAL  34          2HG1      VAL  34  -7.727   5.969 -10.415
  270   HG13  VAL  34          3HG1      VAL  34  -6.345   6.125  -9.328
  271   HG21  VAL  34          3HG2      VAL  34  -8.744   3.715  -7.635
  272   HG22  VAL  34          1HG2      VAL  34  -7.092   3.864  -8.243
  273   HG23  VAL  34          2HG2      VAL  34  -8.451   3.830  -9.372
  274    H    ASP  35           H        ASP  35  -5.714   7.551  -6.435
  275    HA   ASP  35           HA       ASP  35  -6.526  10.200  -6.127
  276    HB2  ASP  35           2HB      ASP  35  -4.330   9.590  -5.424
  277    HB3  ASP  35           1HB      ASP  35  -3.932   8.869  -6.972
  278    H    ASP  36           H        ASP  36  -4.638   9.224  -8.984
  279    HA   ASP  36           HA       ASP  36  -6.269   9.553 -11.136
  280    HB2  ASP  36           2HB      ASP  36  -6.868  11.845 -10.461
  281    HB3  ASP  36           1HB      ASP  36  -5.176  12.286 -10.307
  282    H    SER  37           H        SER  37  -3.263  11.207 -10.130
  283    HA   SER  37           HA       SER  37  -1.948  10.484 -12.645
  284    HB2  SER  37           2HB      SER  37  -1.969  12.853 -11.880
  285    HB3  SER  37           1HB      SER  37  -1.083  12.394 -10.428
  286    HG   SER  37           HG       SER  37  -0.012  11.733 -12.939
  287    H    GLN  38           H        GLN  38  -2.146   9.159  -9.586
  288    HA   GLN  38           HA       GLN  38   0.435   8.199  -9.050
  289    HB2  GLN  38           2HB      GLN  38  -0.721   6.453  -7.699
  290    HB3  GLN  38           1HB      GLN  38  -1.376   8.057  -7.398
  291    HG2  GLN  38           2HG      GLN  38  -3.318   7.588  -8.749
  292    HG3  GLN  38           1HG      GLN  38  -2.648   6.042  -9.265
  293   HE21  GLN  38          1HE2      GLN  38  -1.699   5.349  -6.552
  294   HE22  GLN  38          2HE2      GLN  38  -3.109   4.945  -5.655
  295    HA   PRO  39           HA       PRO  39   1.307   4.978 -12.153
  296    HB2  PRO  39           2HB      PRO  39   2.124   3.327  -9.746
  297    HB3  PRO  39           1HB      PRO  39   3.017   3.655 -11.249
  298    HG2  PRO  39           2HG      PRO  39   3.678   4.910  -9.010
  299    HG3  PRO  39           1HG      PRO  39   3.685   5.770 -10.567
  300    HD2  PRO  39           2HD      PRO  39   1.674   5.935  -8.337
  301    HD3  PRO  39           1HD      PRO  39   2.271   7.205  -9.425
  302    H    ALA  40           H        ALA  40   0.365   3.153 -13.013
  303    HA   ALA  40           HA       ALA  40  -2.200   2.317 -12.303
  304    HB1  ALA  40           3HB      ALA  40  -1.268   2.053 -14.569
  305    HB2  ALA  40           1HB      ALA  40  -1.902   0.518 -13.966
  306    HB3  ALA  40           2HB      ALA  40  -0.160   0.812 -13.983
  307    H    PHE  41           H        PHE  41   0.944   0.941 -11.458
  308    HA   PHE  41           HA       PHE  41   0.078  -1.474 -10.299
  309    HB2  PHE  41           2HB      PHE  41   2.522   0.218  -9.674
  310    HB3  PHE  41           1HB      PHE  41   2.271  -1.418  -9.080
  311    HD1  PHE  41           HD1      PHE  41   1.337  -2.970 -11.277
  312    HD2  PHE  41           HD2      PHE  41   4.188   0.209 -11.326
  313    HE1  PHE  41           HE1      PHE  41   2.358  -3.917 -13.295
  314    HE2  PHE  41           HE2      PHE  41   5.199  -0.741 -13.353
  315    HZ   PHE  41           HZ       PHE  41   4.287  -2.802 -14.339
  316    H    ILE  42           H        ILE  42   0.315   1.792  -8.916
  317    HA   ILE  42           HA       ILE  42  -0.258   0.930  -6.211
  318    HB   ILE  42           HB       ILE  42  -0.483   3.779  -7.291
  319   HG12  ILE  42          2HG1      ILE  42   1.777   2.910  -7.823
  320   HG13  ILE  42          1HG1      ILE  42   1.868   4.134  -6.567
  321   HG21  ILE  42          1HG2      ILE  42  -1.500   3.468  -5.067
  322   HG22  ILE  42          2HG2      ILE  42  -0.037   4.447  -4.937
  323   HG23  ILE  42          3HG2      ILE  42  -0.005   2.746  -4.462
  324   HD11  ILE  42          3HD1      ILE  42   2.046   1.148  -6.145
  325   HD12  ILE  42          1HD1      ILE  42   2.136   2.372  -4.877
  326   HD13  ILE  42          2HD1      ILE  42   3.386   2.293  -6.119
  327    H    ASN  43           H        ASN  43  -2.105   1.840  -9.046
  328    HA   ASN  43           HA       ASN  43  -4.669   2.211  -7.802
  329    HB2  ASN  43           2HB      ASN  43  -3.928   1.367 -10.641
  330    HB3  ASN  43           1HB      ASN  43  -5.556   1.747 -10.115
  331   HD21  ASN  43          1HD2      ASN  43  -5.091   4.021  -8.576
  332   HD22  ASN  43          2HD2      ASN  43  -4.569   5.280  -9.632
  333    H    ASP  44           H        ASP  44  -2.811  -0.511  -9.053
  334    HA   ASP  44           HA       ASP  44  -4.822  -2.511  -8.953
  335    HB2  ASP  44           2HB      ASP  44  -2.735  -2.749 -10.280
  336    HB3  ASP  44           1HB      ASP  44  -1.783  -2.786  -8.800
  337    H    ILE  45           H        ILE  45  -2.395  -1.375  -6.613
  338    HA   ILE  45           HA       ILE  45  -2.950  -3.277  -4.574
  339    HB   ILE  45           HB       ILE  45  -1.893  -0.455  -4.071
  340   HG12  ILE  45          2HG1      ILE  45  -0.241  -2.941  -4.726
  341   HG13  ILE  45          1HG1      ILE  45  -0.521  -1.606  -5.835
  342   HG21  ILE  45          1HG2      ILE  45  -2.552  -1.700  -2.039
  343   HG22  ILE  45          2HG2      ILE  45  -0.805  -1.481  -2.091
  344   HG23  ILE  45          3HG2      ILE  45  -1.510  -3.046  -2.506
  345   HD11  ILE  45          3HD1      ILE  45   1.677  -1.452  -4.838
  346   HD12  ILE  45          1HD1      ILE  45   0.981  -1.456  -3.219
  347   HD13  ILE  45          2HD1      ILE  45   0.683  -0.096  -4.306
  348    H    LEU  46           H        LEU  46  -4.358  -0.126  -5.382
  349    HA   LEU  46           HA       LEU  46  -6.109   0.121  -3.168
  350    HB2  LEU  46           2HB      LEU  46  -6.286   1.207  -5.990
  351    HB3  LEU  46           1HB      LEU  46  -7.458   1.611  -4.744
  352    HG   LEU  46           HG       LEU  46  -4.478   2.188  -4.542
  353   HD11  LEU  46          1HD1      LEU  46  -6.732   4.129  -5.128
  354   HD12  LEU  46          2HD1      LEU  46  -5.526   3.569  -6.289
  355   HD13  LEU  46          3HD1      LEU  46  -5.026   4.527  -4.900
  356   HD21  LEU  46          3HD2      LEU  46  -5.089   3.522  -2.575
  357   HD22  LEU  46          1HD2      LEU  46  -5.552   1.836  -2.360
  358   HD23  LEU  46          2HD2      LEU  46  -6.779   3.043  -2.754
  359    H    LYS  47           H        LYS  47  -6.406  -1.591  -6.210
  360    HA   LYS  47           HA       LYS  47  -9.159  -2.354  -5.915
  361    HB2  LYS  47           2HB      LYS  47  -6.932  -3.493  -7.653
  362    HB3  LYS  47           1HB      LYS  47  -8.644  -3.891  -7.824
  363    HG2  LYS  47           2HG      LYS  47  -9.188  -1.639  -8.487
  364    HG3  LYS  47           1HG      LYS  47  -7.575  -1.064  -8.056
  365    HD2  LYS  47           2HD      LYS  47  -6.631  -2.502  -9.880
  366    HD3  LYS  47           1HD      LYS  47  -8.280  -2.927 -10.350
  367    HE2  LYS  47           2HE      LYS  47  -8.758  -0.533 -10.791
  368    HE3  LYS  47           1HE      LYS  47  -7.101  -0.126 -10.337
  369    HZ1  LYS  47           3HZ      LYS  47  -6.319  -1.497 -12.177
  370    HZ2  LYS  47           1HZ      LYS  47  -7.342  -0.262 -12.716
  371    HZ3  LYS  47           2HZ      LYS  47  -7.912  -1.844 -12.613
  372    H    VAL  48           H        VAL  48  -6.183  -3.505  -4.550
  373    HA   VAL  48           HA       VAL  48  -7.101  -6.081  -3.687
  374    HB   VAL  48           HB       VAL  48  -5.014  -4.283  -2.343
  375   HG11  VAL  48          1HG1      VAL  48  -5.483  -7.272  -2.019
  376   HG12  VAL  48          2HG1      VAL  48  -5.791  -6.030  -0.804
  377   HG13  VAL  48          3HG1      VAL  48  -4.138  -6.367  -1.318
  378   HG21  VAL  48          3HG2      VAL  48  -3.317  -5.614  -3.538
  379   HG22  VAL  48          1HG2      VAL  48  -4.382  -4.771  -4.666
  380   HG23  VAL  48          2HG2      VAL  48  -4.594  -6.499  -4.377
  381    H    GLU  49           H        GLU  49  -9.089  -6.011  -2.820
  382    HA   GLU  49           HA       GLU  49 -10.165  -4.029  -1.116
  383    HB2  GLU  49           2HB      GLU  49 -11.020  -6.912  -1.578
  384    HB3  GLU  49           1HB      GLU  49 -12.001  -5.689  -0.773
  385    HG2  GLU  49           2HG      GLU  49 -12.160  -4.387  -2.810
  386    HG3  GLU  49           1HG      GLU  49 -11.018  -5.453  -3.632
  387    H    GLY  50           H        GLY  50  -8.717  -3.667   0.513
  388    HA2  GLY  50           2HA      GLY  50  -8.902  -4.892   2.973
  389    HA3  GLY  50           1HA      GLY  50  -7.563  -5.698   2.161
  390    H    VAL  51           H        VAL  51  -7.134  -2.903   0.737
  391    HA   VAL  51           HA       VAL  51  -5.107  -2.036   2.629
  392    HB   VAL  51           HB       VAL  51  -4.339  -0.559   0.814
  393   HG11  VAL  51          1HG1      VAL  51  -3.489  -2.831   0.888
  394   HG12  VAL  51          2HG1      VAL  51  -3.667  -2.316  -0.789
  395   HG13  VAL  51          3HG1      VAL  51  -4.854  -3.409  -0.074
  396   HG21  VAL  51          3HG2      VAL  51  -6.492   0.040  -0.220
  397   HG22  VAL  51          1HG2      VAL  51  -6.700  -1.619  -0.788
  398   HG23  VAL  51          2HG2      VAL  51  -5.395  -0.620  -1.432
  399    H    LYS  52           H        LYS  52  -8.205  -0.902   1.598
  400    HA   LYS  52           HA       LYS  52  -9.454   0.932   1.673
  401    HB2  LYS  52           2HB      LYS  52  -9.679   0.177   3.965
  402    HB3  LYS  52           1HB      LYS  52  -8.217   1.028   4.423
  403    HG2  LYS  52           2HG      LYS  52  -9.369   3.192   3.861
  404    HG3  LYS  52           1HG      LYS  52 -10.851   2.274   3.604
  405    HD2  LYS  52           2HD      LYS  52  -9.292   2.429   6.216
  406    HD3  LYS  52           1HD      LYS  52 -10.777   3.311   5.848
  407    HE2  LYS  52           2HE      LYS  52 -10.469   0.304   6.090
  408    HE3  LYS  52           1HE      LYS  52 -11.315   1.375   7.206
  409    HZ1  LYS  52           3HZ      LYS  52 -12.810   1.942   5.300
  410    HZ2  LYS  52           1HZ      LYS  52 -12.930   0.355   5.859
  411    HZ3  LYS  52           2HZ      LYS  52 -12.092   0.680   4.435
  412    H    SER  53           H        SER  53  -6.682   2.125   3.507
  413    HA   SER  53           HA       SER  53  -6.601   4.558   1.807
  414    HB2  SER  53           2HB      SER  53  -6.334   4.430   4.843
  415    HB3  SER  53           1HB      SER  53  -6.159   5.889   3.863
  416    HG   SER  53           HG       SER  53  -8.470   4.741   3.222
  417    H    ILE  54           H        ILE  54  -4.798   3.930   0.649
  418    HA   ILE  54           HA       ILE  54  -2.273   3.294   1.949
  419    HB   ILE  54           HB       ILE  54  -2.907   3.939  -0.973
  420   HG12  ILE  54          2HG1      ILE  54  -2.490   1.243   0.378
  421   HG13  ILE  54          1HG1      ILE  54  -4.032   1.874  -0.191
  422   HG21  ILE  54          1HG2      ILE  54  -0.364   2.737   0.177
  423   HG22  ILE  54          2HG2      ILE  54  -0.528   4.376  -0.452
  424   HG23  ILE  54          3HG2      ILE  54  -0.705   2.996  -1.537
  425   HD11  ILE  54          3HD1      ILE  54  -1.656   1.127  -1.880
  426   HD12  ILE  54          1HD1      ILE  54  -3.144   1.853  -2.495
  427   HD13  ILE  54          2HD1      ILE  54  -3.185   0.262  -1.737
  428    H    PHE  55           H        PHE  55  -2.160   5.102   3.302
  429    HA   PHE  55           HA       PHE  55  -2.098   7.814   2.280
  430    HB2  PHE  55           2HB      PHE  55  -3.014   7.335   4.527
  431    HB3  PHE  55           1HB      PHE  55  -1.488   6.632   5.037
  432    HD1  PHE  55           HD1      PHE  55  -3.071   9.834   3.957
  433    HD2  PHE  55           HD2      PHE  55   0.205   8.020   6.003
  434    HE1  PHE  55           HE1      PHE  55  -2.360  12.037   4.771
  435    HE2  PHE  55           HE2      PHE  55   0.909  10.225   6.818
  436    HZ   PHE  55           HZ       PHE  55  -0.369  12.237   6.204
  437    H    HIS  56           H        HIS  56  -0.252   9.033   1.984
  438    HA   HIS  56           HA       HIS  56   2.398   7.809   2.428
  439    HB2  HIS  56           2HB      HIS  56   1.874   7.300   0.078
  440    HB3  HIS  56           1HB      HIS  56   1.427   8.974  -0.231
  441    HD1  HIS  56           HD1      HIS  56   3.220  10.200  -1.452
  442    HD2  HIS  56           HD2      HIS  56   4.792   7.259   1.039
  443    HE1  HIS  56           HE1      HIS  56   5.723  10.335  -1.726
  444    HE2  HIS  56           HE2      HIS  56   6.644   8.650  -0.097
  445    H    VAL  57           H        VAL  57   3.791   9.244   3.282
  446    HA   VAL  57           HA       VAL  57   3.782  12.012   2.450
  447    HB   VAL  57           HB       VAL  57   2.138  11.964   4.399
  448   HG11  VAL  57          1HG1      VAL  57   2.947  11.723   6.687
  449   HG12  VAL  57          2HG1      VAL  57   4.548  11.289   6.085
  450   HG13  VAL  57          3HG1      VAL  57   3.171  10.232   5.767
  451   HG21  VAL  57          3HG2      VAL  57   3.289  14.063   3.804
  452   HG22  VAL  57          1HG2      VAL  57   4.636  13.634   4.864
  453   HG23  VAL  57          2HG2      VAL  57   3.040  13.957   5.547
  454    H    MET  58           H        MET  58   5.757  12.928   2.631
  455    HA   MET  58           HA       MET  58   7.950  13.210   2.852
  456    HB2  MET  58           2HB      MET  58   7.442  13.257   5.263
  457    HB3  MET  58           1HB      MET  58   7.643  11.511   5.361
  458    HG2  MET  58           2HG      MET  58  10.016  11.735   4.825
  459    HG3  MET  58           1HG      MET  58   9.820  13.476   4.612
  460    HE1  MET  58           3HE      MET  58  11.956  13.199   7.915
  461    HE2  MET  58           1HE      MET  58  11.913  13.798   6.256
  462    HE3  MET  58           2HE      MET  58  12.034  12.065   6.568
  463    H    ASP  59           H        ASP  59   7.918   9.869   4.121
  464    HA   ASP  59           HA       ASP  59   9.520   8.972   1.790
  465    HB2  ASP  59           2HB      ASP  59  10.945   7.675   3.365
  466    HB3  ASP  59           1HB      ASP  59  11.053   9.408   3.653
  467    H    PHE  60           H        PHE  60   7.172   8.193   4.312
  468    HA   PHE  60           HA       PHE  60   7.267   5.310   3.633
  469    HB2  PHE  60           2HB      PHE  60   6.341   4.888   5.872
  470    HB3  PHE  60           1HB      PHE  60   7.812   5.843   5.979
  471    HD1  PHE  60           HD1      PHE  60   7.622   8.344   6.390
  472    HD2  PHE  60           HD2      PHE  60   4.273   5.717   6.832
  473    HE1  PHE  60           HE1      PHE  60   6.450  10.049   7.699
  474    HE2  PHE  60           HE2      PHE  60   3.106   7.439   8.147
  475    HZ   PHE  60           HZ       PHE  60   4.187   9.614   8.559
  476    H    ILE  61           H        ILE  61   5.283   4.083   3.924
  477    HA   ILE  61           HA       ILE  61   2.858   5.521   3.017
  478    HB   ILE  61           HB       ILE  61   3.785   2.715   2.248
  479   HG12  ILE  61          2HG1      ILE  61   3.486   5.231   0.538
  480   HG13  ILE  61          1HG1      ILE  61   5.010   4.503   1.028
  481   HG21  ILE  61          1HG2      ILE  61   1.246   4.186   1.449
  482   HG22  ILE  61          2HG2      ILE  61   1.344   2.786   2.518
  483   HG23  ILE  61          3HG2      ILE  61   1.768   2.621   0.815
  484   HD11  ILE  61          3HD1      ILE  61   2.961   3.277  -0.818
  485   HD12  ILE  61          1HD1      ILE  61   4.467   2.507  -0.310
  486   HD13  ILE  61          2HD1      ILE  61   4.510   3.982  -1.274
  487    H    SER  62           H        SER  62   1.530   5.601   4.730
  488    HA   SER  62           HA       SER  62   1.252   3.433   6.654
  489    HB2  SER  62           2HB      SER  62  -0.266   6.067   6.368
  490    HB3  SER  62           1HB      SER  62  -0.418   4.941   7.719
  491    HG   SER  62           HG       SER  62   1.196   6.911   7.643
  492    H    VAL  63           H        VAL  63   0.384   1.672   5.456
  493    HA   VAL  63           HA       VAL  63  -2.093   2.011   3.947
  494    HB   VAL  63           HB       VAL  63  -0.632  -0.588   4.628
  495   HG11  VAL  63          1HG1      VAL  63  -2.831  -0.047   2.588
  496   HG12  VAL  63          2HG1      VAL  63  -3.006  -0.967   4.085
  497   HG13  VAL  63          3HG1      VAL  63  -1.973  -1.579   2.794
  498   HG21  VAL  63          3HG2      VAL  63   0.793   0.874   3.242
  499   HG22  VAL  63          1HG2      VAL  63  -0.513   1.057   2.067
  500   HG23  VAL  63          2HG2      VAL  63   0.240  -0.521   2.316
  501    H    ASP  64           H        ASP  64  -3.712   2.531   5.243
  502    HA   ASP  64           HA       ASP  64  -4.305   1.291   7.811
  503    HB2  ASP  64           2HB      ASP  64  -5.843   3.333   6.178
  504    HB3  ASP  64           1HB      ASP  64  -6.315   2.802   7.771
  505    H    LYS  65           H        LYS  65  -4.959  -0.851   7.447
  506    HA   LYS  65           HA       LYS  65  -6.363  -1.687   5.141
  507    HB2  LYS  65           2HB      LYS  65  -6.488  -3.884   6.145
  508    HB3  LYS  65           1HB      LYS  65  -4.894  -3.207   6.436
  509    HG2  LYS  65           2HG      LYS  65  -5.412  -2.798   8.760
  510    HG3  LYS  65           1HG      LYS  65  -7.106  -3.225   8.512
  511    HD2  LYS  65           2HD      LYS  65  -6.462  -5.542   7.972
  512    HD3  LYS  65           1HD      LYS  65  -4.761  -5.133   8.166
  513    HE2  LYS  65           2HE      LYS  65  -5.071  -4.757  10.538
  514    HE3  LYS  65           1HE      LYS  65  -6.822  -4.933  10.381
  515    HZ1  LYS  65           3HZ      LYS  65  -5.793  -6.942  11.236
  516    HZ2  LYS  65           1HZ      LYS  65  -4.830  -7.074   9.857
  517    HZ3  LYS  65           2HZ      LYS  65  -6.510  -7.233   9.736
  518    H    GLU  66           H        GLU  66  -8.415  -3.147   5.430
  519    HA   GLU  66           HA       GLU  66 -10.670  -1.569   6.130
  520    HB2  GLU  66           2HB      GLU  66 -10.386  -4.538   5.546
  521    HB3  GLU  66           1HB      GLU  66 -11.942  -3.783   5.836
  522    HG2  GLU  66           2HG      GLU  66 -10.052  -2.980   3.605
  523    HG3  GLU  66           1HG      GLU  66 -11.392  -4.113   3.422
  524    H    ASN  67           H        ASN  67 -12.498  -2.882   7.523
  525    HA   ASN  67           HA       ASN  67 -11.861  -2.448  10.237
  526    HB2  ASN  67           2HB      ASN  67 -14.097  -3.352  10.758
  527    HB3  ASN  67           1HB      ASN  67 -14.178  -2.274   9.371
  528   HD21  ASN  67          1HD2      ASN  67 -14.629  -3.161   7.313
  529   HD22  ASN  67          2HD2      ASN  67 -15.252  -4.760   7.113
  530    H    ASP  68           H        ASP  68 -11.633  -5.309   8.262
  531    HA   ASP  68           HA       ASP  68 -10.338  -6.728  10.508
  532    HB2  ASP  68           2HB      ASP  68 -12.564  -7.754  10.176
  533    HB3  ASP  68           1HB      ASP  68 -12.248  -7.944   8.456
  534    H    ALA  69           H        ALA  69 -10.869  -6.889   6.967
  535    HA   ALA  69           HA       ALA  69  -9.601  -7.491   5.197
  536    HB1  ALA  69           3HB      ALA  69  -8.746  -5.218   5.603
  537    HB2  ALA  69           1HB      ALA  69  -7.501  -6.258   4.915
  538    HB3  ALA  69           2HB      ALA  69  -7.481  -5.874   6.633
  539    H    ASN  70           H        ASN  70  -6.885  -8.074   4.792
  540    HA   ASN  70           HA       ASN  70  -5.927  -9.971   6.761
  541    HB2  ASN  70           2HB      ASN  70  -7.622 -11.251   5.348
  542    HB3  ASN  70           1HB      ASN  70  -6.579 -10.995   3.956
  543   HD21  ASN  70          1HD2      ASN  70  -7.464 -13.475   5.262
  544   HD22  ASN  70          2HD2      ASN  70  -6.013 -14.331   5.652
  545    H    TRP  71           H        TRP  71  -3.832  -9.381   6.903
  546    HA   TRP  71           HA       TRP  71  -2.438  -7.921   4.887
  547    HB2  TRP  71           2HB      TRP  71  -1.531  -9.163   7.499
  548    HB3  TRP  71           1HB      TRP  71  -0.412  -8.324   6.433
  549    HD1  TRP  71           HD1      TRP  71  -2.155  -7.596   9.477
  550    HE1  TRP  71           HE1      TRP  71  -2.552  -5.068   9.796
  551    HE3  TRP  71           HE3      TRP  71  -1.440  -6.032   4.653
  552    HZ2  TRP  71           HZ2      TRP  71  -2.539  -2.747   8.220
  553    HZ3  TRP  71           HZ3      TRP  71  -1.657  -3.641   4.148
  554    HH2  TRP  71           HH2      TRP  71  -2.200  -2.030   5.896
  555    H    GLU  72           H        GLU  72  -2.632 -11.346   5.659
  556    HA   GLU  72           HA       GLU  72  -0.346 -12.198   4.159
  557    HB2  GLU  72           2HB      GLU  72  -1.498 -13.586   5.936
  558    HB3  GLU  72           1HB      GLU  72  -2.837 -13.839   4.822
  559    HG2  GLU  72           2HG      GLU  72  -1.343 -15.020   3.269
  560    HG3  GLU  72           1HG      GLU  72   0.027 -14.716   4.328
  561    H    THR  73           H        THR  73  -3.549 -11.240   3.276
  562    HA   THR  73           HA       THR  73  -3.403 -12.262   0.554
  563    HB   THR  73           HB       THR  73  -5.396 -10.300   1.788
  564    HG1  THR  73           HG1      THR  73  -5.070 -13.023   2.049
  565   HG21  THR  73          3HG2      THR  73  -5.434 -10.284  -0.688
  566   HG22  THR  73          1HG2      THR  73  -6.897 -11.029  -0.038
  567   HG23  THR  73          2HG2      THR  73  -5.613 -12.040  -0.703
  568    H    VAL  74           H        VAL  74  -3.110  -9.150   2.258
  569    HA   VAL  74           HA       VAL  74  -3.051  -7.471  -0.021
  570    HB   VAL  74           HB       VAL  74  -2.211  -6.947   2.858
  571   HG11  VAL  74          1HG1      VAL  74  -0.987  -5.346   1.461
  572   HG12  VAL  74          2HG1      VAL  74  -2.279  -4.514   2.326
  573   HG13  VAL  74          3HG1      VAL  74  -2.474  -4.904   0.616
  574   HG21  VAL  74          3HG2      VAL  74  -4.341  -5.710   3.015
  575   HG22  VAL  74          1HG2      VAL  74  -4.622  -7.389   2.550
  576   HG23  VAL  74          2HG2      VAL  74  -4.712  -6.111   1.335
  577    H    LEU  75           H        LEU  75  -0.355  -8.492   2.150
  578    HA   LEU  75           HA       LEU  75   1.591  -6.869   0.968
  579    HB2  LEU  75           2HB      LEU  75   1.768  -9.202   2.850
  580    HB3  LEU  75           1HB      LEU  75   3.249  -8.673   2.075
  581    HG   LEU  75           HG       LEU  75   3.084  -7.638   4.262
  582   HD11  LEU  75          1HD1      LEU  75   2.559  -5.547   2.133
  583   HD12  LEU  75          2HD1      LEU  75   4.118  -6.293   2.495
  584   HD13  LEU  75          3HD1      LEU  75   3.329  -5.284   3.703
  585   HD21  LEU  75          3HD2      LEU  75   0.435  -6.469   3.381
  586   HD22  LEU  75          1HD2      LEU  75   1.282  -6.119   4.891
  587   HD23  LEU  75          2HD2      LEU  75   0.673  -7.742   4.583
  588    HA   PRO  76           HA       PRO  76   3.159 -10.793  -1.702
  589    HB2  PRO  76           2HB      PRO  76   0.364 -11.838  -2.251
  590    HB3  PRO  76           1HB      PRO  76   1.909 -12.720  -2.203
  591    HG2  PRO  76           2HG      PRO  76   0.271 -12.910  -0.158
  592    HG3  PRO  76           1HG      PRO  76   2.014 -12.697   0.132
  593    HD2  PRO  76           2HD      PRO  76  -0.198 -10.660   0.352
  594    HD3  PRO  76           1HD      PRO  76   1.220 -10.900   1.397
  595    H    LYS  77           H        LYS  77   0.110  -9.087  -2.174
  596    HA   LYS  77           HA       LYS  77   0.345  -8.799  -5.047
  597    HB2  LYS  77           2HB      LYS  77  -1.526  -7.405  -3.084
  598    HB3  LYS  77           1HB      LYS  77  -1.711  -7.444  -4.839
  599    HG2  LYS  77           2HG      LYS  77  -1.996  -9.913  -4.747
  600    HG3  LYS  77           1HG      LYS  77  -1.831  -9.855  -2.989
  601    HD2  LYS  77           2HD      LYS  77  -3.869  -8.422  -2.882
  602    HD3  LYS  77           1HD      LYS  77  -4.046  -8.572  -4.631
  603    HE2  LYS  77           2HE      LYS  77  -4.332 -11.025  -4.380
  604    HE3  LYS  77           1HE      LYS  77  -4.160 -10.863  -2.630
  605    HZ1  LYS  77           3HZ      LYS  77  -6.149  -9.417  -2.662
  606    HZ2  LYS  77           1HZ      LYS  77  -6.468 -10.989  -3.200
  607    HZ3  LYS  77           2HZ      LYS  77  -6.329  -9.728  -4.310
  608    H    VAL  78           H        VAL  78   0.886  -6.748  -2.203
  609    HA   VAL  78           HA       VAL  78   1.698  -4.369  -3.528
  610    HB   VAL  78           HB       VAL  78   2.605  -5.378  -0.783
  611   HG11  VAL  78          1HG1      VAL  78   2.998  -2.991  -0.241
  612   HG12  VAL  78          2HG1      VAL  78   2.579  -2.546  -1.897
  613   HG13  VAL  78          3HG1      VAL  78   4.013  -3.527  -1.583
  614   HG21  VAL  78          3HG2      VAL  78   0.771  -4.035   0.175
  615   HG22  VAL  78          1HG2      VAL  78   0.142  -5.286  -0.899
  616   HG23  VAL  78          2HG2      VAL  78   0.217  -3.610  -1.445
  617    H    GLU  79           H        GLU  79   3.454  -7.244  -2.448
  618    HA   GLU  79           HA       GLU  79   6.087  -6.455  -3.073
  619    HB2  GLU  79           2HB      GLU  79   4.791  -9.199  -2.812
  620    HB3  GLU  79           1HB      GLU  79   6.509  -9.000  -3.151
  621    HG2  GLU  79           2HG      GLU  79   6.828  -7.822  -1.043
  622    HG3  GLU  79           1HG      GLU  79   5.101  -7.924  -0.696
  623    H    ALA  80           H        ALA  80   3.524  -7.967  -4.976
  624    HA   ALA  80           HA       ALA  80   4.983  -8.741  -7.254
  625    HB1  ALA  80           3HB      ALA  80   2.090  -7.840  -7.112
  626    HB2  ALA  80           1HB      ALA  80   2.681  -9.474  -6.810
  627    HB3  ALA  80           2HB      ALA  80   2.819  -8.772  -8.424
  628    H    VAL  81           H        VAL  81   3.817  -5.596  -6.262
  629    HA   VAL  81           HA       VAL  81   3.982  -4.208  -8.740
  630    HB   VAL  81           HB       VAL  81   3.984  -3.304  -5.839
  631   HG11  VAL  81          1HG1      VAL  81   3.567  -0.967  -6.617
  632   HG12  VAL  81          2HG1      VAL  81   3.982  -1.469  -8.258
  633   HG13  VAL  81          3HG1      VAL  81   5.197  -1.539  -6.981
  634   HG21  VAL  81          3HG2      VAL  81   1.691  -2.545  -6.357
  635   HG22  VAL  81          1HG2      VAL  81   1.886  -4.273  -6.662
  636   HG23  VAL  81          2HG2      VAL  81   1.865  -3.131  -8.010
  637    H    PHE  82           H        PHE  82   6.231  -4.080  -5.942
  638    HA   PHE  82           HA       PHE  82   8.314  -2.724  -7.382
  639    HB2  PHE  82           2HB      PHE  82   8.552  -4.230  -4.740
  640    HB3  PHE  82           1HB      PHE  82   9.583  -2.918  -5.313
  641    HD1  PHE  82           HD1      PHE  82   8.629  -0.569  -5.488
  642    HD2  PHE  82           HD2      PHE  82   6.460  -3.766  -3.663
  643    HE1  PHE  82           HE1      PHE  82   7.084   1.050  -4.468
  644    HE2  PHE  82           HE2      PHE  82   4.935  -2.145  -2.645
  645    HZ   PHE  82           HZ       PHE  82   5.235   0.246  -3.058
  646    H    GLU  83           H        GLU  83   7.812  -6.049  -6.350
  647    HA   GLU  83           HA       GLU  83  10.138  -7.055  -7.838
  648    HB2  GLU  83           2HB      GLU  83   8.251  -8.678  -6.070
  649    HB3  GLU  83           1HB      GLU  83   9.872  -9.114  -6.579
  650    HG2  GLU  83           2HG      GLU  83   9.185  -6.885  -4.652
  651    HG3  GLU  83           1HG      GLU  83   9.716  -8.497  -4.187
  652    H    LEU  84           H        LEU  84   8.819  -6.276  -9.753
  653    HA   LEU  84           HA       LEU  84   6.525  -7.518 -10.762
  654    HB2  LEU  84           2HB      LEU  84   8.966  -6.455 -12.225
  655    HB3  LEU  84           1HB      LEU  84   7.487  -6.931 -13.042
  656    HG   LEU  84           HG       LEU  84   7.696  -4.671 -11.007
  657   HD11  LEU  84          1HD1      LEU  84   8.877  -4.090 -13.070
  658   HD12  LEU  84          2HD1      LEU  84   7.394  -3.152 -12.922
  659   HD13  LEU  84          3HD1      LEU  84   7.459  -4.523 -14.032
  660   HD21  LEU  84          3HD2      LEU  84   5.357  -5.509 -12.761
  661   HD22  LEU  84          1HD2      LEU  84   5.415  -4.076 -11.727
  662   HD23  LEU  84          2HD2      LEU  84   5.461  -5.683 -11.006
  663    H    GLU  85           H        GLU  85   9.839  -8.574 -10.694
  664    HA   GLU  85           HA       GLU  85   9.041 -11.313 -11.356
  665    HB2  GLU  85           2HB      GLU  85  11.429 -11.441 -12.531
  666    HB3  GLU  85           1HB      GLU  85  10.024 -10.892 -13.427
  667    HG2  GLU  85           2HG      GLU  85  12.048  -9.543 -13.886
  668    HG3  GLU  85           1HG      GLU  85  10.721  -8.580 -13.232
  669    H    HIS  86           H        HIS  86  10.622 -12.896 -10.569
  670    HA   HIS  86           HA       HIS  86  11.757 -12.268  -7.980
  671    HB2  HIS  86           2HB      HIS  86  11.913 -14.805  -9.673
  672    HB3  HIS  86           1HB      HIS  86  12.444 -14.671  -7.995
  673    HD1  HIS  86           HD1      HIS  86   9.396 -14.976 -10.111
  674    HD2  HIS  86           HD2      HIS  86  10.329 -14.549  -6.085
  675    HE1  HIS  86           HE1      HIS  86   7.258 -15.420  -8.875
  676    HE2  HIS  86           HE2      HIS  86   7.798 -14.927  -6.467
  677    H    HIS  87           H        HIS  87  13.639 -11.201  -7.868
  678    HA   HIS  87           HA       HIS  87  15.182 -10.458 -10.074
  679    HB2  HIS  87           2HB      HIS  87  15.958 -10.365  -7.127
  680    HB3  HIS  87           1HB      HIS  87  16.731  -9.449  -8.418
  681    HD1  HIS  87           HD1      HIS  87  13.501  -8.960  -9.502
  682    HD2  HIS  87           HD2      HIS  87  15.462  -7.728  -6.053
  683    HE1  HIS  87           HE1      HIS  87  12.214  -6.977  -8.666
  684    HE2  HIS  87           HE2      HIS  87  13.270  -6.431  -6.452
  685    H    HIS  88           H        HIS  88  15.968 -12.189 -11.242
  686    HA   HIS  88           HA       HIS  88  18.478 -13.327 -10.565
  687    HB2  HIS  88           2HB      HIS  88  16.938 -14.733  -9.089
  688    HB3  HIS  88           1HB      HIS  88  16.147 -15.317 -10.545
  689    HD1  HIS  88           HD1      HIS  88  17.347 -17.171 -11.860
  690    HD2  HIS  88           HD2      HIS  88  19.558 -15.740  -8.655
  691    HE1  HIS  88           HE1      HIS  88  19.240 -18.790 -11.583
  692    HE2  HIS  88           HE2      HIS  88  20.684 -17.773  -9.786
  693    H    HIS  89           H        HIS  89  18.261 -11.986 -12.662
  694    HA   HIS  89           HA       HIS  89  17.368 -13.484 -15.019
  695    HB2  HIS  89           2HB      HIS  89  18.778 -10.788 -14.774
  696    HB3  HIS  89           1HB      HIS  89  18.226 -11.489 -16.293
  697    HD1  HIS  89           HD1      HIS  89  15.753 -11.224 -16.873
  698    HD2  HIS  89           HD2      HIS  89  16.671  -9.900 -13.042
  699    HE1  HIS  89           HE1      HIS  89  13.722  -9.990 -16.079
  700    HE2  HIS  89           HE2      HIS  89  14.225  -9.408 -13.685
  701    H    HIS  90           H        HIS  90  20.385 -12.291 -13.590
  702    HA   HIS  90           HA       HIS  90  21.814 -14.687 -14.561
  703    HB2  HIS  90           2HB      HIS  90  22.836 -11.826 -14.791
  704    HB3  HIS  90           1HB      HIS  90  23.897 -13.228 -14.871
  705    HD1  HIS  90           HD1      HIS  90  21.791 -11.102 -16.968
  706    HD2  HIS  90           HD2      HIS  90  23.340 -14.951 -17.163
  707    HE1  HIS  90           HE1      HIS  90  21.628 -11.766 -19.381
  708    HE2  HIS  90           HE2      HIS  90  22.763 -14.007 -19.499
  709    H    HIS  91           H        HIS  91  23.822 -15.084 -13.235
  710    HA   HIS  91           HA       HIS  91  24.748 -15.623 -11.263
  711    HB2  HIS  91           2HB      HIS  91  25.367 -13.262 -11.066
  712    HB3  HIS  91           1HB      HIS  91  23.791 -12.858 -10.401
  713    HD1  HIS  91           HD1      HIS  91  27.060 -14.492  -9.506
  714    HD2  HIS  91           HD2      HIS  91  23.542 -13.280  -7.635
  715    HE1  HIS  91           HE1      HIS  91  27.532 -14.601  -7.035
  716    HE2  HIS  91           HE2      HIS  91  25.425 -13.790  -5.923
  Start of MODEL    4
    1    H1   MET   1           1H       MET   1  14.508   0.580  -6.052
    2    H2   MET   1           2H       MET   1  15.041   0.366  -4.463
    3    H3   MET   1           3H       MET   1  15.029   1.911  -5.147
    4    HA   MET   1           HA       MET   1  13.227   1.663  -3.633
    5    HB2  MET   1           2HB      MET   1  12.939   3.119  -5.604
    6    HB3  MET   1           1HB      MET   1  12.329   1.767  -6.549
    7    HG2  MET   1           2HG      MET   1  10.376   1.615  -5.044
    8    HG3  MET   1           1HG      MET   1  11.004   2.973  -4.105
    9    HE1  MET   1           3HE      MET   1   8.614   4.229  -4.445
   10    HE2  MET   1           1HE      MET   1   8.036   2.858  -5.394
   11    HE3  MET   1           2HE      MET   1   7.895   4.496  -6.032
   12    H    LYS   2           H        LYS   2  12.655  -0.075  -2.486
   13    HA   LYS   2           HA       LYS   2  10.679  -1.923  -3.621
   14    HB2  LYS   2           2HB      LYS   2  11.689  -3.903  -2.571
   15    HB3  LYS   2           1HB      LYS   2  12.841  -3.191  -3.691
   16    HG2  LYS   2           2HG      LYS   2  14.210  -2.344  -1.927
   17    HG3  LYS   2           1HG      LYS   2  12.943  -2.578  -0.722
   18    HD2  LYS   2           2HD      LYS   2  13.178  -5.083  -1.084
   19    HD3  LYS   2           1HD      LYS   2  14.579  -4.745  -2.106
   20    HE2  LYS   2           2HE      LYS   2  15.760  -3.751  -0.219
   21    HE3  LYS   2           1HE      LYS   2  14.333  -3.908   0.807
   22    HZ1  LYS   2           3HZ      LYS   2  14.511  -6.315   0.605
   23    HZ2  LYS   2           1HZ      LYS   2  15.926  -5.657   1.262
   24    HZ3  LYS   2           2HZ      LYS   2  15.892  -6.155  -0.354
   25    H    ILE   3           H        ILE   3   9.899  -3.350  -1.467
   26    HA   ILE   3           HA       ILE   3   9.322  -1.547   0.723
   27    HB   ILE   3           HB       ILE   3   9.008  -4.585   0.574
   28   HG12  ILE   3          2HG1      ILE   3   6.935  -2.369   0.199
   29   HG13  ILE   3          1HG1      ILE   3   7.553  -3.438  -1.054
   30   HG21  ILE   3          1HG2      ILE   3   7.582  -4.383   2.583
   31   HG22  ILE   3          2HG2      ILE   3   7.928  -2.656   2.666
   32   HG23  ILE   3          3HG2      ILE   3   9.225  -3.828   2.908
   33   HD11  ILE   3          3HD1      ILE   3   6.495  -5.345   0.068
   34   HD12  ILE   3          1HD1      ILE   3   5.337  -4.091  -0.369
   35   HD13  ILE   3          2HD1      ILE   3   5.858  -4.259   1.307
   36    H    ILE   4           H        ILE   4  10.888  -0.977   2.159
   37    HA   ILE   4           HA       ILE   4  13.267  -2.615   2.589
   38    HB   ILE   4           HB       ILE   4  12.406   0.117   3.636
   39   HG12  ILE   4          2HG1      ILE   4  14.471   0.915   2.491
   40   HG13  ILE   4          1HG1      ILE   4  14.842  -0.730   1.999
   41   HG21  ILE   4          1HG2      ILE   4  14.887  -1.392   4.543
   42   HG22  ILE   4          2HG2      ILE   4  13.508  -0.941   5.548
   43   HG23  ILE   4          3HG2      ILE   4  14.552   0.311   4.877
   44   HD11  ILE   4          3HD1      ILE   4  13.938   0.667   0.193
   45   HD12  ILE   4          1HD1      ILE   4  12.435   0.845   1.093
   46   HD13  ILE   4          2HD1      ILE   4  12.932  -0.745   0.512
   47    H    SER   5           H        SER   5  10.552  -1.362   4.571
   48    HA   SER   5           HA       SER   5  10.430  -3.789   6.141
   49    HB2  SER   5           2HB      SER   5  12.300  -2.588   7.280
   50    HB3  SER   5           1HB      SER   5  11.258  -1.187   7.527
   51    HG   SER   5           HG       SER   5  10.440  -3.710   8.464
   52    H    ILE   6           H        ILE   6   8.306  -4.149   6.469
   53    HA   ILE   6           HA       ILE   6   6.376  -1.938   6.569
   54    HB   ILE   6           HB       ILE   6   5.992  -4.965   6.434
   55   HG12  ILE   6          2HG1      ILE   6   5.382  -2.738   4.438
   56   HG13  ILE   6          1HG1      ILE   6   6.673  -3.922   4.316
   57   HG21  ILE   6          1HG2      ILE   6   3.807  -2.858   6.580
   58   HG22  ILE   6          2HG2      ILE   6   4.191  -4.036   7.834
   59   HG23  ILE   6          3HG2      ILE   6   3.559  -4.582   6.284
   60   HD11  ILE   6          3HD1      ILE   6   4.882  -4.460   2.812
   61   HD12  ILE   6          1HD1      ILE   6   3.717  -4.481   4.136
   62   HD13  ILE   6          2HD1      ILE   6   4.995  -5.697   4.062
   63    H    SER   7           H        SER   7   6.972  -1.041   8.579
   64    HA   SER   7           HA       SER   7   6.638  -0.577  10.778
   65    HB2  SER   7           2HB      SER   7   4.471  -2.707  10.582
   66    HB3  SER   7           1HB      SER   7   4.540  -1.381  11.747
   67    HG   SER   7           HG       SER   7   4.364  -1.080   8.932
   68    H    GLU   8           H        GLU   8   5.901  -2.137  13.027
   69    HA   GLU   8           HA       GLU   8   8.133  -3.923  13.410
   70    HB2  GLU   8           2HB      GLU   8   5.915  -3.010  15.247
   71    HB3  GLU   8           1HB      GLU   8   7.124  -4.182  15.732
   72    HG2  GLU   8           2HG      GLU   8   7.572  -1.280  14.983
   73    HG3  GLU   8           1HG      GLU   8   7.756  -2.004  16.579
   74    H    THR   9           H        THR   9   4.793  -4.113  12.869
   75    HA   THR   9           HA       THR   9   4.912  -7.029  12.520
   76    HB   THR   9           HB       THR   9   3.729  -6.611  14.660
   77    HG1  THR   9           HG1      THR   9   1.788  -7.758  14.106
   78   HG21  THR   9          3HG2      THR   9   2.777  -4.376  14.257
   79   HG22  THR   9          1HG2      THR   9   1.513  -5.517  14.723
   80   HG23  THR   9          2HG2      THR   9   1.694  -5.042  13.034
   81    HA   PRO  10           HA       PRO  10   3.248  -6.059   8.406
   82    HB2  PRO  10           2HB      PRO  10   2.210  -8.886   8.651
   83    HB3  PRO  10           1HB      PRO  10   3.121  -8.131   7.325
   84    HG2  PRO  10           2HG      PRO  10   4.348  -9.801   8.981
   85    HG3  PRO  10           1HG      PRO  10   5.166  -8.324   8.419
   86    HD2  PRO  10           2HD      PRO  10   3.890  -8.855  11.094
   87    HD3  PRO  10           1HD      PRO  10   5.383  -7.975  10.711
   88    H    ASN  11           H        ASN  11   1.145  -8.035  10.596
   89    HA   ASN  11           HA       ASN  11  -1.251  -6.862   9.431
   90    HB2  ASN  11           2HB      ASN  11  -1.242  -9.267  10.080
   91    HB3  ASN  11           1HB      ASN  11  -1.089  -8.799  11.769
   92   HD21  ASN  11          1HD2      ASN  11  -3.073  -9.612  12.464
   93   HD22  ASN  11          2HD2      ASN  11  -4.598  -8.997  11.933
   94    H    HIS  12           H        HIS  12  -2.245  -5.202  10.147
   95    HA   HIS  12           HA       HIS  12  -2.662  -4.297  12.789
   96    HB2  HIS  12           2HB      HIS  12  -0.176  -3.692  12.392
   97    HB3  HIS  12           1HB      HIS  12  -0.724  -2.583  11.143
   98    HD1  HIS  12           HD1      HIS  12  -0.436  -2.997  14.832
   99    HD2  HIS  12           HD2      HIS  12  -1.928  -0.200  12.141
  100    HE1  HIS  12           HE1      HIS  12  -0.803  -0.907  16.162
  101    HE2  HIS  12           HE2      HIS  12  -1.779   0.748  14.541
  102    H    ASN  13           H        ASN  13  -3.862  -1.967  12.518
  103    HA   ASN  13           HA       ASN  13  -5.698  -2.243  10.324
  104    HB2  ASN  13           2HB      ASN  13  -5.436   0.110  12.214
  105    HB3  ASN  13           1HB      ASN  13  -6.789  -0.211  11.148
  106   HD21  ASN  13          1HD2      ASN  13  -8.408  -0.559  12.583
  107   HD22  ASN  13          2HD2      ASN  13  -8.412  -1.808  13.776
  108    H    THR  14           H        THR  14  -2.779  -0.425  10.760
  109    HA   THR  14           HA       THR  14  -2.824   0.267   7.908
  110    HB   THR  14           HB       THR  14  -3.401   2.376   9.105
  111    HG1  THR  14           HG1      THR  14  -2.261   2.771   7.278
  112   HG21  THR  14          3HG2      THR  14  -1.768   3.502  10.560
  113   HG22  THR  14          1HG2      THR  14  -0.706   2.095  10.478
  114   HG23  THR  14          2HG2      THR  14  -2.281   1.968  11.266
  115    H    MET  15           H        MET  15  -0.569   0.652   7.087
  116    HA   MET  15           HA       MET  15   1.550  -0.586   8.728
  117    HB2  MET  15           2HB      MET  15   2.338  -1.901   6.779
  118    HB3  MET  15           1HB      MET  15   0.745  -2.396   7.322
  119    HG2  MET  15           2HG      MET  15  -0.303  -1.378   5.454
  120    HG3  MET  15           1HG      MET  15   1.153  -0.514   4.999
  121    HE1  MET  15           3HE      MET  15   1.729  -4.243   6.114
  122    HE2  MET  15           1HE      MET  15   1.026  -5.098   4.750
  123    HE3  MET  15           2HE      MET  15   0.002  -4.139   5.806
  124    H    LYS  16           H        LYS  16   3.207   0.686   8.791
  125    HA   LYS  16           HA       LYS  16   3.823   2.752   6.870
  126    HB2  LYS  16           2HB      LYS  16   4.295   3.155   9.245
  127    HB3  LYS  16           1HB      LYS  16   5.332   1.734   9.323
  128    HG2  LYS  16           2HG      LYS  16   6.940   2.808   7.790
  129    HG3  LYS  16           1HG      LYS  16   5.892   4.222   7.671
  130    HD2  LYS  16           2HD      LYS  16   6.240   4.711  10.059
  131    HD3  LYS  16           1HD      LYS  16   7.211   3.247  10.236
  132    HE2  LYS  16           2HE      LYS  16   8.872   4.188   8.640
  133    HE3  LYS  16           1HE      LYS  16   7.907   5.663   8.529
  134    HZ1  LYS  16           3HZ      LYS  16   8.251   6.002  10.903
  135    HZ2  LYS  16           1HZ      LYS  16   9.726   5.928  10.079
  136    HZ3  LYS  16           2HZ      LYS  16   9.196   4.605  10.986
  137    H    ILE  17           H        ILE  17   4.148   1.618   4.919
  138    HA   ILE  17           HA       ILE  17   6.275  -0.337   4.601
  139    HB   ILE  17           HB       ILE  17   4.726   1.247   2.483
  140   HG12  ILE  17          2HG1      ILE  17   4.296  -1.618   3.456
  141   HG13  ILE  17          1HG1      ILE  17   3.284  -0.242   3.873
  142   HG21  ILE  17          1HG2      ILE  17   6.517  -1.192   2.125
  143   HG22  ILE  17          2HG2      ILE  17   6.872   0.449   1.579
  144   HG23  ILE  17          3HG2      ILE  17   5.536  -0.447   0.858
  145   HD11  ILE  17          3HD1      ILE  17   2.250  -1.610   2.165
  146   HD12  ILE  17          1HD1      ILE  17   3.648  -1.410   1.110
  147   HD13  ILE  17          2HD1      ILE  17   2.637  -0.020   1.515
  148    H    THR  18           H        THR  18   8.193   0.528   5.186
  149    HA   THR  18           HA       THR  18   8.825   3.321   4.737
  150    HB   THR  18           HB       THR  18  10.660   1.240   5.994
  151    HG1  THR  18           HG1      THR  18   8.460   1.335   6.955
  152   HG21  THR  18          3HG2      THR  18  10.359   4.230   6.454
  153   HG22  THR  18          1HG2      THR  18  11.666   3.464   5.544
  154   HG23  THR  18          2HG2      THR  18  11.503   3.168   7.279
  155    H    LEU  19           H        LEU  19  10.405   4.130   3.387
  156    HA   LEU  19           HA       LEU  19  11.676   2.301   1.430
  157    HB2  LEU  19           2HB      LEU  19  11.008   5.250   1.070
  158    HB3  LEU  19           1HB      LEU  19  11.716   4.197  -0.148
  159    HG   LEU  19           HG       LEU  19   8.888   3.998   0.979
  160   HD11  LEU  19          1HD1      LEU  19   8.120   4.668  -1.253
  161   HD12  LEU  19          2HD1      LEU  19   9.793   4.862  -1.788
  162   HD13  LEU  19          3HD1      LEU  19   9.140   5.910  -0.525
  163   HD21  LEU  19          3HD2      LEU  19   9.724   1.760   0.455
  164   HD22  LEU  19          1HD2      LEU  19  10.181   2.282  -1.171
  165   HD23  LEU  19          2HD2      LEU  19   8.480   2.242  -0.694
  166    H    SER  20           H        SER  20  13.763   3.077   0.578
  167    HA   SER  20           HA       SER  20  15.601   3.557   2.742
  168    HB2  SER  20           2HB      SER  20  17.321   3.226   0.875
  169    HB3  SER  20           1HB      SER  20  16.197   1.886   1.105
  170    HG   SER  20           HG       SER  20  16.634   3.281  -1.103
  171    H    GLU  21           H        GLU  21  13.984   5.575   0.512
  172    HA   GLU  21           HA       GLU  21  16.049   7.617   0.335
  173    HB2  GLU  21           2HB      GLU  21  14.570   6.973  -1.615
  174    HB3  GLU  21           1HB      GLU  21  13.205   7.682  -0.758
  175    HG2  GLU  21           2HG      GLU  21  14.432   9.890  -0.785
  176    HG3  GLU  21           1HG      GLU  21  15.676   9.137  -1.779
  177    H    SER  22           H        SER  22  15.811   7.537   2.844
  178    HA   SER  22           HA       SER  22  13.675   9.208   3.940
  179    HB2  SER  22           2HB      SER  22  16.052   7.925   5.354
  180    HB3  SER  22           1HB      SER  22  14.575   8.540   6.103
  181    HG   SER  22           HG       SER  22  13.453   6.872   4.859
  182    H    ARG  23           H        ARG  23  14.565  10.979   2.452
  183    HA   ARG  23           HA       ARG  23  16.312  12.777   3.918
  184    HB2  ARG  23           2HB      ARG  23  17.840  11.272   2.459
  185    HB3  ARG  23           1HB      ARG  23  17.109  12.057   1.062
  186    HG2  ARG  23           2HG      ARG  23  17.903  14.268   1.988
  187    HG3  ARG  23           1HG      ARG  23  18.753  13.374   3.246
  188    HD2  ARG  23           2HD      ARG  23  20.402  13.848   1.613
  189    HD3  ARG  23           1HD      ARG  23  19.972  12.156   1.337
  190    HE   ARG  23           HE       ARG  23  18.337  13.301  -0.395
  191   HH11  ARG  23          1HH1      ARG  23  21.721  14.136   0.186
  192   HH12  ARG  23          2HH1      ARG  23  21.967  14.703  -1.434
  193   HH21  ARG  23          1HH2      ARG  23  18.690  14.104  -2.487
  194   HH22  ARG  23          2HH2      ARG  23  20.265  14.687  -2.945
  195    H    GLU  24           H        GLU  24  14.781  12.202   0.742
  196    HA   GLU  24           HA       GLU  24  14.668  14.923  -0.025
  197    HB2  GLU  24           2HB      GLU  24  13.147  12.540  -1.146
  198    HB3  GLU  24           1HB      GLU  24  13.227  14.128  -1.912
  199    HG2  GLU  24           2HG      GLU  24  15.578  12.274  -1.399
  200    HG3  GLU  24           1HG      GLU  24  14.773  12.514  -2.947
  201    H    GLY  25           H        GLY  25  12.498  13.081   1.954
  202    HA2  GLY  25           2HA      GLY  25  10.610  13.673   3.116
  203    HA3  GLY  25           1HA      GLY  25  10.981  15.345   2.716
  204    H    MET  26           H        MET  26   9.858  12.402   1.125
  205    HA   MET  26           HA       MET  26   8.530  13.339  -1.066
  206    HB2  MET  26           2HB      MET  26   7.744  10.953   0.667
  207    HB3  MET  26           1HB      MET  26   7.209  11.212  -0.991
  208    HG2  MET  26           2HG      MET  26   9.473  10.952  -1.816
  209    HG3  MET  26           1HG      MET  26  10.106  10.858  -0.167
  210    HE1  MET  26           3HE      MET  26  11.393   8.585  -0.900
  211    HE2  MET  26           1HE      MET  26  10.684   8.688  -2.514
  212    HE3  MET  26           2HE      MET  26  10.558   7.192  -1.590
  213    H    THR  27           H        THR  27   6.334  13.705  -1.599
  214    HA   THR  27           HA       THR  27   5.063  15.596   0.085
  215    HB   THR  27           HB       THR  27   3.273  15.585  -1.747
  216    HG1  THR  27           HG1      THR  27   3.277  13.710  -2.780
  217   HG21  THR  27          3HG2      THR  27   4.742  16.548  -3.487
  218   HG22  THR  27          1HG2      THR  27   6.157  15.869  -2.681
  219   HG23  THR  27          2HG2      THR  27   5.203  17.125  -1.886
  220    H    SER  28           H        SER  28   3.032  15.539   1.100
  221    HA   SER  28           HA       SER  28   2.130  12.932   2.068
  222    HB2  SER  28           2HB      SER  28   0.697  14.416   3.590
  223    HB3  SER  28           1HB      SER  28   2.439  14.605   3.764
  224    HG   SER  28           HG       SER  28   1.050  16.271   1.975
  225    H    ASP  29           H        ASP  29   0.753  11.883   0.696
  226    HA   ASP  29           HA       ASP  29  -1.635  13.267  -0.310
  227    HB2  ASP  29           2HB      ASP  29   0.233  11.585  -2.032
  228    HB3  ASP  29           1HB      ASP  29  -1.401  12.034  -2.522
  229    H    THR  30           H        THR  30  -3.445  12.100  -0.299
  230    HA   THR  30           HA       THR  30  -3.364   9.336   0.720
  231    HB   THR  30           HB       THR  30  -5.677  11.329   0.723
  232    HG1  THR  30           HG1      THR  30  -3.732  11.693   2.143
  233   HG21  THR  30          3HG2      THR  30  -6.737   9.763   2.317
  234   HG22  THR  30          1HG2      THR  30  -5.392   8.640   2.113
  235   HG23  THR  30          2HG2      THR  30  -6.468   8.984   0.756
  236    H    TYR  31           H        TYR  31  -3.152   8.144  -1.090
  237    HA   TYR  31           HA       TYR  31  -4.700   8.489  -3.506
  238    HB2  TYR  31           2HB      TYR  31  -2.808   6.245  -2.661
  239    HB3  TYR  31           1HB      TYR  31  -3.406   6.531  -4.290
  240    HD1  TYR  31           HD1      TYR  31  -3.022   9.414  -4.676
  241    HD2  TYR  31           HD2      TYR  31  -0.448   6.619  -2.713
  242    HE1  TYR  31           HE1      TYR  31  -1.100  10.841  -5.171
  243    HE2  TYR  31           HE2      TYR  31   1.484   8.062  -3.218
  244    HH   TYR  31           HH       TYR  31   1.128  11.275  -4.317
  245    H    THR  32           H        THR  32  -6.776   7.737  -3.642
  246    HA   THR  32           HA       THR  32  -7.562   5.243  -2.264
  247    HB   THR  32           HB       THR  32  -9.774   6.374  -1.617
  248    HG1  THR  32           HG1      THR  32  -8.469   8.855  -1.631
  249   HG21  THR  32          3HG2      THR  32  -7.260   7.397  -0.248
  250   HG22  THR  32          1HG2      THR  32  -8.108   5.892   0.114
  251   HG23  THR  32          2HG2      THR  32  -8.887   7.442   0.435
  252    H    LYS  33           H        LYS  33  -9.295   7.742  -4.227
  253    HA   LYS  33           HA       LYS  33 -10.939   5.585  -5.347
  254    HB2  LYS  33           2HB      LYS  33 -12.533   7.353  -5.946
  255    HB3  LYS  33           1HB      LYS  33 -12.059   7.510  -4.258
  256    HG2  LYS  33           2HG      LYS  33 -10.667   9.414  -4.720
  257    HG3  LYS  33           1HG      LYS  33 -10.770   9.155  -6.465
  258    HD2  LYS  33           2HD      LYS  33 -13.217   9.676  -6.354
  259    HD3  LYS  33           1HD      LYS  33 -13.042  10.024  -4.632
  260    HE2  LYS  33           2HE      LYS  33 -11.576  11.895  -5.112
  261    HE3  LYS  33           1HE      LYS  33 -11.536  11.485  -6.827
  262    HZ1  LYS  33           3HZ      LYS  33 -13.896  11.956  -6.955
  263    HZ2  LYS  33           1HZ      LYS  33 -13.046  13.308  -6.397
  264    HZ3  LYS  33           2HZ      LYS  33 -13.935  12.361  -5.317
  265    H    VAL  34           H        VAL  34  -8.202   6.266  -6.451
  266    HA   VAL  34           HA       VAL  34  -7.033   6.642  -8.327
  267    HB   VAL  34           HB       VAL  34  -9.608   5.907  -9.779
  268   HG11  VAL  34          1HG1      VAL  34  -6.762   5.975 -10.864
  269   HG12  VAL  34          2HG1      VAL  34  -8.067   7.082 -11.299
  270   HG13  VAL  34          3HG1      VAL  34  -8.176   5.378 -11.740
  271   HG21  VAL  34          3HG2      VAL  34  -7.259   4.140  -8.973
  272   HG22  VAL  34          1HG2      VAL  34  -8.634   3.619  -9.953
  273   HG23  VAL  34          2HG2      VAL  34  -8.880   4.105  -8.275
  274    H    ASP  35           H        ASP  35  -6.572   8.791  -8.066
  275    HA   ASP  35           HA       ASP  35  -7.871  10.819  -9.649
  276    HB2  ASP  35           2HB      ASP  35  -9.420  10.568  -7.657
  277    HB3  ASP  35           1HB      ASP  35  -8.085  10.999  -6.601
  278    H    ASP  36           H        ASP  36  -6.705  12.798  -9.642
  279    HA   ASP  36           HA       ASP  36  -5.051  14.283  -9.469
  280    HB2  ASP  36           2HB      ASP  36  -5.511  14.144  -7.005
  281    HB3  ASP  36           1HB      ASP  36  -4.264  12.912  -6.865
  282    H    SER  37           H        SER  37  -3.210  11.607  -7.955
  283    HA   SER  37           HA       SER  37  -1.694  11.066 -10.374
  284    HB2  SER  37           2HB      SER  37  -0.531  13.099  -9.519
  285    HB3  SER  37           1HB      SER  37  -0.271  12.308  -7.964
  286    HG   SER  37           HG       SER  37   1.436  11.422  -8.800
  287    H    GLN  38           H        GLN  38  -3.030   9.147  -9.641
  288    HA   GLN  38           HA       GLN  38  -1.504   7.420  -7.783
  289    HB2  GLN  38           2HB      GLN  38  -4.334   7.088  -8.872
  290    HB3  GLN  38           1HB      GLN  38  -3.527   5.974  -7.769
  291    HG2  GLN  38           2HG      GLN  38  -3.405   7.787  -6.080
  292    HG3  GLN  38           1HG      GLN  38  -4.274   8.853  -7.177
  293   HE21  GLN  38          1HE2      GLN  38  -5.029   5.436  -6.782
  294   HE22  GLN  38          2HE2      GLN  38  -6.538   5.672  -5.984
  295    HA   PRO  39           HA       PRO  39   0.034   5.622 -11.791
  296    HB2  PRO  39           2HB      PRO  39   1.518   3.994  -9.720
  297    HB3  PRO  39           1HB      PRO  39   2.140   4.764 -11.195
  298    HG2  PRO  39           2HG      PRO  39   2.658   5.851  -8.836
  299    HG3  PRO  39           1HG      PRO  39   2.232   6.888 -10.218
  300    HD2  PRO  39           2HD      PRO  39   0.508   6.060  -7.892
  301    HD3  PRO  39           1HD      PRO  39   0.616   7.633  -8.713
  302    H    ALA  40           H        ALA  40  -0.351   3.576 -12.758
  303    HA   ALA  40           HA       ALA  40  -2.673   2.194 -12.147
  304    HB1  ALA  40           3HB      ALA  40  -1.909   0.522 -13.792
  305    HB2  ALA  40           1HB      ALA  40  -0.265   1.167 -13.696
  306    HB3  ALA  40           2HB      ALA  40  -1.569   2.160 -14.347
  307    H    PHE  41           H        PHE  41   0.611   1.515 -11.178
  308    HA   PHE  41           HA       PHE  41   0.347  -1.069 -10.094
  309    HB2  PHE  41           2HB      PHE  41   2.309   1.118  -9.289
  310    HB3  PHE  41           1HB      PHE  41   2.524  -0.616  -9.078
  311    HD1  PHE  41           HD1      PHE  41   2.722  -2.086 -11.177
  312    HD2  PHE  41           HD2      PHE  41   3.026   2.182 -11.324
  313    HE1  PHE  41           HE1      PHE  41   3.842  -2.234 -13.363
  314    HE2  PHE  41           HE2      PHE  41   4.149   2.019 -13.512
  315    HZ   PHE  41           HZ       PHE  41   4.555  -0.188 -14.533
  316    H    ILE  42           H        ILE  42   0.015   2.160  -8.661
  317    HA   ILE  42           HA       ILE  42  -0.520   1.315  -5.961
  318    HB   ILE  42           HB       ILE  42  -0.943   4.004  -7.342
  319   HG12  ILE  42          2HG1      ILE  42   1.421   3.343  -7.250
  320   HG13  ILE  42          1HG1      ILE  42   1.141   4.696  -6.166
  321   HG21  ILE  42          1HG2      ILE  42  -2.441   3.905  -5.407
  322   HG22  ILE  42          2HG2      ILE  42  -1.121   5.034  -5.095
  323   HG23  ILE  42          3HG2      ILE  42  -1.100   3.429  -4.360
  324   HD11  ILE  42          3HD1      ILE  42   1.472   1.797  -5.360
  325   HD12  ILE  42          1HD1      ILE  42   1.158   3.135  -4.248
  326   HD13  ILE  42          2HD1      ILE  42   2.656   3.089  -5.176
  327    H    ASN  43           H        ASN  43  -2.451   1.866  -8.862
  328    HA   ASN  43           HA       ASN  43  -5.030   2.164  -7.646
  329    HB2  ASN  43           2HB      ASN  43  -4.173   1.294 -10.444
  330    HB3  ASN  43           1HB      ASN  43  -5.857   1.426  -9.976
  331   HD21  ASN  43          1HD2      ASN  43  -3.449   3.760  -8.870
  332   HD22  ASN  43          2HD2      ASN  43  -4.030   5.054  -9.846
  333    H    ASP  44           H        ASP  44  -3.120  -0.512  -8.884
  334    HA   ASP  44           HA       ASP  44  -4.871  -2.657  -8.664
  335    HB2  ASP  44           2HB      ASP  44  -2.753  -2.845  -9.846
  336    HB3  ASP  44           1HB      ASP  44  -1.844  -2.516  -8.376
  337    H    ILE  45           H        ILE  45  -2.530  -1.399  -6.254
  338    HA   ILE  45           HA       ILE  45  -2.933  -3.280  -4.216
  339    HB   ILE  45           HB       ILE  45  -2.209  -0.335  -3.840
  340   HG12  ILE  45          2HG1      ILE  45  -0.346  -2.730  -4.213
  341   HG13  ILE  45          1HG1      ILE  45  -0.682  -1.507  -5.434
  342   HG21  ILE  45          1HG2      ILE  45  -2.861  -1.388  -1.709
  343   HG22  ILE  45          2HG2      ILE  45  -1.130  -1.058  -1.722
  344   HG23  ILE  45          3HG2      ILE  45  -1.715  -2.703  -1.983
  345   HD11  ILE  45          3HD1      ILE  45   0.708  -1.042  -2.792
  346   HD12  ILE  45          1HD1      ILE  45   0.352   0.198  -4.001
  347   HD13  ILE  45          2HD1      ILE  45   1.458  -1.119  -4.387
  348    H    LEU  46           H        LEU  46  -4.536  -0.138  -4.754
  349    HA   LEU  46           HA       LEU  46  -6.360  -0.180  -2.592
  350    HB2  LEU  46           2HB      LEU  46  -6.422   1.183  -5.299
  351    HB3  LEU  46           1HB      LEU  46  -7.678   1.459  -4.096
  352    HG   LEU  46           HG       LEU  46  -4.767   1.911  -3.401
  353   HD11  LEU  46          1HD1      LEU  46  -6.541   3.973  -4.714
  354   HD12  LEU  46          2HD1      LEU  46  -5.098   3.231  -5.406
  355   HD13  LEU  46          3HD1      LEU  46  -4.957   4.273  -3.993
  356   HD21  LEU  46          3HD2      LEU  46  -7.323   3.127  -2.296
  357   HD22  LEU  46          1HD2      LEU  46  -5.681   3.455  -1.732
  358   HD23  LEU  46          2HD2      LEU  46  -6.369   1.846  -1.540
  359    H    LYS  47           H        LYS  47  -6.575  -1.558  -5.830
  360    HA   LYS  47           HA       LYS  47  -9.346  -2.337  -5.630
  361    HB2  LYS  47           2HB      LYS  47  -7.185  -3.033  -7.655
  362    HB3  LYS  47           1HB      LYS  47  -8.859  -3.573  -7.792
  363    HG2  LYS  47           2HG      LYS  47  -9.630  -1.250  -7.966
  364    HG3  LYS  47           1HG      LYS  47  -7.980  -0.660  -7.727
  365    HD2  LYS  47           2HD      LYS  47  -7.309  -1.821  -9.847
  366    HD3  LYS  47           1HD      LYS  47  -8.997  -2.290 -10.093
  367    HE2  LYS  47           2HE      LYS  47  -9.637   0.085 -10.205
  368    HE3  LYS  47           1HE      LYS  47  -7.956   0.560  -9.935
  369    HZ1  LYS  47           3HZ      LYS  47  -7.371  -0.586 -11.996
  370    HZ2  LYS  47           1HZ      LYS  47  -8.493   0.649 -12.269
  371    HZ3  LYS  47           2HZ      LYS  47  -8.996  -0.964 -12.262
  372    H    VAL  48           H        VAL  48  -6.367  -3.709  -4.503
  373    HA   VAL  48           HA       VAL  48  -7.244  -6.445  -4.335
  374    HB   VAL  48           HB       VAL  48  -5.149  -5.034  -2.602
  375   HG11  VAL  48          1HG1      VAL  48  -5.980  -7.061  -1.487
  376   HG12  VAL  48          2HG1      VAL  48  -4.324  -7.306  -2.038
  377   HG13  VAL  48          3HG1      VAL  48  -5.666  -8.020  -2.937
  378   HG21  VAL  48          3HG2      VAL  48  -3.458  -6.095  -4.073
  379   HG22  VAL  48          1HG2      VAL  48  -4.505  -4.996  -4.970
  380   HG23  VAL  48          2HG2      VAL  48  -4.747  -6.737  -5.095
  381    H    GLU  49           H        GLU  49  -8.598  -7.328  -2.964
  382    HA   GLU  49           HA       GLU  49 -10.446  -5.821  -1.482
  383    HB2  GLU  49           2HB      GLU  49  -9.949  -8.827  -1.545
  384    HB3  GLU  49           1HB      GLU  49 -11.389  -8.066  -0.868
  385    HG2  GLU  49           2HG      GLU  49 -12.113  -7.291  -3.024
  386    HG3  GLU  49           1HG      GLU  49 -10.556  -7.662  -3.757
  387    H    GLY  50           H        GLY  50  -9.475  -4.667   0.108
  388    HA2  GLY  50           2HA      GLY  50  -9.407  -5.411   2.703
  389    HA3  GLY  50           1HA      GLY  50  -7.776  -5.799   2.156
  390    H    VAL  51           H        VAL  51  -7.193  -3.814   0.411
  391    HA   VAL  51           HA       VAL  51  -6.325  -1.767   2.192
  392    HB   VAL  51           HB       VAL  51  -6.188  -1.929  -0.855
  393   HG11  VAL  51          1HG1      VAL  51  -4.422  -0.182  -0.744
  394   HG12  VAL  51          2HG1      VAL  51  -4.770   0.041   0.974
  395   HG13  VAL  51          3HG1      VAL  51  -6.001   0.419  -0.230
  396   HG21  VAL  51          3HG2      VAL  51  -3.864  -2.640  -0.516
  397   HG22  VAL  51          1HG2      VAL  51  -4.970  -3.728   0.323
  398   HG23  VAL  51          2HG2      VAL  51  -4.057  -2.523   1.236
  399    H    LYS  52           H        LYS  52  -7.377  -0.020   2.839
  400    HA   LYS  52           HA       LYS  52  -9.818   0.882   1.474
  401    HB2  LYS  52           2HB      LYS  52  -9.894   0.360   3.926
  402    HB3  LYS  52           1HB      LYS  52  -8.742   1.658   4.224
  403    HG2  LYS  52           2HG      LYS  52 -10.337   3.323   3.480
  404    HG3  LYS  52           1HG      LYS  52 -11.460   2.081   2.940
  405    HD2  LYS  52           2HD      LYS  52 -12.341   2.901   5.000
  406    HD3  LYS  52           1HD      LYS  52 -11.642   1.327   5.368
  407    HE2  LYS  52           2HE      LYS  52 -10.149   3.922   5.853
  408    HE3  LYS  52           1HE      LYS  52 -11.221   3.208   7.050
  409    HZ1  LYS  52           3HZ      LYS  52  -8.748   1.995   5.943
  410    HZ2  LYS  52           1HZ      LYS  52  -9.824   1.201   6.985
  411    HZ3  LYS  52           2HZ      LYS  52  -8.992   2.575   7.507
  412    H    SER  53           H        SER  53  -6.778   2.256   2.848
  413    HA   SER  53           HA       SER  53  -6.798   4.354   0.771
  414    HB2  SER  53           2HB      SER  53  -7.925   5.467   2.597
  415    HB3  SER  53           1HB      SER  53  -6.762   4.864   3.774
  416    HG   SER  53           HG       SER  53  -5.423   6.397   3.259
  417    H    ILE  54           H        ILE  54  -4.781   5.325   0.387
  418    HA   ILE  54           HA       ILE  54  -2.367   3.981   1.478
  419    HB   ILE  54           HB       ILE  54  -3.015   4.705  -1.423
  420   HG12  ILE  54          2HG1      ILE  54  -2.294   2.054  -0.104
  421   HG13  ILE  54          1HG1      ILE  54  -3.861   2.509  -0.764
  422   HG21  ILE  54          1HG2      ILE  54  -0.747   4.078  -2.101
  423   HG22  ILE  54          2HG2      ILE  54  -0.303   3.802  -0.418
  424   HG23  ILE  54          3HG2      ILE  54  -0.695   5.431  -0.966
  425   HD11  ILE  54          3HD1      ILE  54  -1.322   2.006  -2.311
  426   HD12  ILE  54          1HD1      ILE  54  -2.834   2.591  -3.014
  427   HD13  ILE  54          2HD1      ILE  54  -2.771   1.003  -2.255
  428    H    PHE  55           H        PHE  55  -1.854   5.676   2.914
  429    HA   PHE  55           HA       PHE  55  -1.658   8.419   1.858
  430    HB2  PHE  55           2HB      PHE  55  -2.848   8.132   3.997
  431    HB3  PHE  55           1HB      PHE  55  -1.414   7.407   4.715
  432    HD1  PHE  55           HD1      PHE  55  -1.921  10.507   2.624
  433    HD2  PHE  55           HD2      PHE  55  -0.558   8.894   6.352
  434    HE1  PHE  55           HE1      PHE  55  -1.172  12.744   3.324
  435    HE2  PHE  55           HE2      PHE  55   0.182  11.140   7.039
  436    HZ   PHE  55           HZ       PHE  55  -0.118  13.063   5.528
  437    H    HIS  56           H        HIS  56   0.175   8.564   0.689
  438    HA   HIS  56           HA       HIS  56   2.735   7.502   1.650
  439    HB2  HIS  56           2HB      HIS  56   2.154   7.240  -0.733
  440    HB3  HIS  56           1HB      HIS  56   1.974   8.977  -0.904
  441    HD1  HIS  56           HD1      HIS  56   3.810   9.440  -2.556
  442    HD2  HIS  56           HD2      HIS  56   5.159   7.231   0.690
  443    HE1  HIS  56           HE1      HIS  56   6.296   9.308  -2.812
  444    HE2  HIS  56           HE2      HIS  56   7.074   7.859  -0.918
  445    H    VAL  57           H        VAL  57   4.266   8.781   2.656
  446    HA   VAL  57           HA       VAL  57   4.352  11.649   2.465
  447    HB   VAL  57           HB       VAL  57   2.467  11.522   4.011
  448   HG11  VAL  57          1HG1      VAL  57   4.138   9.748   5.778
  449   HG12  VAL  57          2HG1      VAL  57   2.733   9.266   4.827
  450   HG13  VAL  57          3HG1      VAL  57   2.540  10.391   6.175
  451   HG21  VAL  57          3HG2      VAL  57   4.951  12.286   5.586
  452   HG22  VAL  57          1HG2      VAL  57   3.295  12.789   5.950
  453   HG23  VAL  57          2HG2      VAL  57   4.078  13.330   4.464
  454    H    MET  58           H        MET  58   6.311  12.437   3.044
  455    HA   MET  58           HA       MET  58   8.381  12.738   3.797
  456    HB2  MET  58           2HB      MET  58   7.458  12.431   6.036
  457    HB3  MET  58           1HB      MET  58   7.655  10.687   5.914
  458    HG2  MET  58           2HG      MET  58  10.105  10.966   5.829
  459    HG3  MET  58           1HG      MET  58   9.904  12.717   5.935
  460    HE1  MET  58           3HE      MET  58  11.389  11.460   9.433
  461    HE2  MET  58           1HE      MET  58  11.745  12.416   7.997
  462    HE3  MET  58           2HE      MET  58  11.647  10.655   7.885
  463    H    ASP  59           H        ASP  59   8.202   9.185   4.388
  464    HA   ASP  59           HA       ASP  59  10.017   8.622   2.178
  465    HB2  ASP  59           2HB      ASP  59  11.841   7.711   3.497
  466    HB3  ASP  59           1HB      ASP  59  11.537   9.343   4.070
  467    H    PHE  60           H        PHE  60   7.339   7.846   3.618
  468    HA   PHE  60           HA       PHE  60   7.566   4.945   3.251
  469    HB2  PHE  60           2HB      PHE  60   6.513   4.479   5.434
  470    HB3  PHE  60           1HB      PHE  60   8.043   5.317   5.651
  471    HD1  PHE  60           HD1      PHE  60   8.048   7.757   6.323
  472    HD2  PHE  60           HD2      PHE  60   4.430   5.462   6.209
  473    HE1  PHE  60           HE1      PHE  60   6.915   9.460   7.686
  474    HE2  PHE  60           HE2      PHE  60   3.313   7.172   7.574
  475    HZ   PHE  60           HZ       PHE  60   4.539   9.185   8.287
  476    H    ILE  61           H        ILE  61   5.409   3.907   3.329
  477    HA   ILE  61           HA       ILE  61   3.214   5.699   2.481
  478    HB   ILE  61           HB       ILE  61   3.477   2.818   1.483
  479   HG12  ILE  61          2HG1      ILE  61   4.071   3.980  -0.818
  480   HG13  ILE  61          1HG1      ILE  61   4.622   5.320   0.177
  481   HG21  ILE  61          1HG2      ILE  61   1.836   5.179   0.503
  482   HG22  ILE  61          2HG2      ILE  61   1.238   3.819   1.454
  483   HG23  ILE  61          3HG2      ILE  61   1.820   3.553  -0.189
  484   HD11  ILE  61          3HD1      ILE  61   6.449   3.879  -0.523
  485   HD12  ILE  61          1HD1      ILE  61   5.687   2.497   0.264
  486   HD13  ILE  61          2HD1      ILE  61   6.271   3.855   1.230
  487    H    SER  62           H        SER  62   2.051   5.778   4.384
  488    HA   SER  62           HA       SER  62   1.545   3.414   5.985
  489    HB2  SER  62           2HB      SER  62   0.082   5.035   7.315
  490    HB3  SER  62           1HB      SER  62   1.790   5.457   7.216
  491    HG   SER  62           HG       SER  62  -0.010   6.506   5.326
  492    H    VAL  63           H        VAL  63   0.500   2.026   4.587
  493    HA   VAL  63           HA       VAL  63  -2.011   2.757   3.274
  494    HB   VAL  63           HB       VAL  63  -0.620   0.034   3.359
  495   HG11  VAL  63          1HG1      VAL  63  -2.738   1.064   1.447
  496   HG12  VAL  63          2HG1      VAL  63  -2.993  -0.096   2.750
  497   HG13  VAL  63          3HG1      VAL  63  -1.961  -0.522   1.384
  498   HG21  VAL  63          3HG2      VAL  63  -0.348   2.168   1.206
  499   HG22  VAL  63          1HG2      VAL  63   0.328   0.535   1.145
  500   HG23  VAL  63          2HG2      VAL  63   0.904   1.683   2.354
  501    H    ASP  64           H        ASP  64  -3.851   2.679   4.489
  502    HA   ASP  64           HA       ASP  64  -4.078   0.725   6.702
  503    HB2  ASP  64           2HB      ASP  64  -6.055   2.055   7.445
  504    HB3  ASP  64           1HB      ASP  64  -4.569   2.989   7.391
  505    H    LYS  65           H        LYS  65  -6.256  -0.250   7.040
  506    HA   LYS  65           HA       LYS  65  -7.561  -1.048   4.515
  507    HB2  LYS  65           2HB      LYS  65  -7.401  -3.466   5.196
  508    HB3  LYS  65           1HB      LYS  65  -5.868  -2.727   4.785
  509    HG2  LYS  65           2HG      LYS  65  -5.291  -4.014   6.628
  510    HG3  LYS  65           1HG      LYS  65  -5.547  -2.437   7.368
  511    HD2  LYS  65           2HD      LYS  65  -7.731  -3.134   8.199
  512    HD3  LYS  65           1HD      LYS  65  -7.636  -4.647   7.302
  513    HE2  LYS  65           2HE      LYS  65  -5.845  -3.859   9.625
  514    HE3  LYS  65           1HE      LYS  65  -7.192  -4.997   9.699
  515    HZ1  LYS  65           3HZ      LYS  65  -6.021  -6.413   8.133
  516    HZ2  LYS  65           1HZ      LYS  65  -5.079  -6.139   9.510
  517    HZ3  LYS  65           2HZ      LYS  65  -4.730  -5.321   8.068
  518    H    GLU  66           H        GLU  66  -9.522  -2.422   4.936
  519    HA   GLU  66           HA       GLU  66 -11.087  -1.562   7.245
  520    HB2  GLU  66           2HB      GLU  66 -11.730  -3.550   5.018
  521    HB3  GLU  66           1HB      GLU  66 -12.881  -2.972   6.230
  522    HG2  GLU  66           2HG      GLU  66 -12.633  -0.672   5.349
  523    HG3  GLU  66           1HG      GLU  66 -11.485  -1.260   4.146
  524    H    ASN  67           H        ASN  67 -11.233  -2.757   9.112
  525    HA   ASN  67           HA       ASN  67  -9.137  -4.462   9.772
  526    HB2  ASN  67           2HB      ASN  67 -10.434  -2.976  11.333
  527    HB3  ASN  67           1HB      ASN  67 -11.735  -4.153  11.331
  528   HD21  ASN  67          1HD2      ASN  67 -11.481  -6.071  12.529
  529   HD22  ASN  67          2HD2      ASN  67 -10.179  -6.308  13.636
  530    H    ASP  68           H        ASP  68 -12.204  -5.327   8.453
  531    HA   ASP  68           HA       ASP  68 -12.601  -7.986   9.074
  532    HB2  ASP  68           2HB      ASP  68 -12.924  -6.696   6.327
  533    HB3  ASP  68           1HB      ASP  68 -13.682  -8.201   6.849
  534    H    ALA  69           H        ALA  69 -10.490  -6.658   6.544
  535    HA   ALA  69           HA       ALA  69  -9.499  -9.288   5.747
  536    HB1  ALA  69           3HB      ALA  69 -10.027  -7.651   4.008
  537    HB2  ALA  69           1HB      ALA  69  -8.312  -8.063   3.973
  538    HB3  ALA  69           2HB      ALA  69  -8.842  -6.528   4.673
  539    H    ASN  70           H        ASN  70  -7.649 -10.158   6.472
  540    HA   ASN  70           HA       ASN  70  -5.738  -8.658   8.087
  541    HB2  ASN  70           2HB      ASN  70  -5.679 -11.549   7.123
  542    HB3  ASN  70           1HB      ASN  70  -4.559 -10.846   8.283
  543   HD21  ASN  70          1HD2      ASN  70  -5.278 -10.413  10.399
  544   HD22  ASN  70          2HD2      ASN  70  -6.757 -11.059  11.014
  545    H    TRP  71           H        TRP  71  -3.417  -8.618   7.521
  546    HA   TRP  71           HA       TRP  71  -3.141  -7.635   4.833
  547    HB2  TRP  71           2HB      TRP  71  -1.310  -7.682   7.224
  548    HB3  TRP  71           1HB      TRP  71  -0.675  -7.246   5.643
  549    HD1  TRP  71           HD1      TRP  71  -1.978  -5.629   8.606
  550    HE1  TRP  71           HE1      TRP  71  -2.652  -3.209   8.123
  551    HE3  TRP  71           HE3      TRP  71  -2.203  -5.830   3.497
  552    HZ2  TRP  71           HZ2      TRP  71  -3.181  -1.595   5.932
  553    HZ3  TRP  71           HZ3      TRP  71  -2.813  -3.770   2.284
  554    HH2  TRP  71           HH2      TRP  71  -3.293  -1.696   3.491
  555    H    GLU  72           H        GLU  72  -2.165 -10.631   6.410
  556    HA   GLU  72           HA       GLU  72   0.134 -11.274   4.966
  557    HB2  GLU  72           2HB      GLU  72  -0.576 -13.769   5.563
  558    HB3  GLU  72           1HB      GLU  72  -0.054 -12.645   6.800
  559    HG2  GLU  72           2HG      GLU  72  -1.941 -13.917   7.593
  560    HG3  GLU  72           1HG      GLU  72  -2.387 -12.224   7.431
  561    H    THR  73           H        THR  73  -3.167 -11.618   3.907
  562    HA   THR  73           HA       THR  73  -2.567 -13.279   1.612
  563    HB   THR  73           HB       THR  73  -4.763 -13.508   2.721
  564    HG1  THR  73           HG1      THR  73  -4.353 -13.233   0.112
  565   HG21  THR  73          3HG2      THR  73  -5.392 -10.691   1.743
  566   HG22  THR  73          1HG2      THR  73  -5.154 -11.162   3.427
  567   HG23  THR  73          2HG2      THR  73  -6.529 -11.797   2.520
  568    H    VAL  74           H        VAL  74  -3.142  -9.883   2.318
  569    HA   VAL  74           HA       VAL  74  -3.240  -8.885  -0.352
  570    HB   VAL  74           HB       VAL  74  -2.677  -7.371   2.243
  571   HG11  VAL  74          1HG1      VAL  74  -3.513  -5.361   1.070
  572   HG12  VAL  74          2HG1      VAL  74  -3.670  -6.293  -0.421
  573   HG13  VAL  74          3HG1      VAL  74  -2.079  -6.026   0.287
  574   HG21  VAL  74          3HG2      VAL  74  -5.358  -7.884   0.894
  575   HG22  VAL  74          1HG2      VAL  74  -5.100  -6.871   2.321
  576   HG23  VAL  74          2HG2      VAL  74  -4.797  -8.608   2.404
  577    H    LEU  75           H        LEU  75  -0.629  -9.406   1.968
  578    HA   LEU  75           HA       LEU  75   1.294  -7.586   1.235
  579    HB2  LEU  75           2HB      LEU  75   1.606 -10.346   2.431
  580    HB3  LEU  75           1HB      LEU  75   2.987  -9.293   2.185
  581    HG   LEU  75           HG       LEU  75   0.601  -8.672   3.971
  582   HD11  LEU  75          1HD1      LEU  75   2.128  -8.966   5.857
  583   HD12  LEU  75          2HD1      LEU  75   3.430  -9.429   4.756
  584   HD13  LEU  75          3HD1      LEU  75   1.999 -10.451   4.915
  585   HD21  LEU  75          3HD2      LEU  75   1.928  -6.731   4.723
  586   HD22  LEU  75          1HD2      LEU  75   1.510  -6.630   3.014
  587   HD23  LEU  75          2HD2      LEU  75   3.146  -7.090   3.495
  588    HA   PRO  76           HA       PRO  76   3.386 -10.804  -1.906
  589    HB2  PRO  76           2HB      PRO  76   0.880 -12.153  -2.905
  590    HB3  PRO  76           1HB      PRO  76   2.519 -12.814  -2.698
  591    HG2  PRO  76           2HG      PRO  76   0.638 -13.451  -0.953
  592    HG3  PRO  76           1HG      PRO  76   2.280 -13.065  -0.386
  593    HD2  PRO  76           2HD      PRO  76  -0.181 -11.326  -0.340
  594    HD3  PRO  76           1HD      PRO  76   1.060 -11.559   0.914
  595    H    LYS  77           H        LYS  77   0.212  -9.374  -2.362
  596    HA   LYS  77           HA       LYS  77   0.566  -8.775  -5.170
  597    HB2  LYS  77           2HB      LYS  77  -1.659  -8.115  -3.199
  598    HB3  LYS  77           1HB      LYS  77  -1.673  -7.553  -4.864
  599    HG2  LYS  77           2HG      LYS  77  -3.075  -9.503  -4.755
  600    HG3  LYS  77           1HG      LYS  77  -1.606  -9.949  -5.627
  601    HD2  LYS  77           2HD      LYS  77  -0.756 -10.882  -3.367
  602    HD3  LYS  77           1HD      LYS  77  -2.414 -10.697  -2.791
  603    HE2  LYS  77           2HE      LYS  77  -1.546 -12.385  -5.169
  604    HE3  LYS  77           1HE      LYS  77  -1.929 -13.004  -3.563
  605    HZ1  LYS  77           3HZ      LYS  77  -3.836 -11.586  -5.350
  606    HZ2  LYS  77           1HZ      LYS  77  -4.191 -12.254  -3.836
  607    HZ3  LYS  77           2HZ      LYS  77  -3.758 -13.260  -5.123
  608    H    VAL  78           H        VAL  78   0.646  -6.953  -2.090
  609    HA   VAL  78           HA       VAL  78   1.088  -4.376  -3.224
  610    HB   VAL  78           HB       VAL  78   1.962  -5.393  -0.472
  611   HG11  VAL  78          1HG1      VAL  78   3.117  -3.313  -1.063
  612   HG12  VAL  78          2HG1      VAL  78   1.938  -3.013   0.215
  613   HG13  VAL  78          3HG1      VAL  78   1.579  -2.536  -1.448
  614   HG21  VAL  78          3HG2      VAL  78  -0.143  -4.403   0.382
  615   HG22  VAL  78          1HG2      VAL  78  -0.453  -5.690  -0.785
  616   HG23  VAL  78          2HG2      VAL  78  -0.624  -4.002  -1.269
  617    H    GLU  79           H        GLU  79   3.305  -6.860  -1.959
  618    HA   GLU  79           HA       GLU  79   5.752  -5.509  -2.365
  619    HB2  GLU  79           2HB      GLU  79   5.409  -7.436  -0.822
  620    HB3  GLU  79           1HB      GLU  79   5.203  -8.498  -2.211
  621    HG2  GLU  79           2HG      GLU  79   7.544  -7.992  -2.906
  622    HG3  GLU  79           1HG      GLU  79   7.732  -6.989  -1.467
  623    H    ALA  80           H        ALA  80   3.774  -7.536  -4.448
  624    HA   ALA  80           HA       ALA  80   5.520  -8.150  -6.544
  625    HB1  ALA  80           3HB      ALA  80   2.531  -7.624  -6.730
  626    HB2  ALA  80           1HB      ALA  80   3.286  -9.169  -6.332
  627    HB3  ALA  80           2HB      ALA  80   3.511  -8.468  -7.935
  628    H    VAL  81           H        VAL  81   3.706  -5.187  -5.859
  629    HA   VAL  81           HA       VAL  81   4.003  -3.785  -8.281
  630    HB   VAL  81           HB       VAL  81   3.770  -2.809  -5.406
  631   HG11  VAL  81          1HG1      VAL  81   3.174  -0.539  -6.290
  632   HG12  VAL  81          2HG1      VAL  81   3.733  -1.052  -7.883
  633   HG13  VAL  81          3HG1      VAL  81   4.867  -0.976  -6.538
  634   HG21  VAL  81          3HG2      VAL  81   1.429  -2.316  -6.037
  635   HG22  VAL  81          1HG2      VAL  81   1.830  -4.020  -6.263
  636   HG23  VAL  81          2HG2      VAL  81   1.737  -2.940  -7.658
  637    H    PHE  82           H        PHE  82   6.098  -3.834  -5.410
  638    HA   PHE  82           HA       PHE  82   8.178  -2.204  -6.645
  639    HB2  PHE  82           2HB      PHE  82   8.301  -3.642  -3.966
  640    HB3  PHE  82           1HB      PHE  82   9.179  -2.196  -4.457
  641    HD1  PHE  82           HD2      PHE  82   7.884  -0.014  -4.763
  642    HD2  PHE  82           HD1      PHE  82   6.130  -3.493  -2.997
  643    HE1  PHE  82           HE2      PHE  82   6.040   1.348  -3.868
  644    HE2  PHE  82           HE1      PHE  82   4.294  -2.126  -2.118
  645    HZ   PHE  82           HZ       PHE  82   4.248   0.276  -2.569
  646    H    GLU  83           H        GLU  83   7.566  -5.135  -7.617
  647    HA   GLU  83           HA       GLU  83  10.348  -5.915  -7.964
  648    HB2  GLU  83           2HB      GLU  83   9.583  -6.830  -5.687
  649    HB3  GLU  83           1HB      GLU  83   8.500  -7.901  -6.568
  650    HG2  GLU  83           2HG      GLU  83  10.416  -8.986  -7.654
  651    HG3  GLU  83           1HG      GLU  83  11.527  -7.855  -6.881
  652    H    LEU  84           H        LEU  84   7.388  -5.576  -9.338
  653    HA   LEU  84           HA       LEU  84   7.202  -7.964 -10.928
  654    HB2  LEU  84           2HB      LEU  84   5.604  -6.503 -12.398
  655    HB3  LEU  84           1HB      LEU  84   5.116  -6.986 -10.789
  656    HG   LEU  84           HG       LEU  84   5.764  -4.664  -9.975
  657   HD11  LEU  84          1HD1      LEU  84   5.908  -2.814 -11.564
  658   HD12  LEU  84          2HD1      LEU  84   5.913  -3.954 -12.912
  659   HD13  LEU  84          3HD1      LEU  84   7.249  -3.942 -11.761
  660   HD21  LEU  84          3HD2      LEU  84   3.439  -5.329 -10.341
  661   HD22  LEU  84          1HD2      LEU  84   3.536  -4.816 -12.030
  662   HD23  LEU  84          2HD2      LEU  84   3.678  -3.628 -10.729
  663    H    GLU  85           H        GLU  85   8.813  -4.906 -11.289
  664    HA   GLU  85           HA       GLU  85  10.267  -4.033 -12.763
  665    HB2  GLU  85           2HB      GLU  85  10.996  -6.970 -12.855
  666    HB3  GLU  85           1HB      GLU  85  11.930  -5.781 -13.763
  667    HG2  GLU  85           2HG      GLU  85  11.488  -5.766 -10.751
  668    HG3  GLU  85           1HG      GLU  85  12.956  -6.301 -11.576
  669    H    HIS  86           H        HIS  86   7.787  -4.150 -13.819
  670    HA   HIS  86           HA       HIS  86   7.876  -5.007 -16.580
  671    HB2  HIS  86           2HB      HIS  86   5.732  -4.980 -15.290
  672    HB3  HIS  86           1HB      HIS  86   5.838  -3.228 -15.161
  673    HD1  HIS  86           HD1      HIS  86   4.584  -1.995 -16.938
  674    HD2  HIS  86           HD2      HIS  86   5.629  -5.823 -18.166
  675    HE1  HIS  86           HE1      HIS  86   3.559  -2.278 -19.210
  676    HE2  HIS  86           HE2      HIS  86   4.269  -4.572 -19.959
  677    H    HIS  87           H        HIS  87   9.908  -3.866 -16.885
  678    HA   HIS  87           HA       HIS  87   9.608  -1.642 -18.559
  679    HB2  HIS  87           2HB      HIS  87  11.075   0.027 -17.410
  680    HB3  HIS  87           1HB      HIS  87   9.577  -0.225 -16.544
  681    HD1  HIS  87           HD1      HIS  87  12.992   0.286 -15.872
  682    HD2  HIS  87           HD2      HIS  87  10.125  -2.268 -14.298
  683    HE1  HIS  87           HE1      HIS  87  13.848  -0.379 -13.617
  684    HE2  HIS  87           HE2      HIS  87  12.023  -1.783 -12.624
  685    H    HIS  88           H        HIS  88  10.926  -2.266 -20.137
  686    HA   HIS  88           HA       HIS  88  12.973  -4.231 -19.809
  687    HB2  HIS  88           2HB      HIS  88  13.399  -3.873 -22.273
  688    HB3  HIS  88           1HB      HIS  88  11.730  -4.240 -21.876
  689    HD1  HIS  88           HD1      HIS  88   9.967  -2.559 -22.560
  690    HD2  HIS  88           HD2      HIS  88  13.829  -1.126 -23.069
  691    HE1  HIS  88           HE1      HIS  88   9.730  -0.412 -23.821
  692    HE2  HIS  88           HE2      HIS  88  12.083   0.317 -24.299
  693    H    HIS  89           H        HIS  89  13.057  -0.696 -20.192
  694    HA   HIS  89           HA       HIS  89  15.923  -0.447 -20.002
  695    HB2  HIS  89           2HB      HIS  89  13.613   1.480 -19.570
  696    HB3  HIS  89           1HB      HIS  89  15.223   1.937 -19.039
  697    HD1  HIS  89           HD1      HIS  89  16.954   2.544 -20.826
  698    HD2  HIS  89           HD2      HIS  89  13.268   1.445 -22.405
  699    HE1  HIS  89           HE1      HIS  89  17.006   3.271 -23.227
  700    HE2  HIS  89           HE2      HIS  89  14.866   2.386 -24.202
  701    H    HIS  90           H        HIS  90  17.136   0.110 -18.118
  702    HA   HIS  90           HA       HIS  90  16.124  -1.015 -15.622
  703    HB2  HIS  90           2HB      HIS  90  18.873   0.187 -16.164
  704    HB3  HIS  90           1HB      HIS  90  18.417  -0.862 -14.821
  705    HD1  HIS  90           HD1      HIS  90  17.244  -3.280 -15.988
  706    HD2  HIS  90           HD2      HIS  90  20.326  -1.278 -17.937
  707    HE1  HIS  90           HE1      HIS  90  18.242  -4.944 -17.579
  708    HE2  HIS  90           HE2      HIS  90  19.989  -3.664 -18.847
  709    H    HIS  91           H        HIS  91  15.709   0.165 -13.768
  710    HA   HIS  91           HA       HIS  91  15.160   1.840 -12.390
  711    HB2  HIS  91           2HB      HIS  91  17.043   3.577 -14.053
  712    HB3  HIS  91           1HB      HIS  91  16.297   4.081 -12.543
  713    HD1  HIS  91           HD1      HIS  91  18.685   4.407 -11.547
  714    HD2  HIS  91           HD2      HIS  91  17.781   0.488 -12.577
  715    HE1  HIS  91           HE1      HIS  91  20.447   2.991 -10.458
  716    HE2  HIS  91           HE2      HIS  91  19.944   0.641 -11.192
  Start of MODEL    5
    1    H1   MET   1           1H       MET   1  12.628   2.774  -6.242
    2    H2   MET   1           2H       MET   1  13.117   3.183  -4.681
    3    H3   MET   1           3H       MET   1  12.537   4.380  -5.717
    4    HA   MET   1           HA       MET   1  10.885   3.833  -4.105
    5    HB2  MET   1           2HB      MET   1  10.192   2.812  -6.891
    6    HB3  MET   1           1HB      MET   1   9.014   3.269  -5.665
    7    HG2  MET   1           2HG      MET   1   9.912   5.582  -5.699
    8    HG3  MET   1           1HG      MET   1  11.022   5.108  -6.991
    9    HE1  MET   1           3HE      MET   1  10.145   6.985  -8.687
   10    HE2  MET   1           1HE      MET   1   9.134   7.591  -7.371
   11    HE3  MET   1           2HE      MET   1   8.430   7.300  -8.963
   12    H    LYS   2           H        LYS   2  12.838   1.651  -3.873
   13    HA   LYS   2           HA       LYS   2  11.130  -0.723  -3.590
   14    HB2  LYS   2           2HB      LYS   2  14.087  -0.463  -2.878
   15    HB3  LYS   2           1HB      LYS   2  13.161  -1.950  -3.034
   16    HG2  LYS   2           2HG      LYS   2  14.037  -0.078  -5.251
   17    HG3  LYS   2           1HG      LYS   2  14.566  -1.736  -4.973
   18    HD2  LYS   2           2HD      LYS   2  11.753  -0.895  -5.797
   19    HD3  LYS   2           1HD      LYS   2  12.982  -1.542  -6.882
   20    HE2  LYS   2           2HE      LYS   2  11.819  -3.043  -4.514
   21    HE3  LYS   2           1HE      LYS   2  11.282  -3.226  -6.180
   22    HZ1  LYS   2           3HZ      LYS   2  14.002  -3.831  -5.162
   23    HZ2  LYS   2           1HZ      LYS   2  13.502  -3.991  -6.765
   24    HZ3  LYS   2           2HZ      LYS   2  12.821  -4.966  -5.568
   25    H    ILE   3           H        ILE   3  11.052  -1.853  -1.512
   26    HA   ILE   3           HA       ILE   3  10.403  -0.044   0.640
   27    HB   ILE   3           HB       ILE   3  10.442  -3.097   0.784
   28   HG12  ILE   3          2HG1      ILE   3   8.077  -1.325  -0.014
   29   HG13  ILE   3          1HG1      ILE   3   9.001  -2.334  -1.121
   30   HG21  ILE   3          1HG2      ILE   3  10.324  -1.969   2.977
   31   HG22  ILE   3          2HG2      ILE   3   8.811  -2.802   2.628
   32   HG23  ILE   3          3HG2      ILE   3   8.913  -1.047   2.451
   33   HD11  ILE   3          3HD1      ILE   3   8.244  -4.340   0.054
   34   HD12  ILE   3          1HD1      ILE   3   6.887  -3.369  -0.516
   35   HD13  ILE   3          2HD1      ILE   3   7.333  -3.339   1.189
   36    H    ILE   4           H        ILE   4  11.691   0.529   2.276
   37    HA   ILE   4           HA       ILE   4  14.310  -0.669   2.721
   38    HB   ILE   4           HB       ILE   4  12.922   1.694   4.083
   39   HG12  ILE   4          2HG1      ILE   4  13.464   2.166   1.731
   40   HG13  ILE   4          1HG1      ILE   4  14.511   3.106   2.785
   41   HG21  ILE   4          1HG2      ILE   4  15.797   0.747   4.433
   42   HG22  ILE   4          2HG2      ILE   4  14.521   0.713   5.652
   43   HG23  ILE   4          3HG2      ILE   4  15.133   2.259   5.067
   44   HD11  ILE   4          3HD1      ILE   4  15.742   2.251   0.888
   45   HD12  ILE   4          1HD1      ILE   4  15.277   0.597   1.286
   46   HD13  ILE   4          2HD1      ILE   4  16.336   1.503   2.369
   47    H    SER   5           H        SER   5  11.261  -0.168   4.536
   48    HA   SER   5           HA       SER   5  11.831  -2.514   6.203
   49    HB2  SER   5           2HB      SER   5  11.152  -1.212   8.275
   50    HB3  SER   5           1HB      SER   5  12.687  -0.696   7.577
   51    HG   SER   5           HG       SER   5  10.259   0.645   7.735
   52    H    ILE   6           H        ILE   6  10.066  -3.761   6.416
   53    HA   ILE   6           HA       ILE   6   7.500  -2.850   5.326
   54    HB   ILE   6           HB       ILE   6   8.251  -5.677   6.249
   55   HG12  ILE   6          2HG1      ILE   6   8.205  -6.129   3.660
   56   HG13  ILE   6          1HG1      ILE   6   8.436  -4.395   3.491
   57   HG21  ILE   6          1HG2      ILE   6   5.888  -4.716   4.591
   58   HG22  ILE   6          2HG2      ILE   6   5.824  -5.281   6.262
   59   HG23  ILE   6          3HG2      ILE   6   6.260  -6.402   4.971
   60   HD11  ILE   6          3HD1      ILE   6  10.511  -5.621   3.279
   61   HD12  ILE   6          1HD1      ILE   6  10.299  -6.309   4.889
   62   HD13  ILE   6          2HD1      ILE   6  10.554  -4.572   4.695
   63    H    SER   7           H        SER   7   7.009  -1.448   7.047
   64    HA   SER   7           HA       SER   7   5.748  -0.773   8.752
   65    HB2  SER   7           2HB      SER   7   3.920  -2.224   9.564
   66    HB3  SER   7           1HB      SER   7   4.068  -2.301   7.813
   67    HG   SER   7           HG       SER   7   5.465  -4.236   9.223
   68    H    GLU   8           H        GLU   8   5.106  -1.160  11.145
   69    HA   GLU   8           HA       GLU   8   7.184  -2.605  12.673
   70    HB2  GLU   8           2HB      GLU   8   5.394  -0.309  13.604
   71    HB3  GLU   8           1HB      GLU   8   6.718  -1.037  14.488
   72    HG2  GLU   8           2HG      GLU   8   8.325  -0.151  12.871
   73    HG3  GLU   8           1HG      GLU   8   7.008   0.537  11.922
   74    H    THR   9           H        THR   9   5.707  -2.718  15.129
   75    HA   THR   9           HA       THR   9   3.930  -4.920  14.456
   76    HB   THR   9           HB       THR   9   3.958  -5.328  16.956
   77    HG1  THR   9           HG1      THR   9   4.963  -3.963  18.227
   78   HG21  THR   9          3HG2      THR   9   6.245  -6.234  17.014
   79   HG22  THR   9          1HG2      THR   9   6.692  -5.244  15.621
   80   HG23  THR   9          2HG2      THR   9   5.513  -6.546  15.440
   81    HA   PRO  10           HA       PRO  10   0.965  -2.504  17.365
   82    HB2  PRO  10           2HB      PRO  10   1.154   0.151  17.869
   83    HB3  PRO  10           1HB      PRO  10   2.203  -1.018  18.701
   84    HG2  PRO  10           2HG      PRO  10   2.828   0.709  16.326
   85    HG3  PRO  10           1HG      PRO  10   3.801   0.410  17.785
   86    HD2  PRO  10           2HD      PRO  10   4.220  -0.921  15.418
   87    HD3  PRO  10           1HD      PRO  10   4.600  -1.622  17.005
   88    H    ASN  11           H        ASN  11   1.885  -1.351  14.346
   89    HA   ASN  11           HA       ASN  11  -0.629   0.048  13.712
   90    HB2  ASN  11           2HB      ASN  11   0.616   0.809  11.697
   91    HB3  ASN  11           1HB      ASN  11   1.403   1.281  13.187
   92   HD21  ASN  11          1HD2      ASN  11   1.641  -0.717  10.326
   93   HD22  ASN  11          2HD2      ASN  11   3.290  -1.172  10.556
   94    H    HIS  12           H        HIS  12  -1.115  -2.507  14.098
   95    HA   HIS  12           HA       HIS  12  -0.745  -4.332  11.967
   96    HB2  HIS  12           2HB      HIS  12  -1.308  -5.026  14.269
   97    HB3  HIS  12           1HB      HIS  12  -2.886  -4.261  14.139
   98    HD1  HIS  12           HD1      HIS  12  -4.663  -5.962  13.797
   99    HD2  HIS  12           HD2      HIS  12  -1.076  -7.108  12.031
  100    HE1  HIS  12           HE1      HIS  12  -5.110  -8.210  12.755
  101    HE2  HIS  12           HE2      HIS  12  -2.867  -8.958  11.884
  102    H    ASN  13           H        ASN  13  -3.098  -1.786  12.475
  103    HA   ASN  13           HA       ASN  13  -4.740  -2.701  10.197
  104    HB2  ASN  13           2HB      ASN  13  -5.391  -0.631  12.331
  105    HB3  ASN  13           1HB      ASN  13  -6.467  -1.116  11.026
  106   HD21  ASN  13          1HD2      ASN  13  -6.850  -1.298  13.929
  107   HD22  ASN  13          2HD2      ASN  13  -7.183  -2.960  14.259
  108    H    THR  14           H        THR  14  -2.078  -0.942  10.442
  109    HA   THR  14           HA       THR  14  -2.548   0.440   7.962
  110    HB   THR  14           HB       THR  14  -3.425   2.220   9.290
  111    HG1  THR  14           HG1      THR  14  -2.219   3.356   7.975
  112   HG21  THR  14          3HG2      THR  14  -1.018   2.057  11.133
  113   HG22  THR  14          1HG2      THR  14  -2.662   1.544  11.530
  114   HG23  THR  14          2HG2      THR  14  -2.316   3.248  11.226
  115    H    MET  15           H        MET  15  -0.846  -0.646   6.999
  116    HA   MET  15           HA       MET  15   1.598  -1.158   8.502
  117    HB2  MET  15           2HB      MET  15   0.617  -2.060   5.775
  118    HB3  MET  15           1HB      MET  15   2.271  -2.350   6.294
  119    HG2  MET  15           2HG      MET  15   1.383  -3.576   8.279
  120    HG3  MET  15           1HG      MET  15  -0.241  -3.380   7.618
  121    HE1  MET  15           3HE      MET  15   3.076  -5.746   5.409
  122    HE2  MET  15           1HE      MET  15   3.350  -4.939   6.951
  123    HE3  MET  15           2HE      MET  15   3.046  -3.985   5.499
  124    H    LYS  16           H        LYS  16   3.368  -0.033   8.441
  125    HA   LYS  16           HA       LYS  16   3.717   2.335   6.837
  126    HB2  LYS  16           2HB      LYS  16   4.331   2.256   9.242
  127    HB3  LYS  16           1HB      LYS  16   5.521   1.002   8.915
  128    HG2  LYS  16           2HG      LYS  16   6.760   2.654   7.470
  129    HG3  LYS  16           1HG      LYS  16   5.618   3.895   7.992
  130    HD2  LYS  16           2HD      LYS  16   7.546   2.336   9.767
  131    HD3  LYS  16           1HD      LYS  16   7.685   4.035   9.309
  132    HE2  LYS  16           2HE      LYS  16   5.479   2.831  11.016
  133    HE3  LYS  16           1HE      LYS  16   6.834   3.787  11.609
  134    HZ1  LYS  16           3HZ      LYS  16   6.013   5.683  10.396
  135    HZ2  LYS  16           1HZ      LYS  16   4.793   5.083  11.395
  136    HZ3  LYS  16           2HZ      LYS  16   4.755   4.778   9.735
  137    H    ILE  17           H        ILE  17   3.962   1.489   4.675
  138    HA   ILE  17           HA       ILE  17   6.274  -0.173   4.031
  139    HB   ILE  17           HB       ILE  17   4.292   1.244   2.181
  140   HG12  ILE  17          2HG1      ILE  17   4.372  -1.692   3.033
  141   HG13  ILE  17          1HG1      ILE  17   3.263  -0.494   3.685
  142   HG21  ILE  17          1HG2      ILE  17   6.338  -0.917   1.510
  143   HG22  ILE  17          2HG2      ILE  17   6.428   0.778   1.031
  144   HG23  ILE  17          3HG2      ILE  17   5.142  -0.245   0.396
  145   HD11  ILE  17          3HD1      ILE  17   2.161  -1.870   2.048
  146   HD12  ILE  17          1HD1      ILE  17   3.374  -1.466   0.835
  147   HD13  ILE  17          2HD1      ILE  17   2.285  -0.219   1.443
  148    H    THR  18           H        THR  18   8.067   0.958   4.567
  149    HA   THR  18           HA       THR  18   8.433   3.764   4.001
  150    HB   THR  18           HB       THR  18  10.465   1.677   4.924
  151    HG1  THR  18           HG1      THR  18   9.962   2.724   7.010
  152   HG21  THR  18          3HG2      THR  18  11.735   3.625   5.775
  153   HG22  THR  18          1HG2      THR  18  10.545   4.721   5.066
  154   HG23  THR  18          2HG2      THR  18  11.551   3.710   4.024
  155    H    LEU  19           H        LEU  19   9.109   4.602   2.104
  156    HA   LEU  19           HA       LEU  19  10.176   2.891  -0.013
  157    HB2  LEU  19           2HB      LEU  19   9.465   5.849   0.010
  158    HB3  LEU  19           1HB      LEU  19  10.034   4.977  -1.408
  159    HG   LEU  19           HG       LEU  19   7.419   4.498   0.073
  160   HD11  LEU  19          1HD1      LEU  19   7.896   5.593  -2.717
  161   HD12  LEU  19          2HD1      LEU  19   7.389   6.527  -1.306
  162   HD13  LEU  19          3HD1      LEU  19   6.326   5.285  -1.963
  163   HD21  LEU  19          3HD2      LEU  19   6.864   2.857  -1.679
  164   HD22  LEU  19          1HD2      LEU  19   8.270   2.352  -0.744
  165   HD23  LEU  19          2HD2      LEU  19   8.484   3.023  -2.363
  166    H    SER  20           H        SER  20  12.036   3.691  -1.301
  167    HA   SER  20           HA       SER  20  14.332   4.066   0.382
  168    HB2  SER  20           2HB      SER  20  15.522   3.958  -1.921
  169    HB3  SER  20           1HB      SER  20  14.633   2.531  -1.399
  170    HG   SER  20           HG       SER  20  13.480   4.521  -3.051
  171    H    GLU  21           H        GLU  21  12.270   6.186  -1.400
  172    HA   GLU  21           HA       GLU  21  14.231   8.374  -1.447
  173    HB2  GLU  21           2HB      GLU  21  11.415   8.247  -2.618
  174    HB3  GLU  21           1HB      GLU  21  12.457   9.662  -2.694
  175    HG2  GLU  21           2HG      GLU  21  12.501   8.548  -4.821
  176    HG3  GLU  21           1HG      GLU  21  14.080   8.360  -4.055
  177    H    SER  22           H        SER  22  14.403   9.126   0.603
  178    HA   SER  22           HA       SER  22  12.143   9.715   2.296
  179    HB2  SER  22           2HB      SER  22  14.351   9.038   3.231
  180    HB3  SER  22           1HB      SER  22  15.069  10.516   2.597
  181    HG   SER  22           HG       SER  22  12.895  10.452   4.432
  182    H    ARG  23           H        ARG  23  10.820  11.298   1.627
  183    HA   ARG  23           HA       ARG  23   9.957  13.199   0.786
  184    HB2  ARG  23           2HB      ARG  23  10.666  15.275   1.936
  185    HB3  ARG  23           1HB      ARG  23  10.440  13.924   3.036
  186    HG2  ARG  23           2HG      ARG  23  12.892  13.630   3.162
  187    HG3  ARG  23           1HG      ARG  23  13.105  14.996   2.068
  188    HD2  ARG  23           2HD      ARG  23  11.970  16.465   3.758
  189    HD3  ARG  23           1HD      ARG  23  11.903  15.077   4.858
  190    HE   ARG  23           HE       ARG  23  14.540  15.753   3.824
  191   HH11  ARG  23          1HH1      ARG  23  12.304  16.226   6.502
  192   HH12  ARG  23          2HH1      ARG  23  13.556  16.692   7.605
  193   HH21  ARG  23          1HH2      ARG  23  16.158  16.306   5.320
  194   HH22  ARG  23          2HH2      ARG  23  15.719  16.736   6.946
  195    H    GLU  24           H        GLU  24  11.320  15.822   0.246
  196    HA   GLU  24           HA       GLU  24  12.090  16.978  -1.529
  197    HB2  GLU  24           2HB      GLU  24  14.219  14.898  -1.081
  198    HB3  GLU  24           1HB      GLU  24  14.343  15.877  -2.536
  199    HG2  GLU  24           2HG      GLU  24  15.698  16.850  -0.779
  200    HG3  GLU  24           1HG      GLU  24  14.369  17.931  -1.176
  201    H    GLY  25           H        GLY  25   9.959  15.460  -2.180
  202    HA2  GLY  25           2HA      GLY  25   9.434  15.538  -4.758
  203    HA3  GLY  25           1HA      GLY  25  10.449  14.099  -4.747
  204    H    MET  26           H        MET  26   9.529  13.258  -2.103
  205    HA   MET  26           HA       MET  26   7.053  11.908  -2.908
  206    HB2  MET  26           2HB      MET  26   8.990  11.474  -0.600
  207    HB3  MET  26           1HB      MET  26   7.509  10.548  -0.805
  208    HG2  MET  26           2HG      MET  26   9.762  10.638  -2.821
  209    HG3  MET  26           1HG      MET  26   9.524   9.367  -1.617
  210    HE1  MET  26           3HE      MET  26   9.773   8.666  -4.721
  211    HE2  MET  26           1HE      MET  26   8.442   7.532  -4.923
  212    HE3  MET  26           2HE      MET  26   9.462   7.444  -3.485
  213    H    THR  27           H        THR  27   5.306  13.156  -2.580
  214    HA   THR  27           HA       THR  27   5.024  15.071  -0.415
  215    HB   THR  27           HB       THR  27   2.956  14.189  -2.490
  216    HG1  THR  27           HG1      THR  27   4.676  14.927  -3.654
  217   HG21  THR  27          3HG2      THR  27   3.160  16.839  -1.004
  218   HG22  THR  27          1HG2      THR  27   1.967  15.573  -0.680
  219   HG23  THR  27          2HG2      THR  27   1.963  16.418  -2.228
  220    H    SER  28           H        SER  28   3.032  15.071   0.991
  221    HA   SER  28           HA       SER  28   2.303  12.489   2.099
  222    HB2  SER  28           2HB      SER  28   0.932  13.867   3.693
  223    HB3  SER  28           1HB      SER  28   2.623  14.364   3.646
  224    HG   SER  28           HG       SER  28   0.345  15.657   2.614
  225    H    ASP  29           H        ASP  29   1.471  11.741   0.032
  226    HA   ASP  29           HA       ASP  29  -1.090  12.711  -0.964
  227    HB2  ASP  29           2HB      ASP  29   0.471  10.226  -1.808
  228    HB3  ASP  29           1HB      ASP  29  -0.806  11.032  -2.712
  229    H    THR  30           H        THR  30  -3.004  11.439  -0.978
  230    HA   THR  30           HA       THR  30  -3.055   8.966   0.637
  231    HB   THR  30           HB       THR  30  -4.101  10.609   2.060
  232    HG1  THR  30           HG1      THR  30  -5.156   8.579   1.908
  233   HG21  THR  30          3HG2      THR  30  -6.066  11.954   1.435
  234   HG22  THR  30          1HG2      THR  30  -5.954  11.373  -0.228
  235   HG23  THR  30          2HG2      THR  30  -4.667  12.379   0.445
  236    H    TYR  31           H        TYR  31  -3.118   7.518  -0.971
  237    HA   TYR  31           HA       TYR  31  -4.777   7.877  -3.362
  238    HB2  TYR  31           2HB      TYR  31  -3.081   5.468  -2.553
  239    HB3  TYR  31           1HB      TYR  31  -3.677   5.851  -4.165
  240    HD1  TYR  31           HD1      TYR  31  -2.839   8.335  -5.020
  241    HD2  TYR  31           HD2      TYR  31  -0.807   5.878  -2.176
  242    HE1  TYR  31           HE1      TYR  31  -0.722   9.475  -5.536
  243    HE2  TYR  31           HE2      TYR  31   1.302   7.014  -2.695
  244    HH   TYR  31           HH       TYR  31   1.455   9.910  -4.434
  245    H    THR  32           H        THR  32  -6.894   7.170  -3.352
  246    HA   THR  32           HA       THR  32  -7.713   5.143  -1.336
  247    HB   THR  32           HB       THR  32  -9.942   6.268  -1.285
  248    HG1  THR  32           HG1      THR  32  -8.687   8.350  -2.782
  249   HG21  THR  32          3HG2      THR  32  -9.266   8.270  -0.001
  250   HG22  THR  32          1HG2      THR  32  -7.622   8.119  -0.627
  251   HG23  THR  32          2HG2      THR  32  -8.284   6.870   0.431
  252    H    LYS  33           H        LYS  33  -8.735   6.497  -4.553
  253    HA   LYS  33           HA       LYS  33 -10.370   4.015  -4.906
  254    HB2  LYS  33           2HB      LYS  33 -12.232   5.419  -5.654
  255    HB3  LYS  33           1HB      LYS  33 -11.722   5.913  -4.044
  256    HG2  LYS  33           2HG      LYS  33 -10.367   7.767  -5.157
  257    HG3  LYS  33           1HG      LYS  33 -11.161   7.325  -6.668
  258    HD2  LYS  33           2HD      LYS  33 -12.491   9.098  -5.937
  259    HD3  LYS  33           1HD      LYS  33 -13.395   7.716  -5.320
  260    HE2  LYS  33           2HE      LYS  33 -11.481   9.462  -3.728
  261    HE3  LYS  33           1HE      LYS  33 -13.239   9.511  -3.645
  262    HZ1  LYS  33           3HZ      LYS  33 -13.170   7.197  -2.827
  263    HZ2  LYS  33           1HZ      LYS  33 -12.387   8.285  -1.805
  264    HZ3  LYS  33           2HZ      LYS  33 -11.484   7.275  -2.803
  265    H    VAL  34           H        VAL  34  -7.812   4.663  -6.164
  266    HA   VAL  34           HA       VAL  34  -6.671   4.987  -8.081
  267    HB   VAL  34           HB       VAL  34  -9.273   4.119  -9.437
  268   HG11  VAL  34          1HG1      VAL  34  -7.874   5.329 -11.055
  269   HG12  VAL  34          2HG1      VAL  34  -7.887   3.607 -11.441
  270   HG13  VAL  34          3HG1      VAL  34  -6.482   4.323 -10.643
  271   HG21  VAL  34          3HG2      VAL  34  -8.186   1.891  -9.629
  272   HG22  VAL  34          1HG2      VAL  34  -8.395   2.384  -7.948
  273   HG23  VAL  34          2HG2      VAL  34  -6.805   2.494  -8.709
  274    H    ASP  35           H        ASP  35  -6.385   7.076  -7.728
  275    HA   ASP  35           HA       ASP  35  -8.497   9.009  -7.815
  276    HB2  ASP  35           2HB      ASP  35  -5.584   9.328  -6.981
  277    HB3  ASP  35           1HB      ASP  35  -6.917  10.420  -6.598
  278    H    ASP  36           H        ASP  36  -5.091   9.480  -8.935
  279    HA   ASP  36           HA       ASP  36  -5.783  10.044 -11.644
  280    HB2  ASP  36           2HB      ASP  36  -6.790  12.074 -10.537
  281    HB3  ASP  36           1HB      ASP  36  -5.195  12.518  -9.942
  282    H    SER  37           H        SER  37  -3.451  11.668  -9.443
  283    HA   SER  37           HA       SER  37  -1.296  11.211 -11.367
  284    HB2  SER  37           2HB      SER  37  -1.362  12.959  -8.867
  285    HB3  SER  37           1HB      SER  37  -0.090  12.950 -10.091
  286    HG   SER  37           HG       SER  37  -2.735  13.402 -10.892
  287    H    GLN  38           H        GLN  38  -1.509   8.889 -10.688
  288    HA   GLN  38           HA       GLN  38   0.692   8.213  -8.927
  289    HB2  GLN  38           2HB      GLN  38  -0.665   6.470  -7.761
  290    HB3  GLN  38           1HB      GLN  38  -1.261   8.095  -7.433
  291    HG2  GLN  38           2HG      GLN  38  -3.079   7.769  -9.056
  292    HG3  GLN  38           1HG      GLN  38  -2.483   6.150  -9.422
  293   HE21  GLN  38          1HE2      GLN  38  -1.839   5.563  -6.649
  294   HE22  GLN  38          2HE2      GLN  38  -3.333   5.317  -5.834
  295    HA   PRO  39           HA       PRO  39   1.251   5.015 -12.116
  296    HB2  PRO  39           2HB      PRO  39   2.389   3.278  -9.953
  297    HB3  PRO  39           1HB      PRO  39   3.157   3.887 -11.434
  298    HG2  PRO  39           2HG      PRO  39   3.832   4.838  -9.027
  299    HG3  PRO  39           1HG      PRO  39   3.789   5.888 -10.464
  300    HD2  PRO  39           2HD      PRO  39   1.738   5.626  -8.266
  301    HD3  PRO  39           1HD      PRO  39   2.361   7.085  -9.062
  302    H    ALA  40           H        ALA  40   0.192   3.178 -12.811
  303    HA   ALA  40           HA       ALA  40  -2.132   2.139 -11.629
  304    HB1  ALA  40           3HB      ALA  40  -1.631   1.943 -14.033
  305    HB2  ALA  40           1HB      ALA  40  -1.999   0.364 -13.334
  306    HB3  ALA  40           2HB      ALA  40  -0.325   0.811 -13.676
  307    H    PHE  41           H        PHE  41   1.190   1.328 -11.201
  308    HA   PHE  41           HA       PHE  41   1.355  -1.079  -9.918
  309    HB2  PHE  41           2HB      PHE  41   2.692   1.586  -9.285
  310    HB3  PHE  41           1HB      PHE  41   3.178   0.089  -8.520
  311    HD1  PHE  41           HD2      PHE  41   2.736   1.569 -11.959
  312    HD2  PHE  41           HD1      PHE  41   4.933  -1.144  -9.489
  313    HE1  PHE  41           HE2      PHE  41   4.307   1.163 -13.799
  314    HE2  PHE  41           HE1      PHE  41   6.505  -1.536 -11.333
  315    HZ   PHE  41           HZ       PHE  41   6.199  -0.386 -13.490
  316    H    ILE  42           H        ILE  42   0.491   2.047  -8.440
  317    HA   ILE  42           HA       ILE  42  -0.048   0.999  -5.817
  318    HB   ILE  42           HB       ILE  42  -0.762   3.713  -7.032
  319   HG12  ILE  42          2HG1      ILE  42   1.685   3.331  -7.069
  320   HG13  ILE  42          1HG1      ILE  42   1.278   4.575  -5.893
  321   HG21  ILE  42          1HG2      ILE  42  -0.948   4.534  -4.701
  322   HG22  ILE  42          2HG2      ILE  42  -0.690   2.894  -4.099
  323   HG23  ILE  42          3HG2      ILE  42  -2.131   3.273  -5.046
  324   HD11  ILE  42          3HD1      ILE  42   1.529   2.930  -4.086
  325   HD12  ILE  42          1HD1      ILE  42   3.002   3.101  -5.043
  326   HD13  ILE  42          2HD1      ILE  42   1.957   1.701  -5.278
  327    H    ASN  43           H        ASN  43  -1.928   1.480  -8.736
  328    HA   ASN  43           HA       ASN  43  -4.522   1.690  -7.568
  329    HB2  ASN  43           2HB      ASN  43  -3.630   1.014 -10.392
  330    HB3  ASN  43           1HB      ASN  43  -5.312   1.213  -9.928
  331   HD21  ASN  43          1HD2      ASN  43  -4.776   3.435  -8.070
  332   HD22  ASN  43          2HD2      ASN  43  -4.460   4.794  -9.070
  333    H    ASP  44           H        ASP  44  -2.562  -1.050  -8.651
  334    HA   ASP  44           HA       ASP  44  -4.526  -3.072  -8.624
  335    HB2  ASP  44           2HB      ASP  44  -2.282  -3.488  -9.539
  336    HB3  ASP  44           1HB      ASP  44  -1.555  -3.257  -7.953
  337    H    ILE  45           H        ILE  45  -2.443  -1.822  -6.042
  338    HA   ILE  45           HA       ILE  45  -3.302  -3.573  -3.977
  339    HB   ILE  45           HB       ILE  45  -2.144  -0.775  -3.597
  340   HG12  ILE  45          2HG1      ILE  45  -0.568  -3.374  -3.901
  341   HG13  ILE  45          1HG1      ILE  45  -0.732  -2.158  -5.163
  342   HG21  ILE  45          1HG2      ILE  45  -2.051  -3.221  -1.775
  343   HG22  ILE  45          2HG2      ILE  45  -3.032  -1.773  -1.525
  344   HG23  ILE  45          3HG2      ILE  45  -1.274  -1.668  -1.456
  345   HD11  ILE  45          3HD1      ILE  45   0.443  -0.533  -3.737
  346   HD12  ILE  45          1HD1      ILE  45   1.408  -1.975  -4.053
  347   HD13  ILE  45          2HD1      ILE  45   0.620  -1.773  -2.490
  348    H    LEU  46           H        LEU  46  -4.373  -0.358  -5.038
  349    HA   LEU  46           HA       LEU  46  -6.167   0.278  -2.960
  350    HB2  LEU  46           2HB      LEU  46  -6.155   1.095  -5.890
  351    HB3  LEU  46           1HB      LEU  46  -7.291   1.763  -4.725
  352    HG   LEU  46           HG       LEU  46  -4.263   2.054  -4.613
  353   HD11  LEU  46          1HD1      LEU  46  -6.384   4.135  -5.235
  354   HD12  LEU  46          2HD1      LEU  46  -5.245   3.430  -6.387
  355   HD13  LEU  46          3HD1      LEU  46  -4.651   4.428  -5.063
  356   HD21  LEU  46          3HD2      LEU  46  -4.664   3.582  -2.721
  357   HD22  LEU  46          1HD2      LEU  46  -5.185   1.938  -2.362
  358   HD23  LEU  46          2HD2      LEU  46  -6.382   3.175  -2.754
  359    H    LYS  47           H        LYS  47  -6.604  -1.614  -5.896
  360    HA   LYS  47           HA       LYS  47  -9.485  -1.895  -5.515
  361    HB2  LYS  47           2HB      LYS  47  -7.639  -3.063  -7.635
  362    HB3  LYS  47           1HB      LYS  47  -9.396  -3.217  -7.622
  363    HG2  LYS  47           2HG      LYS  47  -9.517  -0.673  -7.721
  364    HG3  LYS  47           1HG      LYS  47  -7.770  -0.685  -7.984
  365    HD2  LYS  47           2HD      LYS  47  -8.885  -0.512 -10.134
  366    HD3  LYS  47           1HD      LYS  47  -8.120  -2.100 -10.022
  367    HE2  LYS  47           2HE      LYS  47 -10.360  -3.042  -9.324
  368    HE3  LYS  47           1HE      LYS  47 -11.070  -1.461  -9.657
  369    HZ1  LYS  47           3HZ      LYS  47 -11.348  -2.961 -11.508
  370    HZ2  LYS  47           1HZ      LYS  47  -9.683  -3.198 -11.622
  371    HZ3  LYS  47           2HZ      LYS  47 -10.344  -1.683 -11.955
  372    H    VAL  48           H        VAL  48  -6.921  -3.406  -4.066
  373    HA   VAL  48           HA       VAL  48  -8.048  -6.075  -3.893
  374    HB   VAL  48           HB       VAL  48  -6.023  -4.755  -2.004
  375   HG11  VAL  48          1HG1      VAL  48  -7.131  -6.717  -0.999
  376   HG12  VAL  48          2HG1      VAL  48  -5.432  -7.052  -1.328
  377   HG13  VAL  48          3HG1      VAL  48  -6.683  -7.705  -2.393
  378   HG21  VAL  48          3HG2      VAL  48  -5.119  -4.782  -4.275
  379   HG22  VAL  48          1HG2      VAL  48  -5.485  -6.501  -4.440
  380   HG23  VAL  48          2HG2      VAL  48  -4.271  -5.960  -3.276
  381    H    GLU  49           H        GLU  49  -9.758  -6.602  -2.672
  382    HA   GLU  49           HA       GLU  49 -11.389  -4.827  -1.321
  383    HB2  GLU  49           2HB      GLU  49 -11.167  -7.851  -1.107
  384    HB3  GLU  49           1HB      GLU  49 -12.399  -6.952  -0.235
  385    HG2  GLU  49           2HG      GLU  49 -13.320  -7.928  -2.261
  386    HG3  GLU  49           1HG      GLU  49 -13.363  -6.172  -2.359
  387    H    GLY  50           H        GLY  50 -11.422  -3.952   0.686
  388    HA2  GLY  50           2HA      GLY  50 -11.186  -4.038   3.047
  389    HA3  GLY  50           1HA      GLY  50  -9.838  -5.146   2.877
  390    H    VAL  51           H        VAL  51  -8.534  -3.497   0.778
  391    HA   VAL  51           HA       VAL  51  -6.941  -1.800   2.438
  392    HB   VAL  51           HB       VAL  51  -7.076  -1.890  -0.622
  393   HG11  VAL  51          1HG1      VAL  51  -6.019   0.208   0.143
  394   HG12  VAL  51          2HG1      VAL  51  -4.820  -0.858  -0.589
  395   HG13  VAL  51          3HG1      VAL  51  -4.908  -0.704   1.168
  396   HG21  VAL  51          3HG2      VAL  51  -5.088  -3.349  -0.480
  397   HG22  VAL  51          1HG2      VAL  51  -6.471  -4.072   0.346
  398   HG23  VAL  51          2HG2      VAL  51  -5.178  -3.317   1.283
  399    H    LYS  52           H        LYS  52  -7.647   0.059   3.269
  400    HA   LYS  52           HA       LYS  52  -9.977   1.420   2.242
  401    HB2  LYS  52           2HB      LYS  52  -9.680   1.067   4.659
  402    HB3  LYS  52           1HB      LYS  52  -8.189   2.004   4.639
  403    HG2  LYS  52           2HG      LYS  52  -9.385   4.042   4.148
  404    HG3  LYS  52           1HG      LYS  52 -10.900   3.166   3.910
  405    HD2  LYS  52           2HD      LYS  52  -9.385   3.347   6.552
  406    HD3  LYS  52           1HD      LYS  52 -10.782   4.336   6.117
  407    HE2  LYS  52           2HE      LYS  52 -10.764   1.311   6.398
  408    HE3  LYS  52           1HE      LYS  52 -11.455   2.458   7.549
  409    HZ1  LYS  52           3HZ      LYS  52 -12.984   3.192   5.799
  410    HZ2  LYS  52           1HZ      LYS  52 -13.180   1.555   6.157
  411    HZ3  LYS  52           2HZ      LYS  52 -12.368   2.022   4.753
  412    H    SER  53           H        SER  53  -6.613   2.430   3.000
  413    HA   SER  53           HA       SER  53  -6.433   3.962   0.563
  414    HB2  SER  53           2HB      SER  53  -7.631   5.571   2.032
  415    HB3  SER  53           1HB      SER  53  -6.354   5.434   3.238
  416    HG   SER  53           HG       SER  53  -6.054   6.412   0.582
  417    H    ILE  54           H        ILE  54  -4.350   4.786   0.216
  418    HA   ILE  54           HA       ILE  54  -2.115   3.523   1.660
  419    HB   ILE  54           HB       ILE  54  -2.460   4.215  -1.308
  420   HG12  ILE  54          2HG1      ILE  54  -2.139   1.516   0.076
  421   HG13  ILE  54          1HG1      ILE  54  -3.618   2.137  -0.647
  422   HG21  ILE  54          1HG2      ILE  54  -0.138   4.669  -0.636
  423   HG22  ILE  54          2HG2      ILE  54  -0.230   3.291  -1.730
  424   HG23  ILE  54          3HG2      ILE  54   0.006   3.028  -0.000
  425   HD11  ILE  54          3HD1      ILE  54  -2.626   0.517  -2.092
  426   HD12  ILE  54          1HD1      ILE  54  -1.087   1.375  -2.092
  427   HD13  ILE  54          2HD1      ILE  54  -2.505   2.100  -2.855
  428    H    PHE  55           H        PHE  55  -1.944   5.287   3.093
  429    HA   PHE  55           HA       PHE  55  -1.818   8.023   2.103
  430    HB2  PHE  55           2HB      PHE  55  -2.979   7.479   4.250
  431    HB3  PHE  55           1HB      PHE  55  -1.447   6.961   4.941
  432    HD1  PHE  55           HD1      PHE  55  -2.917   9.961   3.208
  433    HD2  PHE  55           HD2      PHE  55  -0.305   8.538   6.273
  434    HE1  PHE  55           HE1      PHE  55  -2.484  12.271   3.912
  435    HE2  PHE  55           HE2      PHE  55   0.125  10.853   6.974
  436    HZ   PHE  55           HZ       PHE  55  -0.962  12.726   5.795
  437    H    HIS  56           H        HIS  56   0.003   8.117   0.881
  438    HA   HIS  56           HA       HIS  56   2.622   7.244   1.803
  439    HB2  HIS  56           2HB      HIS  56   2.158   6.982  -0.543
  440    HB3  HIS  56           1HB      HIS  56   1.537   8.620  -0.691
  441    HD1  HIS  56           HD1      HIS  56   3.051   9.848  -2.152
  442    HD2  HIS  56           HD2      HIS  56   5.161   7.395   0.455
  443    HE1  HIS  56           HE1      HIS  56   5.464  10.291  -2.633
  444    HE2  HIS  56           HE2      HIS  56   6.717   8.647  -1.188
  445    H    VAL  57           H        VAL  57   3.829   8.532   3.160
  446    HA   VAL  57           HA       VAL  57   3.613  11.465   2.957
  447    HB   VAL  57           HB       VAL  57   1.956  11.014   4.639
  448   HG11  VAL  57          1HG1      VAL  57   2.319   9.685   6.667
  449   HG12  VAL  57          2HG1      VAL  57   3.935   9.259   6.096
  450   HG13  VAL  57          3HG1      VAL  57   2.515   8.710   5.203
  451   HG21  VAL  57          3HG2      VAL  57   2.836  12.143   6.636
  452   HG22  VAL  57          1HG2      VAL  57   3.416  12.918   5.157
  453   HG23  VAL  57          2HG2      VAL  57   4.486  11.858   6.078
  454    H    MET  58           H        MET  58   5.500  12.390   3.003
  455    HA   MET  58           HA       MET  58   7.693  12.841   3.066
  456    HB2  MET  58           2HB      MET  58   7.395  12.700   5.532
  457    HB3  MET  58           1HB      MET  58   7.772  10.984   5.486
  458    HG2  MET  58           2HG      MET  58  10.049  11.500   4.723
  459    HG3  MET  58           1HG      MET  58   9.663  13.225   4.722
  460    HE1  MET  58           3HE      MET  58  11.861  13.642   6.309
  461    HE2  MET  58           1HE      MET  58  12.175  11.906   6.281
  462    HE3  MET  58           2HE      MET  58  12.117  12.765   7.819
  463    H    ASP  59           H        ASP  59   7.855   9.456   4.129
  464    HA   ASP  59           HA       ASP  59   8.618   8.486   1.476
  465    HB2  ASP  59           2HB      ASP  59  10.566   7.187   2.474
  466    HB3  ASP  59           1HB      ASP  59  10.803   8.921   2.351
  467    H    PHE  60           H        PHE  60   7.572   7.964   4.756
  468    HA   PHE  60           HA       PHE  60   7.240   5.097   4.462
  469    HB2  PHE  60           2HB      PHE  60   6.588   5.123   6.819
  470    HB3  PHE  60           1HB      PHE  60   8.079   6.016   6.601
  471    HD1  PHE  60           HD2      PHE  60   7.969   8.590   6.601
  472    HD2  PHE  60           HD1      PHE  60   4.712   6.145   7.881
  473    HE1  PHE  60           HE2      PHE  60   6.974  10.514   7.764
  474    HE2  PHE  60           HE1      PHE  60   3.720   8.066   9.042
  475    HZ   PHE  60           HZ       PHE  60   4.834  10.262   8.962
  476    H    ILE  61           H        ILE  61   5.342   4.145   3.941
  477    HA   ILE  61           HA       ILE  61   3.053   5.917   3.367
  478    HB   ILE  61           HB       ILE  61   3.508   3.084   2.322
  479   HG12  ILE  61          2HG1      ILE  61   4.052   5.737   0.890
  480   HG13  ILE  61          1HG1      ILE  61   5.280   4.598   1.433
  481   HG21  ILE  61          1HG2      ILE  61   1.156   3.819   2.397
  482   HG22  ILE  61          2HG2      ILE  61   1.720   3.654   0.737
  483   HG23  ILE  61          3HG2      ILE  61   1.564   5.257   1.456
  484   HD11  ILE  61          3HD1      ILE  61   4.424   2.925  -0.149
  485   HD12  ILE  61          1HD1      ILE  61   4.908   4.416  -0.958
  486   HD13  ILE  61          2HD1      ILE  61   3.200   4.075  -0.695
  487    H    SER  62           H        SER  62   1.632   5.926   4.969
  488    HA   SER  62           HA       SER  62   1.094   3.702   6.718
  489    HB2  SER  62           2HB      SER  62  -0.460   6.319   6.424
  490    HB3  SER  62           1HB      SER  62  -0.429   5.239   7.823
  491    HG   SER  62           HG       SER  62   1.115   7.306   7.381
  492    H    VAL  63           H        VAL  63   0.452   2.134   5.035
  493    HA   VAL  63           HA       VAL  63  -1.949   2.612   3.487
  494    HB   VAL  63           HB       VAL  63  -0.492  -0.044   3.918
  495   HG11  VAL  63          1HG1      VAL  63  -1.666  -0.776   1.856
  496   HG12  VAL  63          2HG1      VAL  63  -2.539   0.759   1.803
  497   HG13  VAL  63          3HG1      VAL  63  -2.807  -0.365   3.138
  498   HG21  VAL  63          3HG2      VAL  63  -0.197   1.968   1.653
  499   HG22  VAL  63          1HG2      VAL  63   0.545   0.366   1.708
  500   HG23  VAL  63          2HG2      VAL  63   1.013   1.595   2.883
  501    H    ASP  64           H        ASP  64  -3.569   3.045   4.887
  502    HA   ASP  64           HA       ASP  64  -4.204   1.334   7.149
  503    HB2  ASP  64           2HB      ASP  64  -6.100   2.950   7.495
  504    HB3  ASP  64           1HB      ASP  64  -4.514   3.706   7.454
  505    H    LYS  65           H        LYS  65  -6.206   0.260   7.409
  506    HA   LYS  65           HA       LYS  65  -7.571  -0.616   4.930
  507    HB2  LYS  65           2HB      LYS  65  -7.318  -2.979   5.606
  508    HB3  LYS  65           1HB      LYS  65  -5.731  -2.241   5.386
  509    HG2  LYS  65           2HG      LYS  65  -5.270  -2.215   7.697
  510    HG3  LYS  65           1HG      LYS  65  -6.974  -2.333   8.139
  511    HD2  LYS  65           2HD      LYS  65  -6.958  -4.688   7.201
  512    HD3  LYS  65           1HD      LYS  65  -5.203  -4.544   7.045
  513    HE2  LYS  65           2HE      LYS  65  -4.955  -4.270   9.437
  514    HE3  LYS  65           1HE      LYS  65  -6.702  -4.153   9.658
  515    HZ1  LYS  65           3HZ      LYS  65  -5.292  -6.559   8.659
  516    HZ2  LYS  65           1HZ      LYS  65  -6.937  -6.426   9.020
  517    HZ3  LYS  65           2HZ      LYS  65  -5.791  -6.320  10.255
  518    H    GLU  66           H        GLU  66  -9.381  -2.193   5.583
  519    HA   GLU  66           HA       GLU  66 -10.910  -1.413   7.935
  520    HB2  GLU  66           2HB      GLU  66 -11.344  -3.615   5.857
  521    HB3  GLU  66           1HB      GLU  66 -12.504  -3.147   7.102
  522    HG2  GLU  66           2HG      GLU  66 -12.782  -0.951   6.095
  523    HG3  GLU  66           1HG      GLU  66 -11.502  -1.289   4.928
  524    H    ASN  67           H        ASN  67 -11.172  -2.778   9.765
  525    HA   ASN  67           HA       ASN  67  -8.805  -3.849  10.737
  526    HB2  ASN  67           2HB      ASN  67 -10.963  -3.018  11.971
  527    HB3  ASN  67           1HB      ASN  67 -11.489  -4.687  11.880
  528   HD21  ASN  67          1HD2      ASN  67  -8.674  -5.732  12.377
  529   HD22  ASN  67          2HD2      ASN  67  -8.389  -5.432  14.045
  530    H    ASP  68           H        ASP  68 -11.527  -5.552   9.255
  531    HA   ASP  68           HA       ASP  68 -10.765  -8.216   9.918
  532    HB2  ASP  68           2HB      ASP  68 -12.669  -7.080   7.839
  533    HB3  ASP  68           1HB      ASP  68 -12.421  -8.813   8.029
  534    H    ALA  69           H        ALA  69  -9.913  -6.112   7.236
  535    HA   ALA  69           HA       ALA  69  -9.210  -7.935   5.241
  536    HB1  ALA  69           3HB      ALA  69  -9.448  -5.521   4.832
  537    HB2  ALA  69           1HB      ALA  69  -7.894  -6.114   4.238
  538    HB3  ALA  69           2HB      ALA  69  -7.976  -5.204   5.750
  539    H    ASN  70           H        ASN  70  -7.785  -9.581   5.401
  540    HA   ASN  70           HA       ASN  70  -5.581  -9.539   7.296
  541    HB2  ASN  70           2HB      ASN  70  -6.432 -11.655   5.267
  542    HB3  ASN  70           1HB      ASN  70  -5.200 -11.877   6.509
  543   HD21  ASN  70          1HD2      ASN  70  -5.850 -12.109   8.670
  544   HD22  ASN  70          2HD2      ASN  70  -7.484 -12.457   9.105
  545    H    TRP  71           H        TRP  71  -3.559  -8.941   6.824
  546    HA   TRP  71           HA       TRP  71  -2.808  -7.965   4.248
  547    HB2  TRP  71           2HB      TRP  71  -1.180  -8.446   6.768
  548    HB3  TRP  71           1HB      TRP  71  -0.535  -7.671   5.321
  549    HD1  TRP  71           HD1      TRP  71  -2.259  -6.832   8.515
  550    HE1  TRP  71           HE1      TRP  71  -2.942  -4.358   8.512
  551    HE3  TRP  71           HE3      TRP  71  -1.591  -5.761   3.542
  552    HZ2  TRP  71           HZ2      TRP  71  -3.187  -2.245   6.696
  553    HZ3  TRP  71           HZ3      TRP  71  -2.083  -3.476   2.760
  554    HH2  TRP  71           HH2      TRP  71  -2.866  -1.758   4.313
  555    H    GLU  72           H        GLU  72  -2.751 -11.109   5.563
  556    HA   GLU  72           HA       GLU  72  -0.459 -12.254   4.407
  557    HB2  GLU  72           2HB      GLU  72  -1.621 -14.421   4.704
  558    HB3  GLU  72           1HB      GLU  72  -1.795 -13.391   6.123
  559    HG2  GLU  72           2HG      GLU  72  -4.065 -12.746   5.368
  560    HG3  GLU  72           1HG      GLU  72  -3.895 -13.810   3.976
  561    H    THR  73           H        THR  73  -3.549 -11.404   3.003
  562    HA   THR  73           HA       THR  73  -2.973 -12.796   0.482
  563    HB   THR  73           HB       THR  73  -5.237 -13.095   1.424
  564    HG1  THR  73           HG1      THR  73  -6.083 -11.822  -0.769
  565   HG21  THR  73          3HG2      THR  73  -6.920 -11.288   1.325
  566   HG22  THR  73          1HG2      THR  73  -5.666 -10.131   0.875
  567   HG23  THR  73          2HG2      THR  73  -5.635 -10.892   2.468
  568    H    VAL  74           H        VAL  74  -3.446  -9.528   1.753
  569    HA   VAL  74           HA       VAL  74  -3.393  -8.085  -0.696
  570    HB   VAL  74           HB       VAL  74  -2.619  -7.046   2.079
  571   HG11  VAL  74          1HG1      VAL  74  -3.596  -5.535  -0.379
  572   HG12  VAL  74          2HG1      VAL  74  -1.954  -5.518   0.262
  573   HG13  VAL  74          3HG1      VAL  74  -3.270  -4.821   1.207
  574   HG21  VAL  74          3HG2      VAL  74  -5.379  -7.092   0.792
  575   HG22  VAL  74          1HG2      VAL  74  -4.967  -6.316   2.326
  576   HG23  VAL  74          2HG2      VAL  74  -4.862  -8.070   2.166
  577    H    LEU  75           H        LEU  75  -0.863  -8.878   1.661
  578    HA   LEU  75           HA       LEU  75   1.145  -7.154   0.744
  579    HB2  LEU  75           2HB      LEU  75   0.940  -8.427   2.993
  580    HB3  LEU  75           1HB      LEU  75   1.753  -9.752   2.193
  581    HG   LEU  75           HG       LEU  75   3.015  -6.980   2.417
  582   HD11  LEU  75          1HD1      LEU  75   3.352  -9.282   4.377
  583   HD12  LEU  75          2HD1      LEU  75   2.536  -7.749   4.696
  584   HD13  LEU  75          3HD1      LEU  75   4.269  -7.769   4.385
  585   HD21  LEU  75          3HD2      LEU  75   4.082  -8.422   0.737
  586   HD22  LEU  75          1HD2      LEU  75   4.295  -9.701   1.939
  587   HD23  LEU  75          2HD2      LEU  75   5.156  -8.169   2.108
  588    HA   PRO  76           HA       PRO  76   2.859 -11.153  -1.946
  589    HB2  PRO  76           2HB      PRO  76  -0.007 -11.791  -2.757
  590    HB3  PRO  76           1HB      PRO  76   1.422 -12.854  -2.755
  591    HG2  PRO  76           2HG      PRO  76  -0.338 -13.025  -0.802
  592    HG3  PRO  76           1HG      PRO  76   1.404 -13.113  -0.444
  593    HD2  PRO  76           2HD      PRO  76  -0.511 -10.862   0.051
  594    HD3  PRO  76           1HD      PRO  76   0.921 -11.343   0.978
  595    H    LYS  77           H        LYS  77  -0.073  -9.224  -2.670
  596    HA   LYS  77           HA       LYS  77   0.709  -8.599  -5.385
  597    HB2  LYS  77           2HB      LYS  77  -1.521  -7.641  -3.571
  598    HB3  LYS  77           1HB      LYS  77  -1.200  -6.811  -5.092
  599    HG2  LYS  77           2HG      LYS  77  -1.536  -8.941  -6.317
  600    HG3  LYS  77           1HG      LYS  77  -1.932  -9.743  -4.795
  601    HD2  LYS  77           2HD      LYS  77  -3.983  -8.592  -4.568
  602    HD3  LYS  77           1HD      LYS  77  -3.479  -7.278  -5.635
  603    HE2  LYS  77           2HE      LYS  77  -4.102 -10.108  -6.553
  604    HE3  LYS  77           1HE      LYS  77  -5.196  -8.728  -6.669
  605    HZ1  LYS  77           3HZ      LYS  77  -3.447  -7.605  -8.010
  606    HZ2  LYS  77           1HZ      LYS  77  -4.122  -8.968  -8.751
  607    HZ3  LYS  77           2HZ      LYS  77  -2.594  -9.060  -8.046
  608    H    VAL  78           H        VAL  78   0.847  -6.912  -2.271
  609    HA   VAL  78           HA       VAL  78   1.663  -4.361  -3.158
  610    HB   VAL  78           HB       VAL  78   2.254  -5.760  -0.508
  611   HG11  VAL  78          1HG1      VAL  78   2.711  -3.518   0.429
  612   HG12  VAL  78          2HG1      VAL  78   2.554  -2.807  -1.179
  613   HG13  VAL  78          3HG1      VAL  78   3.863  -3.942  -0.838
  614   HG21  VAL  78          3HG2      VAL  78   0.069  -3.761  -1.215
  615   HG22  VAL  78          1HG2      VAL  78   0.369  -4.441   0.388
  616   HG23  VAL  78          2HG2      VAL  78  -0.152  -5.489  -0.929
  617    H    GLU  79           H        GLU  79   3.646  -7.016  -1.853
  618    HA   GLU  79           HA       GLU  79   6.157  -5.895  -2.348
  619    HB2  GLU  79           2HB      GLU  79   5.714  -7.852  -0.841
  620    HB3  GLU  79           1HB      GLU  79   5.409  -8.854  -2.257
  621    HG2  GLU  79           2HG      GLU  79   7.749  -8.490  -2.999
  622    HG3  GLU  79           1HG      GLU  79   8.044  -7.520  -1.554
  623    H    ALA  80           H        ALA  80   4.039  -7.926  -4.371
  624    HA   ALA  80           HA       ALA  80   5.759  -8.407  -6.555
  625    HB1  ALA  80           3HB      ALA  80   3.718  -8.908  -7.850
  626    HB2  ALA  80           1HB      ALA  80   2.729  -8.158  -6.590
  627    HB3  ALA  80           2HB      ALA  80   3.640  -9.627  -6.242
  628    H    VAL  81           H        VAL  81   3.765  -5.601  -5.752
  629    HA   VAL  81           HA       VAL  81   3.815  -4.232  -8.218
  630    HB   VAL  81           HB       VAL  81   3.494  -3.331  -5.341
  631   HG11  VAL  81          1HG1      VAL  81   4.614  -1.417  -6.316
  632   HG12  VAL  81          2HG1      VAL  81   2.906  -1.029  -6.104
  633   HG13  VAL  81          3HG1      VAL  81   3.528  -1.434  -7.706
  634   HG21  VAL  81          3HG2      VAL  81   1.183  -2.827  -6.063
  635   HG22  VAL  81          1HG2      VAL  81   1.611  -4.507  -6.390
  636   HG23  VAL  81          2HG2      VAL  81   1.576  -3.331  -7.705
  637    H    PHE  82           H        PHE  82   6.037  -3.945  -5.432
  638    HA   PHE  82           HA       PHE  82   7.948  -2.310  -6.814
  639    HB2  PHE  82           2HB      PHE  82   8.379  -3.987  -4.303
  640    HB3  PHE  82           1HB      PHE  82   9.316  -2.578  -4.812
  641    HD1  PHE  82           HD1      PHE  82   8.044  -0.323  -5.044
  642    HD2  PHE  82           HD2      PHE  82   6.475  -3.684  -2.928
  643    HE1  PHE  82           HE1      PHE  82   6.412   1.136  -3.926
  644    HE2  PHE  82           HE2      PHE  82   4.858  -2.219  -1.806
  645    HZ   PHE  82           HZ       PHE  82   4.816   0.172  -2.322
  646    H    GLU  83           H        GLU  83   7.490  -5.794  -6.592
  647    HA   GLU  83           HA       GLU  83  10.216  -6.303  -7.648
  648    HB2  GLU  83           2HB      GLU  83   8.327  -8.232  -6.244
  649    HB3  GLU  83           1HB      GLU  83   9.970  -8.591  -6.759
  650    HG2  GLU  83           2HG      GLU  83   9.122  -6.669  -4.580
  651    HG3  GLU  83           1HG      GLU  83   9.904  -8.230  -4.362
  652    H    LEU  84           H        LEU  84   7.568  -5.644  -9.190
  653    HA   LEU  84           HA       LEU  84   7.285  -8.027 -10.861
  654    HB2  LEU  84           2HB      LEU  84   5.612  -6.792 -12.152
  655    HB3  LEU  84           1HB      LEU  84   5.281  -6.732 -10.439
  656    HG   LEU  84           HG       LEU  84   6.369  -4.343 -10.534
  657   HD11  LEU  84          1HD1      LEU  84   5.659  -4.671 -13.466
  658   HD12  LEU  84          2HD1      LEU  84   7.272  -4.416 -12.800
  659   HD13  LEU  84          3HD1      LEU  84   6.059  -3.147 -12.667
  660   HD21  LEU  84          3HD2      LEU  84   4.008  -4.761 -10.027
  661   HD22  LEU  84          1HD2      LEU  84   3.632  -4.859 -11.750
  662   HD23  LEU  84          2HD2      LEU  84   4.181  -3.335 -11.046
  663    H    GLU  85           H        GLU  85   9.713  -5.948 -10.639
  664    HA   GLU  85           HA       GLU  85  10.316  -4.949 -13.138
  665    HB2  GLU  85           2HB      GLU  85  11.775  -5.385 -10.661
  666    HB3  GLU  85           1HB      GLU  85  12.783  -5.983 -11.967
  667    HG2  GLU  85           2HG      GLU  85  11.769  -3.173 -11.524
  668    HG3  GLU  85           1HG      GLU  85  13.437  -3.745 -11.631
  669    H    HIS  86           H        HIS  86  11.694  -5.738 -14.831
  670    HA   HIS  86           HA       HIS  86  10.758  -8.037 -16.049
  671    HB2  HIS  86           2HB      HIS  86  13.407  -6.613 -16.561
  672    HB3  HIS  86           1HB      HIS  86  12.649  -7.759 -17.666
  673    HD1  HIS  86           HD1      HIS  86  10.867  -6.849 -19.226
  674    HD2  HIS  86           HD2      HIS  86  11.988  -4.095 -16.324
  675    HE1  HIS  86           HE1      HIS  86   9.760  -4.695 -19.887
  676    HE2  HIS  86           HE2      HIS  86  10.564  -3.015 -18.191
  677    H    HIS  87           H        HIS  87  10.972 -10.075 -15.419
  678    HA   HIS  87           HA       HIS  87  12.646 -10.916 -13.334
  679    HB2  HIS  87           2HB      HIS  87  10.510 -12.020 -13.787
  680    HB3  HIS  87           1HB      HIS  87  11.073 -12.566 -15.361
  681    HD1  HIS  87           HD1      HIS  87  12.430 -14.722 -15.433
  682    HD2  HIS  87           HD2      HIS  87  11.671 -13.448 -11.556
  683    HE1  HIS  87           HE1      HIS  87  13.142 -16.615 -13.961
  684    HE2  HIS  87           HE2      HIS  87  12.440 -15.918 -11.651
  685    H    HIS  88           H        HIS  88  12.858 -11.515 -16.829
  686    HA   HIS  88           HA       HIS  88  14.453 -12.216 -18.243
  687    HB2  HIS  88           2HB      HIS  88  16.441 -11.588 -16.017
  688    HB3  HIS  88           1HB      HIS  88  16.878 -11.970 -17.678
  689    HD1  HIS  88           HD1      HIS  88  15.997 -10.164 -19.506
  690    HD2  HIS  88           HD2      HIS  88  16.000  -8.924 -15.545
  691    HE1  HIS  88           HE1      HIS  88  15.839  -7.659 -19.590
  692    HE2  HIS  88           HE2      HIS  88  15.930  -6.927 -17.187
  693    H    HIS  89           H        HIS  89  15.511 -14.126 -18.881
  694    HA   HIS  89           HA       HIS  89  15.457 -16.390 -17.047
  695    HB2  HIS  89           2HB      HIS  89  16.279 -16.088 -19.955
  696    HB3  HIS  89           1HB      HIS  89  16.590 -17.581 -19.064
  697    HD1  HIS  89           HD1      HIS  89  14.531 -18.977 -18.320
  698    HD2  HIS  89           HD2      HIS  89  13.589 -15.656 -20.636
  699    HE1  HIS  89           HE1      HIS  89  12.138 -19.299 -19.015
  700    HE2  HIS  89           HE2      HIS  89  11.551 -17.220 -20.316
  701    H    HIS  90           H        HIS  90  17.660 -13.902 -17.833
  702    HA   HIS  90           HA       HIS  90  20.002 -15.105 -16.657
  703    HB2  HIS  90           2HB      HIS  90  20.154 -13.132 -18.180
  704    HB3  HIS  90           1HB      HIS  90  19.253 -12.158 -17.022
  705    HD1  HIS  90           HD1      HIS  90  22.505 -14.162 -17.091
  706    HD2  HIS  90           HD2      HIS  90  20.898 -10.738 -15.363
  707    HE1  HIS  90           HE1      HIS  90  24.383 -13.121 -15.785
  708    HE2  HIS  90           HE2      HIS  90  23.417 -10.995 -14.838
  709    H    HIS  91           H        HIS  91  18.846 -16.115 -14.923
  710    HA   HIS  91           HA       HIS  91  18.872 -14.730 -12.433
  711    HB2  HIS  91           2HB      HIS  91  16.673 -13.893 -13.172
  712    HB3  HIS  91           1HB      HIS  91  16.146 -15.518 -13.590
  713    HD1  HIS  91           HD1      HIS  91  15.046 -16.851 -11.780
  714    HD2  HIS  91           HD2      HIS  91  16.965 -13.475 -10.304
  715    HE1  HIS  91           HE1      HIS  91  14.365 -16.701  -9.369
  716    HE2  HIS  91           HE2      HIS  91  15.654 -14.736  -8.462
  Start of MODEL    6
    1    H1   MET   1           1H       MET   1  13.125   3.917  -5.472
    2    H2   MET   1           2H       MET   1  11.799   3.054  -6.068
    3    H3   MET   1           3H       MET   1  13.212   2.237  -5.630
    4    HA   MET   1           HA       MET   1  12.934   2.786  -3.363
    5    HB2  MET   1           2HB      MET   1  10.519   4.332  -4.361
    6    HB3  MET   1           1HB      MET   1  10.682   3.856  -2.674
    7    HG2  MET   1           2HG      MET   1  11.376   6.162  -3.001
    8    HG3  MET   1           1HG      MET   1  12.743   5.169  -2.495
    9    HE1  MET   1           3HE      MET   1  14.509   6.987  -3.251
   10    HE2  MET   1           1HE      MET   1  13.170   8.056  -3.674
   11    HE3  MET   1           2HE      MET   1  14.478   7.778  -4.826
   12    H    LYS   2           H        LYS   2  12.567   0.824  -2.602
   13    HA   LYS   2           HA       LYS   2  10.013  -0.564  -3.217
   14    HB2  LYS   2           2HB      LYS   2  11.119  -2.697  -3.127
   15    HB3  LYS   2           1HB      LYS   2  12.048  -1.693  -4.232
   16    HG2  LYS   2           2HG      LYS   2  13.832  -1.432  -2.659
   17    HG3  LYS   2           1HG      LYS   2  12.848  -2.046  -1.328
   18    HD2  LYS   2           2HD      LYS   2  12.778  -4.280  -2.538
   19    HD3  LYS   2           1HD      LYS   2  13.973  -3.631  -3.666
   20    HE2  LYS   2           2HE      LYS   2  15.569  -3.316  -1.821
   21    HE3  LYS   2           1HE      LYS   2  14.361  -3.879  -0.660
   22    HZ1  LYS   2           3HZ      LYS   2  14.364  -6.026  -1.761
   23    HZ2  LYS   2           1HZ      LYS   2  15.912  -5.617  -1.224
   24    HZ3  LYS   2           2HZ      LYS   2  15.525  -5.486  -2.861
   25    H    ILE   3           H        ILE   3   9.731  -2.401  -1.416
   26    HA   ILE   3           HA       ILE   3   9.473  -1.088   1.128
   27    HB   ILE   3           HB       ILE   3   9.145  -4.068   0.522
   28   HG12  ILE   3          2HG1      ILE   3   7.079  -1.823   0.405
   29   HG13  ILE   3          1HG1      ILE   3   7.648  -2.795  -0.941
   30   HG21  ILE   3          1HG2      ILE   3   9.392  -3.580   2.939
   31   HG22  ILE   3          2HG2      ILE   3   7.766  -4.151   2.571
   32   HG23  ILE   3          3HG2      ILE   3   8.050  -2.434   2.855
   33   HD11  ILE   3          3HD1      ILE   3   5.430  -3.459  -0.263
   34   HD12  ILE   3          1HD1      ILE   3   5.991  -3.769   1.381
   35   HD13  ILE   3          2HD1      ILE   3   6.573  -4.765   0.045
   36    H    ILE   4           H        ILE   4  11.369  -0.608   2.119
   37    HA   ILE   4           HA       ILE   4  13.611  -2.458   2.259
   38    HB   ILE   4           HB       ILE   4  13.183   0.282   3.542
   39   HG12  ILE   4          2HG1      ILE   4  13.322   0.404   1.092
   40   HG13  ILE   4          1HG1      ILE   4  14.780   1.087   1.796
   41   HG21  ILE   4          1HG2      ILE   4  15.617   0.293   4.041
   42   HG22  ILE   4          2HG2      ILE   4  15.737  -1.377   3.485
   43   HG23  ILE   4          3HG2      ILE   4  14.773  -0.992   4.911
   44   HD11  ILE   4          3HD1      ILE   4  15.977  -1.007   1.278
   45   HD12  ILE   4          1HD1      ILE   4  15.310  -0.225  -0.155
   46   HD13  ILE   4          2HD1      ILE   4  14.508  -1.637   0.528
   47    H    SER   5           H        SER   5  11.253  -1.014   4.522
   48    HA   SER   5           HA       SER   5  11.303  -3.353   6.230
   49    HB2  SER   5           2HB      SER   5  11.890  -2.008   8.302
   50    HB3  SER   5           1HB      SER   5  13.231  -2.184   7.170
   51    HG   SER   5           HG       SER   5  11.544   0.093   7.456
   52    H    ILE   6           H        ILE   6   9.218  -3.690   6.730
   53    HA   ILE   6           HA       ILE   6   7.257  -1.564   6.974
   54    HB   ILE   6           HB       ILE   6   7.014  -4.530   7.702
   55   HG12  ILE   6          2HG1      ILE   6   6.160  -3.143   5.108
   56   HG13  ILE   6          1HG1      ILE   6   7.587  -4.156   5.277
   57   HG21  ILE   6          1HG2      ILE   6   4.819  -2.469   7.230
   58   HG22  ILE   6          2HG2      ILE   6   5.277  -3.152   8.790
   59   HG23  ILE   6          3HG2      ILE   6   4.561  -4.186   7.554
   60   HD11  ILE   6          3HD1      ILE   6   6.145  -6.090   5.764
   61   HD12  ILE   6          1HD1      ILE   6   5.794  -5.364   4.195
   62   HD13  ILE   6          2HD1      ILE   6   4.723  -5.064   5.560
   63    H    SER   7           H        SER   7   6.197  -1.045   9.010
   64    HA   SER   7           HA       SER   7   7.963  -0.692  11.204
   65    HB2  SER   7           2HB      SER   7   6.190   0.920  10.742
   66    HB3  SER   7           1HB      SER   7   4.944  -0.295  11.034
   67    HG   SER   7           HG       SER   7   6.147   1.326  12.779
   68    H    GLU   8           H        GLU   8   7.257  -1.209  13.485
   69    HA   GLU   8           HA       GLU   8   7.251  -3.937  14.088
   70    HB2  GLU   8           2HB      GLU   8   6.621  -1.478  15.727
   71    HB3  GLU   8           1HB      GLU   8   6.653  -3.077  16.438
   72    HG2  GLU   8           2HG      GLU   8   8.732  -1.883  16.892
   73    HG3  GLU   8           1HG      GLU   8   9.042  -3.295  15.892
   74    H    THR   9           H        THR   9   4.755  -1.752  13.545
   75    HA   THR   9           HA       THR   9   2.654  -3.778  13.942
   76    HB   THR   9           HB       THR   9   2.065  -1.756  15.095
   77    HG1  THR   9           HG1      THR   9   0.521  -1.551  12.721
   78   HG21  THR   9          3HG2      THR   9   2.493  -0.214  12.513
   79   HG22  THR   9          1HG2      THR   9   3.492  -0.097  13.961
   80   HG23  THR   9          2HG2      THR   9   1.812   0.448  13.998
   81    HA   PRO  10           HA       PRO  10   2.887  -3.859   9.335
   82    HB2  PRO  10           2HB      PRO  10   2.848  -6.525   8.980
   83    HB3  PRO  10           1HB      PRO  10   4.317  -5.723   9.577
   84    HG2  PRO  10           2HG      PRO  10   2.278  -7.291  11.110
   85    HG3  PRO  10           1HG      PRO  10   4.045  -7.263  11.292
   86    HD2  PRO  10           2HD      PRO  10   2.218  -5.796  12.859
   87    HD3  PRO  10           1HD      PRO  10   3.964  -5.487  12.747
   88    H    ASN  11           H        ASN  11   0.552  -4.057  11.514
   89    HA   ASN  11           HA       ASN  11  -1.631  -4.595   9.686
   90    HB2  ASN  11           2HB      ASN  11  -2.623  -6.146  11.485
   91    HB3  ASN  11           1HB      ASN  11  -1.329  -6.821  10.513
   92   HD21  ASN  11          1HD2      ASN  11  -0.913  -8.380  12.123
   93   HD22  ASN  11          2HD2      ASN  11  -0.109  -7.988  13.601
   94    H    HIS  12           H        HIS  12  -3.612  -4.681  11.746
   95    HA   HIS  12           HA       HIS  12  -4.923  -3.454  13.099
   96    HB2  HIS  12           2HB      HIS  12  -2.325  -2.148  14.042
   97    HB3  HIS  12           1HB      HIS  12  -3.882  -2.012  14.854
   98    HD1  HIS  12           HD1      HIS  12  -1.841  -3.022  16.629
   99    HD2  HIS  12           HD2      HIS  12  -3.790  -5.598  14.033
  100    HE1  HIS  12           HE1      HIS  12  -1.533  -5.318  17.599
  101    HE2  HIS  12           HE2      HIS  12  -2.594  -6.867  15.937
  102    H    ASN  13           H        ASN  13  -5.729  -2.661  11.100
  103    HA   ASN  13           HA       ASN  13  -6.700  -1.135   9.792
  104    HB2  ASN  13           2HB      ASN  13  -5.488   0.899  11.677
  105    HB3  ASN  13           1HB      ASN  13  -6.490   1.357  10.311
  106   HD21  ASN  13          1HD2      ASN  13  -8.406  -0.711  10.460
  107   HD22  ASN  13          2HD2      ASN  13  -9.348  -0.452  11.884
  108    H    THR  14           H        THR  14  -3.421   0.110  10.525
  109    HA   THR  14           HA       THR  14  -2.842   0.184   7.654
  110    HB   THR  14           HB       THR  14  -3.740   2.405   8.000
  111    HG1  THR  14           HG1      THR  14  -2.182   3.209   6.882
  112   HG21  THR  14          3HG2      THR  14  -2.804   4.005   9.635
  113   HG22  THR  14          1HG2      THR  14  -1.751   2.749  10.286
  114   HG23  THR  14          2HG2      THR  14  -3.502   2.605  10.455
  115    H    MET  15           H        MET  15  -0.804  -0.289   7.149
  116    HA   MET  15           HA       MET  15   1.219  -0.592   9.312
  117    HB2  MET  15           2HB      MET  15   2.461  -2.065   7.783
  118    HB3  MET  15           1HB      MET  15   0.820  -2.656   7.974
  119    HG2  MET  15           2HG      MET  15   0.251  -2.182   5.787
  120    HG3  MET  15           1HG      MET  15   1.411  -0.881   5.641
  121    HE1  MET  15           3HE      MET  15   2.617  -5.346   5.453
  122    HE2  MET  15           1HE      MET  15   0.966  -4.805   5.752
  123    HE3  MET  15           2HE      MET  15   2.213  -4.550   6.974
  124    H    LYS  16           H        LYS  16   3.302   0.247   8.988
  125    HA   LYS  16           HA       LYS  16   3.593   2.468   7.062
  126    HB2  LYS  16           2HB      LYS  16   4.254   3.069   9.295
  127    HB3  LYS  16           1HB      LYS  16   5.169   1.590   9.502
  128    HG2  LYS  16           2HG      LYS  16   6.772   2.445   7.720
  129    HG3  LYS  16           1HG      LYS  16   5.925   3.989   7.806
  130    HD2  LYS  16           2HD      LYS  16   7.403   2.607  10.079
  131    HD3  LYS  16           1HD      LYS  16   7.950   4.036   9.201
  132    HE2  LYS  16           2HE      LYS  16   6.057   5.328  10.097
  133    HE3  LYS  16           1HE      LYS  16   5.447   3.891  10.919
  134    HZ1  LYS  16           3HZ      LYS  16   7.567   3.845  12.164
  135    HZ2  LYS  16           1HZ      LYS  16   6.612   5.203  12.480
  136    HZ3  LYS  16           2HZ      LYS  16   7.965   5.337  11.480
  137    H    ILE  17           H        ILE  17   4.631   2.103   5.197
  138    HA   ILE  17           HA       ILE  17   6.598  -0.105   4.967
  139    HB   ILE  17           HB       ILE  17   4.785   1.148   2.856
  140   HG12  ILE  17          2HG1      ILE  17   5.079  -1.716   3.877
  141   HG13  ILE  17          1HG1      ILE  17   3.748  -0.623   4.226
  142   HG21  ILE  17          1HG2      ILE  17   7.075  -0.793   2.351
  143   HG22  ILE  17          2HG2      ILE  17   6.999   0.888   1.825
  144   HG23  ILE  17          3HG2      ILE  17   5.877  -0.293   1.155
  145   HD11  ILE  17          3HD1      ILE  17   3.133  -0.673   1.828
  146   HD12  ILE  17          1HD1      ILE  17   3.077  -2.256   2.602
  147   HD13  ILE  17          2HD1      ILE  17   4.430  -1.839   1.554
  148    H    THR  18           H        THR  18   8.373   0.954   5.621
  149    HA   THR  18           HA       THR  18   9.211   3.544   4.764
  150    HB   THR  18           HB       THR  18  10.953   1.271   5.841
  151    HG1  THR  18           HG1      THR  18   9.559   3.304   7.291
  152   HG21  THR  18          3HG2      THR  18  11.344   4.295   5.943
  153   HG22  THR  18          1HG2      THR  18  12.247   3.177   4.918
  154   HG23  THR  18          2HG2      THR  18  12.408   3.090   6.671
  155    H    LEU  19           H        LEU  19   9.699   3.981   2.686
  156    HA   LEU  19           HA       LEU  19  10.570   1.947   0.803
  157    HB2  LEU  19           2HB      LEU  19  10.173   4.944   0.468
  158    HB3  LEU  19           1HB      LEU  19  10.535   3.831  -0.840
  159    HG   LEU  19           HG       LEU  19   7.981   3.883   0.819
  160   HD11  LEU  19          1HD1      LEU  19   6.874   4.531  -1.273
  161   HD12  LEU  19          2HD1      LEU  19   8.429   4.551  -2.108
  162   HD13  LEU  19          3HD1      LEU  19   8.106   5.707  -0.814
  163   HD21  LEU  19          3HD2      LEU  19   8.510   1.558   0.261
  164   HD22  LEU  19          1HD2      LEU  19   8.730   1.984  -1.438
  165   HD23  LEU  19          2HD2      LEU  19   7.134   2.110  -0.691
  166    H    SER  20           H        SER  20  12.402   2.783  -0.791
  167    HA   SER  20           HA       SER  20  14.882   3.121   0.602
  168    HB2  SER  20           2HB      SER  20  14.396   3.474  -2.387
  169    HB3  SER  20           1HB      SER  20  15.911   3.031  -1.593
  170    HG   SER  20           HG       SER  20  15.240   1.031  -1.390
  171    H    GLU  21           H        GLU  21  12.517   5.320   0.107
  172    HA   GLU  21           HA       GLU  21  13.641   7.643  -0.937
  173    HB2  GLU  21           2HB      GLU  21  11.140   6.886  -0.167
  174    HB3  GLU  21           1HB      GLU  21  11.555   7.846   1.237
  175    HG2  GLU  21           2HG      GLU  21  11.632   8.894  -1.603
  176    HG3  GLU  21           1HG      GLU  21  10.229   9.001  -0.560
  177    H    SER  22           H        SER  22  14.965   9.133  -0.112
  178    HA   SER  22           HA       SER  22  16.588   8.727   2.121
  179    HB2  SER  22           2HB      SER  22  17.287   9.962   0.083
  180    HB3  SER  22           1HB      SER  22  16.182  11.271   0.513
  181    HG   SER  22           HG       SER  22  17.415  11.587   2.414
  182    H    ARG  23           H        ARG  23  13.709  10.355   1.700
  183    HA   ARG  23           HA       ARG  23  12.132  11.131   3.159
  184    HB2  ARG  23           2HB      ARG  23  13.349  10.573   5.261
  185    HB3  ARG  23           1HB      ARG  23  14.305  12.043   5.083
  186    HG2  ARG  23           2HG      ARG  23  12.242  13.407   5.243
  187    HG3  ARG  23           1HG      ARG  23  11.281  11.936   5.415
  188    HD2  ARG  23           2HD      ARG  23  12.580  11.432   7.526
  189    HD3  ARG  23           1HD      ARG  23  13.324  13.033   7.379
  190    HE   ARG  23           HE       ARG  23  11.192  14.042   7.726
  191   HH11  ARG  23          1HH1      ARG  23  11.079  10.544   8.160
  192   HH12  ARG  23          2HH1      ARG  23   9.592  10.590   9.048
  193   HH21  ARG  23          1HH2      ARG  23   9.206  14.045   8.860
  194   HH22  ARG  23          2HH2      ARG  23   8.539  12.553   9.442
  195    H    GLU  24           H        GLU  24  11.158  12.951   2.703
  196    HA   GLU  24           HA       GLU  24  10.656  15.087   2.295
  197    HB2  GLU  24           2HB      GLU  24  12.545  15.709   3.884
  198    HB3  GLU  24           1HB      GLU  24  13.592  15.868   2.481
  199    HG2  GLU  24           2HG      GLU  24  12.187  17.686   1.610
  200    HG3  GLU  24           1HG      GLU  24  11.065  17.486   2.953
  201    H    GLY  25           H        GLY  25  12.472  13.099   0.380
  202    HA2  GLY  25           2HA      GLY  25  12.778  14.745  -1.963
  203    HA3  GLY  25           1HA      GLY  25  12.881  12.991  -1.881
  204    H    MET  26           H        MET  26  10.338  12.562  -0.688
  205    HA   MET  26           HA       MET  26   8.433  13.255  -2.856
  206    HB2  MET  26           2HB      MET  26   8.398  10.969  -0.836
  207    HB3  MET  26           1HB      MET  26   7.122  11.282  -2.003
  208    HG2  MET  26           2HG      MET  26   8.638  10.785  -3.845
  209    HG3  MET  26           1HG      MET  26   9.980  10.581  -2.712
  210    HE1  MET  26           3HE      MET  26   9.094   8.308  -4.906
  211    HE2  MET  26           1HE      MET  26   9.224   6.857  -3.914
  212    HE3  MET  26           2HE      MET  26  10.462   8.110  -3.809
  213    H    THR  27           H        THR  27   6.055  13.088  -1.783
  214    HA   THR  27           HA       THR  27   5.985  14.854   0.602
  215    HB   THR  27           HB       THR  27   5.491  16.113  -1.542
  216    HG1  THR  27           HG1      THR  27   4.277  17.333  -0.323
  217   HG21  THR  27          3HG2      THR  27   3.289  15.830  -2.629
  218   HG22  THR  27          1HG2      THR  27   2.950  14.436  -1.595
  219   HG23  THR  27          2HG2      THR  27   4.247  14.357  -2.789
  220    H    SER  28           H        SER  28   3.587  15.014   1.339
  221    HA   SER  28           HA       SER  28   2.615  12.337   2.008
  222    HB2  SER  28           2HB      SER  28   1.124  13.653   3.591
  223    HB3  SER  28           1HB      SER  28   2.852  13.886   3.853
  224    HG   SER  28           HG       SER  28   1.440  15.644   2.158
  225    H    ASP  29           H        ASP  29   0.818  11.442   1.160
  226    HA   ASP  29           HA       ASP  29  -1.400  12.982   0.100
  227    HB2  ASP  29           2HB      ASP  29   0.374  12.561  -1.809
  228    HB3  ASP  29           1HB      ASP  29  -0.168  10.898  -1.761
  229    H    THR  30           H        THR  30  -3.309  11.567  -0.214
  230    HA   THR  30           HA       THR  30  -3.030   8.813   0.814
  231    HB   THR  30           HB       THR  30  -3.957  10.001   2.690
  232    HG1  THR  30           HG1      THR  30  -6.054   8.946   2.808
  233   HG21  THR  30          3HG2      THR  30  -6.129  11.093   0.872
  234   HG22  THR  30          1HG2      THR  30  -4.824  12.029   1.601
  235   HG23  THR  30          2HG2      THR  30  -6.060  11.291   2.623
  236    H    TYR  31           H        TYR  31  -3.247   7.718  -1.008
  237    HA   TYR  31           HA       TYR  31  -5.148   8.393  -3.105
  238    HB2  TYR  31           2HB      TYR  31  -3.297   5.973  -2.819
  239    HB3  TYR  31           1HB      TYR  31  -4.154   6.451  -4.286
  240    HD1  TYR  31           HD1      TYR  31  -3.630   8.862  -5.200
  241    HD2  TYR  31           HD2      TYR  31  -1.071   6.781  -2.477
  242    HE1  TYR  31           HE1      TYR  31  -1.765  10.316  -5.840
  243    HE2  TYR  31           HE2      TYR  31   0.799   8.238  -3.130
  244    HH   TYR  31           HH       TYR  31   0.347  11.108  -4.871
  245    H    THR  32           H        THR  32  -7.225   7.898  -2.756
  246    HA   THR  32           HA       THR  32  -7.937   5.610  -1.006
  247    HB   THR  32           HB       THR  32 -10.037   6.946  -0.507
  248    HG1  THR  32           HG1      THR  32  -9.791   9.277  -1.027
  249   HG21  THR  32          3HG2      THR  32  -8.138   7.008   1.072
  250   HG22  THR  32          1HG2      THR  32  -8.950   8.572   1.008
  251   HG23  THR  32          2HG2      THR  32  -7.415   8.340   0.165
  252    H    LYS  33           H        LYS  33  -9.546   7.608  -3.533
  253    HA   LYS  33           HA       LYS  33 -11.192   5.265  -4.247
  254    HB2  LYS  33           2HB      LYS  33 -11.673   8.199  -4.896
  255    HB3  LYS  33           1HB      LYS  33 -12.819   6.881  -5.094
  256    HG2  LYS  33           2HG      LYS  33 -12.994   6.620  -2.663
  257    HG3  LYS  33           1HG      LYS  33 -11.760   7.859  -2.418
  258    HD2  LYS  33           2HD      LYS  33 -14.488   8.303  -3.696
  259    HD3  LYS  33           1HD      LYS  33 -14.045   8.759  -2.051
  260    HE2  LYS  33           2HE      LYS  33 -12.367  10.346  -2.944
  261    HE3  LYS  33           1HE      LYS  33 -12.787   9.871  -4.590
  262    HZ1  LYS  33           3HZ      LYS  33 -14.596  11.183  -2.643
  263    HZ2  LYS  33           1HZ      LYS  33 -15.019  10.719  -4.210
  264    HZ3  LYS  33           2HZ      LYS  33 -13.859  11.926  -3.970
  265    H    VAL  34           H        VAL  34  -8.432   5.903  -5.301
  266    HA   VAL  34           HA       VAL  34  -7.228   5.504  -7.169
  267    HB   VAL  34           HB       VAL  34  -9.917   4.728  -8.390
  268   HG11  VAL  34          1HG1      VAL  34  -8.651   3.392 -10.056
  269   HG12  VAL  34          2HG1      VAL  34  -7.138   4.051  -9.428
  270   HG13  VAL  34          3HG1      VAL  34  -8.308   5.119 -10.202
  271   HG21  VAL  34          3HG2      VAL  34  -7.807   2.962  -7.089
  272   HG22  VAL  34          1HG2      VAL  34  -9.297   2.386  -7.849
  273   HG23  VAL  34          2HG2      VAL  34  -9.371   3.388  -6.398
  274    H    ASP  35           H        ASP  35  -6.607   6.372  -9.196
  275    HA   ASP  35           HA       ASP  35  -6.161   7.887 -10.752
  276    HB2  ASP  35           2HB      ASP  35  -8.321   7.412 -11.703
  277    HB3  ASP  35           1HB      ASP  35  -9.125   8.483 -10.569
  278    H    ASP  36           H        ASP  36  -4.736   8.997  -9.479
  279    HA   ASP  36           HA       ASP  36  -5.165  11.797  -9.429
  280    HB2  ASP  36           2HB      ASP  36  -6.263  11.346  -7.256
  281    HB3  ASP  36           1HB      ASP  36  -4.835  10.485  -6.690
  282    H    SER  37           H        SER  37  -3.485  11.198 -10.952
  283    HA   SER  37           HA       SER  37  -1.367  10.967 -11.729
  284    HB2  SER  37           2HB      SER  37   0.289  12.541 -10.673
  285    HB3  SER  37           1HB      SER  37  -1.279  13.285 -10.990
  286    HG   SER  37           HG       SER  37  -1.071  12.167  -8.481
  287    H    GLN  38           H        GLN  38  -1.932   8.657 -10.573
  288    HA   GLN  38           HA       GLN  38   0.509   7.795  -9.185
  289    HB2  GLN  38           2HB      GLN  38  -1.070   6.252  -7.771
  290    HB3  GLN  38           1HB      GLN  38  -0.874   7.927  -7.309
  291    HG2  GLN  38           2HG      GLN  38  -3.136   7.888  -7.150
  292    HG3  GLN  38           1HG      GLN  38  -3.069   8.183  -8.876
  293   HE21  GLN  38          1HE2      GLN  38  -2.512   5.150  -7.087
  294   HE22  GLN  38          2HE2      GLN  38  -3.828   4.309  -7.828
  295    HA   PRO  39           HA       PRO  39   0.666   5.006 -12.677
  296    HB2  PRO  39           2HB      PRO  39   2.187   3.283 -10.701
  297    HB3  PRO  39           1HB      PRO  39   2.623   3.758 -12.360
  298    HG2  PRO  39           2HG      PRO  39   3.779   4.954 -10.300
  299    HG3  PRO  39           1HG      PRO  39   3.290   5.895 -11.730
  300    HD2  PRO  39           2HD      PRO  39   1.972   5.747  -9.031
  301    HD3  PRO  39           1HD      PRO  39   2.144   7.127 -10.137
  302    H    ALA  40           H        ALA  40  -0.092   3.005 -13.414
  303    HA   ALA  40           HA       ALA  40  -2.521   2.076 -12.488
  304    HB1  ALA  40           3HB      ALA  40  -1.692   1.739 -14.783
  305    HB2  ALA  40           1HB      ALA  40  -2.267   0.225 -14.083
  306    HB3  ALA  40           2HB      ALA  40  -0.534   0.544 -14.198
  307    H    PHE  41           H        PHE  41   0.677   0.915 -11.683
  308    HA   PHE  41           HA       PHE  41   0.101  -1.528 -10.424
  309    HB2  PHE  41           2HB      PHE  41   2.337   0.413  -9.700
  310    HB3  PHE  41           1HB      PHE  41   2.325  -1.327  -9.433
  311    HD1  PHE  41           HD1      PHE  41   2.189  -2.842 -11.542
  312    HD2  PHE  41           HD2      PHE  41   3.294   1.285 -11.692
  313    HE1  PHE  41           HE1      PHE  41   3.231  -3.192 -13.734
  314    HE2  PHE  41           HE2      PHE  41   4.337   0.922 -13.886
  315    HZ   PHE  41           HZ       PHE  41   4.305  -1.317 -14.911
  316    H    ILE  42           H        ILE  42   0.202   1.776  -9.158
  317    HA   ILE  42           HA       ILE  42  -0.308   1.159  -6.404
  318    HB   ILE  42           HB       ILE  42  -0.729   3.807  -7.887
  319   HG12  ILE  42          2HG1      ILE  42   1.600   3.030  -8.195
  320   HG13  ILE  42          1HG1      ILE  42   1.569   4.431  -7.134
  321   HG21  ILE  42          1HG2      ILE  42  -0.443   4.886  -5.668
  322   HG22  ILE  42          2HG2      ILE  42  -0.345   3.296  -4.908
  323   HG23  ILE  42          3HG2      ILE  42  -1.838   3.805  -5.695
  324   HD11  ILE  42          3HD1      ILE  42   1.899   1.556  -6.283
  325   HD12  ILE  42          1HD1      ILE  42   1.834   2.943  -5.194
  326   HD13  ILE  42          2HD1      ILE  42   3.158   2.789  -6.347
  327    H    ASN  43           H        ASN  43  -2.300   1.648  -9.263
  328    HA   ASN  43           HA       ASN  43  -4.821   2.104  -7.968
  329    HB2  ASN  43           2HB      ASN  43  -4.171   1.100 -10.779
  330    HB3  ASN  43           1HB      ASN  43  -5.790   1.462 -10.221
  331   HD21  ASN  43          1HD2      ASN  43  -2.802   3.313  -9.659
  332   HD22  ASN  43          2HD2      ASN  43  -3.361   4.745 -10.436
  333    H    ASP  44           H        ASP  44  -3.034  -0.758  -9.049
  334    HA   ASP  44           HA       ASP  44  -5.015  -2.727  -8.583
  335    HB2  ASP  44           2HB      ASP  44  -1.985  -2.815  -8.721
  336    HB3  ASP  44           1HB      ASP  44  -2.901  -4.260  -8.300
  337    H    ILE  45           H        ILE  45  -2.456  -1.392  -6.459
  338    HA   ILE  45           HA       ILE  45  -2.944  -3.028  -4.211
  339    HB   ILE  45           HB       ILE  45  -1.963  -0.142  -4.136
  340   HG12  ILE  45          2HG1      ILE  45  -0.299  -2.699  -4.330
  341   HG13  ILE  45          1HG1      ILE  45  -0.578  -1.578  -5.656
  342   HG21  ILE  45          1HG2      ILE  45  -1.641  -2.375  -2.082
  343   HG22  ILE  45          2HG2      ILE  45  -2.619  -0.918  -1.903
  344   HG23  ILE  45          3HG2      ILE  45  -0.864  -0.794  -1.986
  345   HD11  ILE  45          3HD1      ILE  45   1.615  -1.240  -4.721
  346   HD12  ILE  45          1HD1      ILE  45   0.939  -0.996  -3.111
  347   HD13  ILE  45          2HD1      ILE  45   0.618   0.177  -4.391
  348    H    LEU  46           H        LEU  46  -4.411   0.009  -5.243
  349    HA   LEU  46           HA       LEU  46  -6.197   0.404  -3.094
  350    HB2  LEU  46           2HB      LEU  46  -6.284   1.270  -5.998
  351    HB3  LEU  46           1HB      LEU  46  -7.502   1.768  -4.834
  352    HG   LEU  46           HG       LEU  46  -4.530   2.344  -4.523
  353   HD11  LEU  46          1HD1      LEU  46  -5.020   4.672  -5.092
  354   HD12  LEU  46          2HD1      LEU  46  -6.694   4.248  -5.464
  355   HD13  LEU  46          3HD1      LEU  46  -5.376   3.597  -6.443
  356   HD21  LEU  46          3HD2      LEU  46  -5.739   2.201  -2.395
  357   HD22  LEU  46          1HD2      LEU  46  -6.918   3.385  -2.965
  358   HD23  LEU  46          2HD2      LEU  46  -5.232   3.854  -2.723
  359    H    LYS  47           H        LYS  47  -6.443  -1.605  -5.976
  360    HA   LYS  47           HA       LYS  47  -9.194  -2.408  -5.411
  361    HB2  LYS  47           2HB      LYS  47  -7.431  -2.469  -7.761
  362    HB3  LYS  47           1HB      LYS  47  -8.197  -4.032  -7.522
  363    HG2  LYS  47           2HG      LYS  47  -9.460  -2.516  -9.049
  364    HG3  LYS  47           1HG      LYS  47 -10.402  -3.066  -7.660
  365    HD2  LYS  47           2HD      LYS  47 -10.056  -0.917  -6.529
  366    HD3  LYS  47           1HD      LYS  47  -9.019  -0.357  -7.841
  367    HE2  LYS  47           2HE      LYS  47 -10.950  -0.470  -9.390
  368    HE3  LYS  47           1HE      LYS  47 -11.981  -1.011  -8.063
  369    HZ1  LYS  47           3HZ      LYS  47 -12.249   1.328  -8.416
  370    HZ2  LYS  47           1HZ      LYS  47 -10.586   1.598  -8.267
  371    HZ3  LYS  47           2HZ      LYS  47 -11.483   1.089  -6.925
  372    H    VAL  48           H        VAL  48  -6.266  -3.352  -4.131
  373    HA   VAL  48           HA       VAL  48  -6.761  -6.165  -3.871
  374    HB   VAL  48           HB       VAL  48  -5.034  -4.344  -2.129
  375   HG11  VAL  48          1HG1      VAL  48  -5.627  -6.355  -0.853
  376   HG12  VAL  48          2HG1      VAL  48  -3.933  -6.434  -1.332
  377   HG13  VAL  48          3HG1      VAL  48  -5.138  -7.390  -2.197
  378   HG21  VAL  48          3HG2      VAL  48  -3.131  -5.292  -3.388
  379   HG22  VAL  48          1HG2      VAL  48  -4.255  -4.456  -4.457
  380   HG23  VAL  48          2HG2      VAL  48  -4.247  -6.217  -4.394
  381    H    GLU  49           H        GLU  49  -8.106  -7.169  -2.579
  382    HA   GLU  49           HA       GLU  49 -10.170  -5.915  -1.202
  383    HB2  GLU  49           2HB      GLU  49 -10.777  -8.167  -0.339
  384    HB3  GLU  49           1HB      GLU  49 -10.507  -8.142  -2.070
  385    HG2  GLU  49           2HG      GLU  49  -8.454  -9.122  -0.074
  386    HG3  GLU  49           1HG      GLU  49  -9.631 -10.175  -0.847
  387    H    GLY  50           H        GLY  50 -10.535  -5.347   0.842
  388    HA2  GLY  50           2HA      GLY  50 -10.117  -5.252   3.193
  389    HA3  GLY  50           1HA      GLY  50  -8.443  -5.722   2.909
  390    H    VAL  51           H        VAL  51  -7.798  -3.977   0.814
  391    HA   VAL  51           HA       VAL  51  -6.811  -1.825   2.369
  392    HB   VAL  51           HB       VAL  51  -6.706  -2.163  -0.663
  393   HG11  VAL  51          1HG1      VAL  51  -5.004  -0.363   1.128
  394   HG12  VAL  51          2HG1      VAL  51  -6.207   0.181  -0.041
  395   HG13  VAL  51          3HG1      VAL  51  -4.742  -0.624  -0.600
  396   HG21  VAL  51          3HG2      VAL  51  -4.668  -2.963   1.461
  397   HG22  VAL  51          1HG2      VAL  51  -4.435  -3.096  -0.286
  398   HG23  VAL  51          2HG2      VAL  51  -5.669  -4.068   0.517
  399    H    LYS  52           H        LYS  52  -7.317   0.262   2.524
  400    HA   LYS  52           HA       LYS  52  -9.860   1.246   1.372
  401    HB2  LYS  52           2HB      LYS  52  -9.971   0.893   3.802
  402    HB3  LYS  52           1HB      LYS  52  -8.504   1.834   4.042
  403    HG2  LYS  52           2HG      LYS  52  -9.679   3.872   3.303
  404    HG3  LYS  52           1HG      LYS  52 -11.145   2.931   3.022
  405    HD2  LYS  52           2HD      LYS  52 -11.252   4.157   5.164
  406    HD3  LYS  52           1HD      LYS  52 -11.311   2.412   5.419
  407    HE2  LYS  52           2HE      LYS  52  -9.863   3.488   7.088
  408    HE3  LYS  52           1HE      LYS  52  -8.913   2.429   6.045
  409    HZ1  LYS  52           3HZ      LYS  52  -9.109   5.387   5.829
  410    HZ2  LYS  52           1HZ      LYS  52  -8.219   4.396   4.788
  411    HZ3  LYS  52           2HZ      LYS  52  -7.787   4.517   6.419
  412    H    SER  53           H        SER  53  -6.563   2.169   2.403
  413    HA   SER  53           HA       SER  53  -6.499   4.374   0.482
  414    HB2  SER  53           2HB      SER  53  -5.883   4.881   3.425
  415    HB3  SER  53           1HB      SER  53  -5.914   6.071   2.123
  416    HG   SER  53           HG       SER  53  -8.224   5.394   1.923
  417    H    ILE  54           H        ILE  54  -4.409   5.180   0.107
  418    HA   ILE  54           HA       ILE  54  -2.076   3.693   1.149
  419    HB   ILE  54           HB       ILE  54  -2.540   4.780  -1.682
  420   HG12  ILE  54          2HG1      ILE  54  -2.062   1.916  -0.745
  421   HG13  ILE  54          1HG1      ILE  54  -3.614   2.578  -1.247
  422   HG21  ILE  54          1HG2      ILE  54  -0.284   4.008  -2.284
  423   HG22  ILE  54          2HG2      ILE  54   0.002   3.491  -0.624
  424   HG23  ILE  54          3HG2      ILE  54  -0.199   5.203  -0.987
  425   HD11  ILE  54          3HD1      ILE  54  -1.183   2.168  -2.971
  426   HD12  ILE  54          1HD1      ILE  54  -2.668   2.965  -3.501
  427   HD13  ILE  54          2HD1      ILE  54  -2.699   1.272  -3.016
  428    H    PHE  55           H        PHE  55  -2.038   5.289   2.808
  429    HA   PHE  55           HA       PHE  55  -1.808   8.103   2.116
  430    HB2  PHE  55           2HB      PHE  55  -3.028   7.448   4.172
  431    HB3  PHE  55           1HB      PHE  55  -1.573   6.695   4.816
  432    HD1  PHE  55           HD1      PHE  55  -2.302  10.039   3.235
  433    HD2  PHE  55           HD2      PHE  55  -0.732   7.957   6.620
  434    HE1  PHE  55           HE1      PHE  55  -1.711  12.179   4.274
  435    HE2  PHE  55           HE2      PHE  55  -0.138  10.104   7.654
  436    HZ   PHE  55           HZ       PHE  55  -0.627  12.219   6.484
  437    H    HIS  56           H        HIS  56   0.014   8.173   0.852
  438    HA   HIS  56           HA       HIS  56   2.569   7.133   1.821
  439    HB2  HIS  56           2HB      HIS  56   2.167   6.868  -0.561
  440    HB3  HIS  56           1HB      HIS  56   1.774   8.572  -0.749
  441    HD1  HIS  56           HD1      HIS  56   3.593   9.238  -2.333
  442    HD2  HIS  56           HD2      HIS  56   5.101   7.344   1.042
  443    HE1  HIS  56           HE1      HIS  56   6.066   9.565  -2.434
  444    HE2  HIS  56           HE2      HIS  56   6.933   8.612  -0.281
  445    H    VAL  57           H        VAL  57   2.837   8.359   3.652
  446    HA   VAL  57           HA       VAL  57   2.980  11.275   3.447
  447    HB   VAL  57           HB       VAL  57   1.795  10.681   5.389
  448   HG11  VAL  57          1HG1      VAL  57   3.907   8.630   6.081
  449   HG12  VAL  57          2HG1      VAL  57   2.283   8.301   5.477
  450   HG13  VAL  57          3HG1      VAL  57   2.500   9.022   7.073
  451   HG21  VAL  57          3HG2      VAL  57   3.492  12.425   5.856
  452   HG22  VAL  57          1HG2      VAL  57   4.621  11.181   6.396
  453   HG23  VAL  57          2HG2      VAL  57   3.131  11.473   7.297
  454    H    MET  58           H        MET  58   4.772  11.868   2.479
  455    HA   MET  58           HA       MET  58   6.872  12.577   2.237
  456    HB2  MET  58           2HB      MET  58   6.662  12.959   4.745
  457    HB3  MET  58           1HB      MET  58   7.464  11.415   4.996
  458    HG2  MET  58           2HG      MET  58   9.108  13.123   5.269
  459    HG3  MET  58           1HG      MET  58   9.437  12.351   3.717
  460    HE1  MET  58           3HE      MET  58   6.584  15.003   4.588
  461    HE2  MET  58           1HE      MET  58   7.406  16.500   4.147
  462    HE3  MET  58           2HE      MET  58   7.980  15.552   5.517
  463    H    ASP  59           H        ASP  59   7.931   9.799   4.191
  464    HA   ASP  59           HA       ASP  59   9.411   8.775   1.825
  465    HB2  ASP  59           2HB      ASP  59  11.219   8.160   3.396
  466    HB3  ASP  59           1HB      ASP  59  10.881   9.885   3.451
  467    H    PHE  60           H        PHE  60   6.972   8.035   3.970
  468    HA   PHE  60           HA       PHE  60   7.333   5.132   3.627
  469    HB2  PHE  60           2HB      PHE  60   6.570   4.725   5.950
  470    HB3  PHE  60           1HB      PHE  60   8.095   5.587   5.887
  471    HD1  PHE  60           HD2      PHE  60   7.907   8.236   6.094
  472    HD2  PHE  60           HD1      PHE  60   4.907   5.513   7.452
  473    HE1  PHE  60           HE2      PHE  60   7.062   9.940   7.641
  474    HE2  PHE  60           HE1      PHE  60   4.066   7.222   9.006
  475    HZ   PHE  60           HZ       PHE  60   5.135   9.443   9.095
  476    H    ILE  61           H        ILE  61   5.552   4.015   3.137
  477    HA   ILE  61           HA       ILE  61   3.075   5.487   2.611
  478    HB   ILE  61           HB       ILE  61   3.822   2.637   1.805
  479   HG12  ILE  61          2HG1      ILE  61   3.999   5.207   0.154
  480   HG13  ILE  61          1HG1      ILE  61   5.358   4.246   0.722
  481   HG21  ILE  61          1HG2      ILE  61   1.390   3.026   1.901
  482   HG22  ILE  61          2HG2      ILE  61   1.923   2.801   0.237
  483   HG23  ILE  61          3HG2      ILE  61   1.555   4.422   0.831
  484   HD11  ILE  61          3HD1      ILE  61   4.643   2.389  -0.719
  485   HD12  ILE  61          1HD1      ILE  61   4.946   3.865  -1.635
  486   HD13  ILE  61          2HD1      ILE  61   3.290   3.366  -1.296
  487    H    SER  62           H        SER  62   1.886   5.580   4.418
  488    HA   SER  62           HA       SER  62   1.420   3.355   6.194
  489    HB2  SER  62           2HB      SER  62   1.432   5.816   6.903
  490    HB3  SER  62           1HB      SER  62  -0.083   6.010   6.031
  491    HG   SER  62           HG       SER  62  -0.131   3.891   7.756
  492    H    VAL  63           H        VAL  63   0.557   1.722   4.868
  493    HA   VAL  63           HA       VAL  63  -1.628   2.186   3.020
  494    HB   VAL  63           HB       VAL  63  -0.491  -0.489   3.966
  495   HG11  VAL  63          1HG1      VAL  63  -2.190   0.146   1.514
  496   HG12  VAL  63          2HG1      VAL  63  -2.714  -0.745   2.943
  497   HG13  VAL  63          3HG1      VAL  63  -1.479  -1.427   1.887
  498   HG21  VAL  63          3HG2      VAL  63   0.881  -0.506   1.916
  499   HG22  VAL  63          1HG2      VAL  63   1.291   0.871   2.941
  500   HG23  VAL  63          2HG2      VAL  63   0.302   1.108   1.498
  501    H    ASP  64           H        ASP  64  -3.429   2.837   4.095
  502    HA   ASP  64           HA       ASP  64  -4.442   1.565   6.486
  503    HB2  ASP  64           2HB      ASP  64  -5.722   3.599   4.648
  504    HB3  ASP  64           1HB      ASP  64  -6.415   3.075   6.164
  505    H    LYS  65           H        LYS  65  -6.300   0.344   6.662
  506    HA   LYS  65           HA       LYS  65  -7.892  -0.386   4.349
  507    HB2  LYS  65           2HB      LYS  65  -7.581  -2.806   4.641
  508    HB3  LYS  65           1HB      LYS  65  -6.054  -2.040   4.233
  509    HG2  LYS  65           2HG      LYS  65  -5.088  -2.554   6.244
  510    HG3  LYS  65           1HG      LYS  65  -6.597  -2.405   7.141
  511    HD2  LYS  65           2HD      LYS  65  -5.713  -4.713   7.103
  512    HD3  LYS  65           1HD      LYS  65  -7.322  -4.592   6.396
  513    HE2  LYS  65           2HE      LYS  65  -6.378  -4.730   4.143
  514    HE3  LYS  65           1HE      LYS  65  -4.736  -4.708   4.799
  515    HZ1  LYS  65           3HZ      LYS  65  -6.751  -6.795   5.381
  516    HZ2  LYS  65           1HZ      LYS  65  -5.128  -6.796   5.851
  517    HZ3  LYS  65           2HZ      LYS  65  -5.536  -6.939   4.215
  518    H    GLU  66           H        GLU  66  -9.279  -2.500   5.540
  519    HA   GLU  66           HA       GLU  66 -10.932  -1.467   7.562
  520    HB2  GLU  66           2HB      GLU  66 -10.386  -4.352   6.747
  521    HB3  GLU  66           1HB      GLU  66 -11.714  -3.853   7.789
  522    HG2  GLU  66           2HG      GLU  66 -11.327  -3.071   4.886
  523    HG3  GLU  66           1HG      GLU  66 -12.490  -4.239   5.508
  524    H    ASN  67           H        ASN  67 -11.250  -3.068   9.616
  525    HA   ASN  67           HA       ASN  67  -9.358  -2.481  11.535
  526    HB2  ASN  67           2HB      ASN  67 -10.499  -4.244  12.928
  527    HB3  ASN  67           1HB      ASN  67 -11.603  -3.117  12.156
  528   HD21  ASN  67          1HD2      ASN  67 -12.142  -5.798  13.171
  529   HD22  ASN  67          2HD2      ASN  67 -12.762  -6.706  11.838
  530    H    ASP  68           H        ASP  68  -9.619  -5.480   9.629
  531    HA   ASP  68           HA       ASP  68  -6.760  -5.849   9.702
  532    HB2  ASP  68           2HB      ASP  68  -6.797  -8.183  10.588
  533    HB3  ASP  68           1HB      ASP  68  -7.261  -6.994  11.795
  534    H    ALA  69           H        ALA  69  -9.938  -7.209   8.838
  535    HA   ALA  69           HA       ALA  69 -10.670  -8.627   7.250
  536    HB1  ALA  69           3HB      ALA  69 -10.363  -6.602   5.856
  537    HB2  ALA  69           1HB      ALA  69 -10.083  -8.074   4.920
  538    HB3  ALA  69           2HB      ALA  69  -8.716  -7.110   5.481
  539    H    ASN  70           H        ASN  70  -7.746  -8.813   5.365
  540    HA   ASN  70           HA       ASN  70  -6.223 -10.410   7.205
  541    HB2  ASN  70           2HB      ASN  70  -5.864 -12.330   5.650
  542    HB3  ASN  70           1HB      ASN  70  -7.542 -12.227   6.169
  543   HD21  ASN  70          1HD2      ASN  70  -6.359 -13.500   3.794
  544   HD22  ASN  70          2HD2      ASN  70  -7.192 -12.816   2.442
  545    H    TRP  71           H        TRP  71  -4.152  -9.677   6.993
  546    HA   TRP  71           HA       TRP  71  -3.289  -8.207   4.624
  547    HB2  TRP  71           2HB      TRP  71  -1.861  -8.973   7.197
  548    HB3  TRP  71           1HB      TRP  71  -1.038  -8.173   5.866
  549    HD1  TRP  71           HD1      TRP  71  -3.405  -7.446   8.765
  550    HE1  TRP  71           HE1      TRP  71  -3.690  -4.899   8.983
  551    HE3  TRP  71           HE3      TRP  71  -1.230  -5.996   4.367
  552    HZ2  TRP  71           HZ2      TRP  71  -3.071  -2.572   7.482
  553    HZ3  TRP  71           HZ3      TRP  71  -1.143  -3.598   3.822
  554    HH2  TRP  71           HH2      TRP  71  -2.051  -1.923   5.349
  555    H    GLU  72           H        GLU  72  -3.383 -11.464   5.612
  556    HA   GLU  72           HA       GLU  72  -1.224 -12.731   4.496
  557    HB2  GLU  72           2HB      GLU  72  -2.978 -13.900   5.779
  558    HB3  GLU  72           1HB      GLU  72  -4.135 -13.633   4.481
  559    HG2  GLU  72           2HG      GLU  72  -2.747 -15.064   2.981
  560    HG3  GLU  72           1HG      GLU  72  -1.647 -15.375   4.319
  561    H    THR  73           H        THR  73  -4.210 -11.723   2.810
  562    HA   THR  73           HA       THR  73  -3.332 -12.617   0.220
  563    HB   THR  73           HB       THR  73  -5.745 -12.510   0.775
  564    HG1  THR  73           HG1      THR  73  -6.232 -11.113  -1.241
  565   HG21  THR  73          3HG2      THR  73  -5.464  -9.480   0.647
  566   HG22  THR  73          1HG2      THR  73  -5.819 -10.413   2.103
  567   HG23  THR  73          2HG2      THR  73  -6.981 -10.372   0.775
  568    H    VAL  74           H        VAL  74  -3.261  -9.565   1.999
  569    HA   VAL  74           HA       VAL  74  -3.127  -7.837  -0.219
  570    HB   VAL  74           HB       VAL  74  -2.439  -7.306   2.700
  571   HG11  VAL  74          1HG1      VAL  74  -2.888  -5.286   0.461
  572   HG12  VAL  74          2HG1      VAL  74  -1.375  -5.575   1.321
  573   HG13  VAL  74          3HG1      VAL  74  -2.755  -4.891   2.177
  574   HG21  VAL  74          3HG2      VAL  74  -4.704  -6.306   2.800
  575   HG22  VAL  74          1HG2      VAL  74  -4.772  -8.012   2.361
  576   HG23  VAL  74          2HG2      VAL  74  -4.993  -6.772   1.123
  577    H    LEU  75           H        LEU  75  -0.517  -8.954   1.986
  578    HA   LEU  75           HA       LEU  75   1.502  -7.289   1.026
  579    HB2  LEU  75           2HB      LEU  75   1.564  -9.879   2.543
  580    HB3  LEU  75           1HB      LEU  75   3.074  -9.286   1.875
  581    HG   LEU  75           HG       LEU  75   2.801  -7.161   3.161
  582   HD11  LEU  75          1HD1      LEU  75   0.363  -8.480   4.381
  583   HD12  LEU  75          2HD1      LEU  75   0.382  -7.052   3.343
  584   HD13  LEU  75          3HD1      LEU  75   1.114  -6.987   4.943
  585   HD21  LEU  75          3HD2      LEU  75   3.336  -8.048   5.382
  586   HD22  LEU  75          1HD2      LEU  75   4.142  -8.993   4.132
  587   HD23  LEU  75          2HD2      LEU  75   2.704  -9.633   4.931
  588    HA   PRO  76           HA       PRO  76   2.827 -11.009  -2.182
  589    HB2  PRO  76           2HB      PRO  76  -0.123 -11.543  -2.685
  590    HB3  PRO  76           1HB      PRO  76   1.272 -12.612  -2.974
  591    HG2  PRO  76           2HG      PRO  76  -0.218 -12.964  -0.823
  592    HG3  PRO  76           1HG      PRO  76   1.554 -13.090  -0.702
  593    HD2  PRO  76           2HD      PRO  76  -0.257 -10.910   0.253
  594    HD3  PRO  76           1HD      PRO  76   1.303 -11.449   0.908
  595    H    LYS  77           H        LYS  77  -0.125  -8.981  -2.453
  596    HA   LYS  77           HA       LYS  77   0.275  -8.375  -5.260
  597    HB2  LYS  77           2HB      LYS  77  -1.648  -7.249  -3.186
  598    HB3  LYS  77           1HB      LYS  77  -1.593  -6.663  -4.840
  599    HG2  LYS  77           2HG      LYS  77  -3.432  -8.180  -4.655
  600    HG3  LYS  77           1HG      LYS  77  -2.192  -8.950  -5.643
  601    HD2  LYS  77           2HD      LYS  77  -1.533 -10.381  -3.786
  602    HD3  LYS  77           1HD      LYS  77  -2.610  -9.520  -2.687
  603    HE2  LYS  77           2HE      LYS  77  -3.527 -11.166  -5.075
  604    HE3  LYS  77           1HE      LYS  77  -3.513 -11.727  -3.404
  605    HZ1  LYS  77           3HZ      LYS  77  -5.076  -9.409  -4.397
  606    HZ2  LYS  77           1HZ      LYS  77  -5.102 -10.033  -2.827
  607    HZ3  LYS  77           2HZ      LYS  77  -5.697 -10.953  -4.116
  608    H    VAL  78           H        VAL  78   0.676  -6.622  -2.195
  609    HA   VAL  78           HA       VAL  78   1.299  -4.066  -3.269
  610    HB   VAL  78           HB       VAL  78   1.987  -5.207  -0.517
  611   HG11  VAL  78          1HG1      VAL  78   3.394  -3.241  -0.992
  612   HG12  VAL  78          2HG1      VAL  78   2.195  -2.846   0.238
  613   HG13  VAL  78          3HG1      VAL  78   1.967  -2.294  -1.423
  614   HG21  VAL  78          3HG2      VAL  78  -0.380  -3.489  -1.359
  615   HG22  VAL  78          1HG2      VAL  78  -0.024  -4.033   0.280
  616   HG23  VAL  78          2HG2      VAL  78  -0.445  -5.208  -0.965
  617    H    GLU  79           H        GLU  79   3.373  -6.597  -1.878
  618    HA   GLU  79           HA       GLU  79   5.858  -5.366  -2.231
  619    HB2  GLU  79           2HB      GLU  79   5.163  -8.328  -2.163
  620    HB3  GLU  79           1HB      GLU  79   6.796  -7.685  -2.007
  621    HG2  GLU  79           2HG      GLU  79   6.178  -6.530   0.056
  622    HG3  GLU  79           1HG      GLU  79   4.514  -7.087  -0.107
  623    H    ALA  80           H        ALA  80   3.899  -7.304  -4.448
  624    HA   ALA  80           HA       ALA  80   5.784  -7.907  -6.448
  625    HB1  ALA  80           3HB      ALA  80   3.844  -8.293  -7.919
  626    HB2  ALA  80           1HB      ALA  80   2.797  -7.447  -6.768
  627    HB3  ALA  80           2HB      ALA  80   3.564  -8.966  -6.314
  628    H    VAL  81           H        VAL  81   3.860  -4.999  -5.902
  629    HA   VAL  81           HA       VAL  81   4.444  -3.609  -8.319
  630    HB   VAL  81           HB       VAL  81   3.614  -2.643  -5.549
  631   HG11  VAL  81          1HG1      VAL  81   3.009  -0.454  -6.579
  632   HG12  VAL  81          2HG1      VAL  81   3.794  -0.956  -8.077
  633   HG13  VAL  81          3HG1      VAL  81   4.749  -0.752  -6.610
  634   HG21  VAL  81          3HG2      VAL  81   1.382  -2.364  -6.591
  635   HG22  VAL  81          1HG2      VAL  81   1.943  -4.033  -6.712
  636   HG23  VAL  81          2HG2      VAL  81   2.013  -2.971  -8.121
  637    H    PHE  82           H        PHE  82   5.981  -3.547  -5.102
  638    HA   PHE  82           HA       PHE  82   8.288  -2.029  -5.996
  639    HB2  PHE  82           2HB      PHE  82   7.868  -3.554  -3.388
  640    HB3  PHE  82           1HB      PHE  82   9.045  -2.271  -3.679
  641    HD1  PHE  82           HD1      PHE  82   8.204   0.091  -4.157
  642    HD2  PHE  82           HD2      PHE  82   5.617  -3.032  -2.807
  643    HE1  PHE  82           HE1      PHE  82   6.477   1.749  -3.596
  644    HE2  PHE  82           HE2      PHE  82   3.914  -1.374  -2.241
  645    HZ   PHE  82           HZ       PHE  82   4.335   0.989  -2.656
  646    H    GLU  83           H        GLU  83   7.545  -5.060  -6.870
  647    HA   GLU  83           HA       GLU  83  10.335  -6.037  -6.850
  648    HB2  GLU  83           2HB      GLU  83   8.945  -7.168  -5.053
  649    HB3  GLU  83           1HB      GLU  83   7.886  -7.785  -6.307
  650    HG2  GLU  83           2HG      GLU  83   9.878  -9.006  -7.265
  651    HG3  GLU  83           1HG      GLU  83  10.801  -8.485  -5.857
  652    H    LEU  84           H        LEU  84   9.534  -4.656  -8.920
  653    HA   LEU  84           HA       LEU  84   8.268  -6.293 -10.985
  654    HB2  LEU  84           2HB      LEU  84   9.321  -3.444 -11.047
  655    HB3  LEU  84           1HB      LEU  84   8.539  -4.228 -12.410
  656    HG   LEU  84           HG       LEU  84   7.224  -3.623  -9.726
  657   HD11  LEU  84          1HD1      LEU  84   7.613  -1.594 -11.066
  658   HD12  LEU  84          2HD1      LEU  84   5.896  -1.954 -10.907
  659   HD13  LEU  84          3HD1      LEU  84   6.736  -2.316 -12.418
  660   HD21  LEU  84          3HD2      LEU  84   6.283  -5.670 -10.697
  661   HD22  LEU  84          1HD2      LEU  84   5.981  -4.832 -12.222
  662   HD23  LEU  84          2HD2      LEU  84   5.110  -4.359 -10.760
  663    H    GLU  85           H        GLU  85  10.979  -7.058  -9.914
  664    HA   GLU  85           HA       GLU  85  12.784  -7.007 -12.134
  665    HB2  GLU  85           2HB      GLU  85  13.560  -7.524  -9.837
  666    HB3  GLU  85           1HB      GLU  85  12.563  -8.973  -9.806
  667    HG2  GLU  85           2HG      GLU  85  13.936  -9.861 -11.736
  668    HG3  GLU  85           1HG      GLU  85  14.996  -8.464 -11.554
  669    H    HIS  86           H        HIS  86  12.105  -7.804 -14.051
  670    HA   HIS  86           HA       HIS  86  10.224 -10.062 -14.199
  671    HB2  HIS  86           2HB      HIS  86  11.262  -8.309 -16.473
  672    HB3  HIS  86           1HB      HIS  86   9.881  -9.404 -16.525
  673    HD1  HIS  86           HD1      HIS  86  10.511  -5.957 -16.390
  674    HD2  HIS  86           HD2      HIS  86   7.911  -8.456 -14.333
  675    HE1  HIS  86           HE1      HIS  86   8.722  -4.457 -15.479
  676    HE2  HIS  86           HE2      HIS  86   7.084  -6.006 -14.364
  677    H    HIS  87           H        HIS  87  13.472  -9.099 -15.193
  678    HA   HIS  87           HA       HIS  87  14.442 -11.811 -15.317
  679    HB2  HIS  87           2HB      HIS  87  13.459 -11.696 -17.580
  680    HB3  HIS  87           1HB      HIS  87  14.303 -10.189 -17.905
  681    HD1  HIS  87           HD1      HIS  87  16.221 -10.563 -19.420
  682    HD2  HIS  87           HD2      HIS  87  15.621 -13.831 -16.924
  683    HE1  HIS  87           HE1      HIS  87  17.988 -12.230 -20.057
  684    HE2  HIS  87           HE2      HIS  87  17.492 -14.261 -18.661
  685    H    HIS  88           H        HIS  88  14.972  -8.412 -16.123
  686    HA   HIS  88           HA       HIS  88  17.838  -8.504 -15.559
  687    HB2  HIS  88           2HB      HIS  88  16.894  -7.180 -17.488
  688    HB3  HIS  88           1HB      HIS  88  16.052  -6.145 -16.347
  689    HD1  HIS  88           HD1      HIS  88  17.465  -4.345 -15.132
  690    HD2  HIS  88           HD2      HIS  88  19.681  -6.757 -17.689
  691    HE1  HIS  88           HE1      HIS  88  19.688  -3.210 -15.372
  692    HE2  HIS  88           HE2      HIS  88  21.060  -4.757 -16.798
  693    H    HIS  89           H        HIS  89  18.736  -7.838 -13.668
  694    HA   HIS  89           HA       HIS  89  17.124  -7.291 -11.341
  695    HB2  HIS  89           2HB      HIS  89  20.158  -7.124 -11.682
  696    HB3  HIS  89           1HB      HIS  89  19.301  -7.115 -10.145
  697    HD1  HIS  89           HD1      HIS  89  20.621  -9.384 -12.768
  698    HD2  HIS  89           HD2      HIS  89  18.303  -9.650  -9.327
  699    HE1  HIS  89           HE1      HIS  89  20.567 -11.825 -12.176
  700    HE2  HIS  89           HE2      HIS  89  19.100 -11.974 -10.137
  701    H    HIS  90           H        HIS  90  17.063  -5.324 -10.125
  702    HA   HIS  90           HA       HIS  90  18.439  -2.951 -11.208
  703    HB2  HIS  90           2HB      HIS  90  16.127  -2.844 -12.118
  704    HB3  HIS  90           1HB      HIS  90  15.468  -2.974 -10.488
  705    HD1  HIS  90           HD1      HIS  90  15.134  -0.803  -9.251
  706    HD2  HIS  90           HD2      HIS  90  17.667  -0.353 -12.517
  707    HE1  HIS  90           HE1      HIS  90  15.585   1.666  -9.421
  708    HE2  HIS  90           HE2      HIS  90  17.155   1.909 -11.374
  709    H    HIS  91           H        HIS  91  19.862  -2.886  -9.527
  710    HA   HIS  91           HA       HIS  91  18.930  -1.643  -7.094
  711    HB2  HIS  91           2HB      HIS  91  18.762  -4.009  -6.388
  712    HB3  HIS  91           1HB      HIS  91  20.415  -4.313  -6.911
  713    HD1  HIS  91           HD1      HIS  91  18.572  -2.124  -4.402
  714    HD2  HIS  91           HD2      HIS  91  22.255  -3.997  -4.909
  715    HE1  HIS  91           HE1      HIS  91  19.848  -1.689  -2.283
  716    HE2  HIS  91           HE2      HIS  91  22.064  -2.838  -2.597
  Start of MODEL    7
    1    H1   MET   1           1H       MET   1  12.774   1.269  -2.136
    2    H2   MET   1           2H       MET   1  12.707   2.623  -3.130
    3    H3   MET   1           3H       MET   1  12.670   1.078  -3.805
    4    HA   MET   1           HA       MET   1  10.611   2.209  -2.012
    5    HB2  MET   1           2HB      MET   1  10.577   1.833  -5.043
    6    HB3  MET   1           1HB      MET   1   9.193   2.342  -4.080
    7    HG2  MET   1           2HG      MET   1  10.338   4.395  -3.446
    8    HG3  MET   1           1HG      MET   1  11.800   3.870  -4.286
    9    HE1  MET   1           3HE      MET   1  11.965   6.117  -5.664
   10    HE2  MET   1           1HE      MET   1  10.548   6.738  -4.817
   11    HE3  MET   1           2HE      MET   1  10.628   6.812  -6.578
   12    H    LYS   2           H        LYS   2  12.188  -0.546  -2.615
   13    HA   LYS   2           HA       LYS   2   9.957  -2.345  -3.213
   14    HB2  LYS   2           2HB      LYS   2  11.721  -4.085  -3.338
   15    HB3  LYS   2           1HB      LYS   2  12.105  -2.700  -4.356
   16    HG2  LYS   2           2HG      LYS   2  13.745  -1.898  -2.783
   17    HG3  LYS   2           1HG      LYS   2  13.245  -3.077  -1.569
   18    HD2  LYS   2           2HD      LYS   2  14.078  -4.910  -3.019
   19    HD3  LYS   2           1HD      LYS   2  14.589  -3.721  -4.224
   20    HE2  LYS   2           2HE      LYS   2  16.215  -2.780  -2.669
   21    HE3  LYS   2           1HE      LYS   2  15.627  -3.813  -1.366
   22    HZ1  LYS   2           3HZ      LYS   2  17.659  -4.668  -2.313
   23    HZ2  LYS   2           1HZ      LYS   2  16.961  -4.735  -3.850
   24    HZ3  LYS   2           2HZ      LYS   2  16.387  -5.738  -2.619
   25    H    ILE   3           H        ILE   3   9.604  -1.064  -0.755
   26    HA   ILE   3           HA       ILE   3   9.164  -1.295   1.435
   27    HB   ILE   3           HB       ILE   3   8.903  -4.243   0.745
   28   HG12  ILE   3          2HG1      ILE   3   6.817  -2.016   0.613
   29   HG13  ILE   3          1HG1      ILE   3   7.528  -2.851  -0.760
   30   HG21  ILE   3          1HG2      ILE   3   7.668  -2.676   3.050
   31   HG22  ILE   3          2HG2      ILE   3   8.962  -3.865   3.184
   32   HG23  ILE   3          3HG2      ILE   3   7.351  -4.377   2.685
   33   HD11  ILE   3          3HD1      ILE   3   5.282  -3.624  -0.321
   34   HD12  ILE   3          1HD1      ILE   3   5.728  -4.075   1.325
   35   HD13  ILE   3          2HD1      ILE   3   6.440  -4.923  -0.050
   36    H    ILE   4           H        ILE   4  10.861  -0.800   2.682
   37    HA   ILE   4           HA       ILE   4  13.208  -2.459   2.995
   38    HB   ILE   4           HB       ILE   4  12.369   0.220   4.159
   39   HG12  ILE   4          2HG1      ILE   4  13.040   0.236   1.792
   40   HG13  ILE   4          1HG1      ILE   4  14.210   1.111   2.768
   41   HG21  ILE   4          1HG2      ILE   4  14.987  -1.204   4.752
   42   HG22  ILE   4          2HG2      ILE   4  13.708  -0.840   5.909
   43   HG23  ILE   4          3HG2      ILE   4  14.622   0.474   5.168
   44   HD11  ILE   4          3HD1      ILE   4  15.702  -0.852   2.689
   45   HD12  ILE   4          1HD1      ILE   4  15.331  -0.198   1.094
   46   HD13  ILE   4          2HD1      ILE   4  14.534  -1.670   1.646
   47    H    SER   5           H        SER   5  10.530  -1.342   5.080
   48    HA   SER   5           HA       SER   5  10.904  -3.630   6.839
   49    HB2  SER   5           2HB      SER   5  12.468  -1.758   7.635
   50    HB3  SER   5           1HB      SER   5  11.024  -0.831   8.033
   51    HG   SER   5           HG       SER   5  11.957  -3.245   9.144
   52    H    ILE   6           H        ILE   6   9.147  -4.049   8.166
   53    HA   ILE   6           HA       ILE   6   6.600  -2.974   7.165
   54    HB   ILE   6           HB       ILE   6   7.272  -5.525   8.693
   55   HG12  ILE   6          2HG1      ILE   6   7.933  -5.506   6.283
   56   HG13  ILE   6          1HG1      ILE   6   6.692  -6.700   6.622
   57   HG21  ILE   6          1HG2      ILE   6   4.532  -4.623   7.732
   58   HG22  ILE   6          2HG2      ILE   6   5.047  -4.794   9.411
   59   HG23  ILE   6          3HG2      ILE   6   4.913  -6.220   8.382
   60   HD11  ILE   6          3HD1      ILE   6   6.306  -5.580   4.505
   61   HD12  ILE   6          1HD1      ILE   6   6.242  -4.014   5.313
   62   HD13  ILE   6          2HD1      ILE   6   5.001  -5.228   5.637
   63    H    SER   7           H        SER   7   6.084  -1.239   8.265
   64    HA   SER   7           HA       SER   7   4.950  -0.033   9.736
   65    HB2  SER   7           2HB      SER   7   3.713  -2.170  10.097
   66    HB3  SER   7           1HB      SER   7   4.743  -2.483  11.493
   67    HG   SER   7           HG       SER   7   3.116  -1.441  12.399
   68    H    GLU   8           H        GLU   8   5.353   1.425  11.239
   69    HA   GLU   8           HA       GLU   8   7.344   0.968  13.367
   70    HB2  GLU   8           2HB      GLU   8   6.598   3.399  11.751
   71    HB3  GLU   8           1HB      GLU   8   7.196   3.611  13.375
   72    HG2  GLU   8           2HG      GLU   8   8.699   2.183  11.166
   73    HG3  GLU   8           1HG      GLU   8   8.925   3.875  11.595
   74    H    THR   9           H        THR   9   4.207   1.121  12.741
   75    HA   THR   9           HA       THR   9   3.253   2.471  15.169
   76    HB   THR   9           HB       THR   9   1.612   1.632  12.725
   77    HG1  THR   9           HG1      THR   9   3.014   4.079  13.206
   78   HG21  THR   9          3HG2      THR   9   0.033   3.365  13.491
   79   HG22  THR   9          1HG2      THR   9   1.101   3.764  14.841
   80   HG23  THR   9          2HG2      THR   9   0.310   2.188  14.777
   81    HA   PRO  10           HA       PRO  10   2.318  -1.783  16.556
   82    HB2  PRO  10           2HB      PRO  10   1.011  -1.209  18.898
   83    HB3  PRO  10           1HB      PRO  10   2.770  -1.024  18.726
   84    HG2  PRO  10           2HG      PRO  10   0.629   1.085  18.529
   85    HG3  PRO  10           1HG      PRO  10   2.176   1.129  19.408
   86    HD2  PRO  10           2HD      PRO  10   1.883   2.299  16.967
   87    HD3  PRO  10           1HD      PRO  10   3.422   1.573  17.486
   88    H    ASN  11           H        ASN  11   0.109   0.531  15.484
   89    HA   ASN  11           HA       ASN  11  -2.352  -0.909  15.873
   90    HB2  ASN  11           2HB      ASN  11  -2.377   1.548  15.673
   91    HB3  ASN  11           1HB      ASN  11  -1.681   1.453  14.059
   92   HD21  ASN  11          1HD2      ASN  11  -3.397   2.536  13.111
   93   HD22  ASN  11          2HD2      ASN  11  -4.980   1.863  12.952
   94    H    HIS  12           H        HIS  12  -2.985  -2.608  14.711
   95    HA   HIS  12           HA       HIS  12  -1.464  -3.628  12.490
   96    HB2  HIS  12           2HB      HIS  12  -3.066  -5.530  12.562
   97    HB3  HIS  12           1HB      HIS  12  -2.410  -5.160  14.149
   98    HD1  HIS  12           HD1      HIS  12  -4.078  -4.692  15.988
   99    HD2  HIS  12           HD2      HIS  12  -5.821  -4.690  12.222
  100    HE1  HIS  12           HE1      HIS  12  -6.548  -4.504  16.389
  101    HE2  HIS  12           HE2      HIS  12  -7.579  -4.426  14.084
  102    H    ASN  13           H        ASN  13  -4.206  -1.551  12.741
  103    HA   ASN  13           HA       ASN  13  -5.603  -2.186  10.341
  104    HB2  ASN  13           2HB      ASN  13  -5.459   0.527  11.732
  105    HB3  ASN  13           1HB      ASN  13  -6.666   0.028  10.551
  106   HD21  ASN  13          1HD2      ASN  13  -8.306   0.501  12.055
  107   HD22  ASN  13          2HD2      ASN  13  -8.654  -0.552  13.380
  108    H    THR  14           H        THR  14  -3.262   0.434  11.078
  109    HA   THR  14           HA       THR  14  -2.608   0.562   8.197
  110    HB   THR  14           HB       THR  14  -3.726   2.626   8.880
  111    HG1  THR  14           HG1      THR  14  -2.327   3.163   7.390
  112   HG21  THR  14          3HG2      THR  14  -3.136   2.678  11.298
  113   HG22  THR  14          1HG2      THR  14  -2.724   4.197  10.498
  114   HG23  THR  14          2HG2      THR  14  -1.459   3.028  10.880
  115    H    MET  15           H        MET  15  -0.609   0.027   7.636
  116    HA   MET  15           HA       MET  15   1.527  -0.011   9.703
  117    HB2  MET  15           2HB      MET  15   1.276  -1.666   7.160
  118    HB3  MET  15           1HB      MET  15   2.716  -1.634   8.172
  119    HG2  MET  15           2HG      MET  15   1.208  -2.424  10.085
  120    HG3  MET  15           1HG      MET  15  -0.000  -2.756   8.843
  121    HE1  MET  15           3HE      MET  15   2.274  -5.259   6.591
  122    HE2  MET  15           1HE      MET  15   2.504  -3.513   6.539
  123    HE3  MET  15           2HE      MET  15   0.877  -4.188   6.535
  124    H    LYS  16           H        LYS  16   3.276   1.094   9.444
  125    HA   LYS  16           HA       LYS  16   3.685   3.022   7.323
  126    HB2  LYS  16           2HB      LYS  16   4.133   3.509   9.724
  127    HB3  LYS  16           1HB      LYS  16   5.324   2.232   9.791
  128    HG2  LYS  16           2HG      LYS  16   5.724   4.611   7.973
  129    HG3  LYS  16           1HG      LYS  16   6.083   4.722   9.691
  130    HD2  LYS  16           2HD      LYS  16   7.591   2.667   9.341
  131    HD3  LYS  16           1HD      LYS  16   7.407   2.955   7.611
  132    HE2  LYS  16           2HE      LYS  16   8.505   5.001   9.575
  133    HE3  LYS  16           1HE      LYS  16   9.509   3.910   8.628
  134    HZ1  LYS  16           3HZ      LYS  16   8.632   4.935   6.610
  135    HZ2  LYS  16           1HZ      LYS  16   9.382   6.074   7.608
  136    HZ3  LYS  16           2HZ      LYS  16   7.701   5.993   7.541
  137    H    ILE  17           H        ILE  17   4.061   1.772   5.411
  138    HA   ILE  17           HA       ILE  17   6.108  -0.276   5.358
  139    HB   ILE  17           HB       ILE  17   4.560   1.087   3.107
  140   HG12  ILE  17          2HG1      ILE  17   4.408  -1.724   4.308
  141   HG13  ILE  17          1HG1      ILE  17   3.228  -0.437   4.519
  142   HG21  ILE  17          1HG2      ILE  17   6.565  -1.190   2.838
  143   HG22  ILE  17          2HG2      ILE  17   6.765   0.451   2.222
  144   HG23  ILE  17          3HG2      ILE  17   5.513  -0.591   1.553
  145   HD11  ILE  17          3HD1      ILE  17   2.410  -2.076   2.955
  146   HD12  ILE  17          1HD1      ILE  17   3.853  -1.903   1.955
  147   HD13  ILE  17          2HD1      ILE  17   2.713  -0.564   2.100
  148    H    THR  18           H        THR  18   7.988   0.520   5.970
  149    HA   THR  18           HA       THR  18   9.056   3.071   5.507
  150    HB   THR  18           HB       THR  18  10.668   0.546   6.083
  151    HG1  THR  18           HG1      THR  18  10.150   0.903   8.266
  152   HG21  THR  18          3HG2      THR  18  12.130   2.077   7.350
  153   HG22  THR  18          1HG2      THR  18  11.099   3.442   6.910
  154   HG23  THR  18          2HG2      THR  18  12.015   2.590   5.665
  155    H    LEU  19           H        LEU  19  10.060   3.915   3.730
  156    HA   LEU  19           HA       LEU  19  11.309   2.092   1.755
  157    HB2  LEU  19           2HB      LEU  19  10.241   4.907   1.278
  158    HB3  LEU  19           1HB      LEU  19  10.965   3.851   0.072
  159    HG   LEU  19           HG       LEU  19   8.263   3.513   1.436
  160   HD11  LEU  19          1HD1      LEU  19   7.354   3.653  -0.832
  161   HD12  LEU  19          2HD1      LEU  19   8.981   3.896  -1.476
  162   HD13  LEU  19          3HD1      LEU  19   8.265   5.103  -0.403
  163   HD21  LEU  19          3HD2      LEU  19   7.940   1.456   0.101
  164   HD22  LEU  19          1HD2      LEU  19   9.243   1.280   1.277
  165   HD23  LEU  19          2HD2      LEU  19   9.622   1.537  -0.427
  166    H    SER  20           H        SER  20  13.361   2.722   0.922
  167    HA   SER  20           HA       SER  20  15.098   3.892   2.919
  168    HB2  SER  20           2HB      SER  20  15.707   1.890   1.503
  169    HB3  SER  20           1HB      SER  20  15.802   2.951   0.103
  170    HG   SER  20           HG       SER  20  17.453   2.860   2.387
  171    H    GLU  21           H        GLU  21  13.296   5.093   0.343
  172    HA   GLU  21           HA       GLU  21  15.044   7.326  -0.351
  173    HB2  GLU  21           2HB      GLU  21  12.295   6.574  -1.443
  174    HB3  GLU  21           1HB      GLU  21  13.365   7.806  -2.094
  175    HG2  GLU  21           2HG      GLU  21  13.459   5.861  -3.517
  176    HG3  GLU  21           1HG      GLU  21  15.007   6.037  -2.694
  177    H    SER  22           H        SER  22  14.720   7.752   2.068
  178    HA   SER  22           HA       SER  22  12.335   9.175   2.863
  179    HB2  SER  22           2HB      SER  22  15.075   8.956   4.198
  180    HB3  SER  22           1HB      SER  22  13.593   9.535   4.956
  181    HG   SER  22           HG       SER  22  13.294   7.083   3.804
  182    H    ARG  23           H        ARG  23  13.275  11.436   4.124
  183    HA   ARG  23           HA       ARG  23  13.656  13.652   3.844
  184    HB2  ARG  23           2HB      ARG  23  15.207  12.948   1.304
  185    HB3  ARG  23           1HB      ARG  23  15.186  14.521   2.096
  186    HG2  ARG  23           2HG      ARG  23  16.406  13.638   3.996
  187    HG3  ARG  23           1HG      ARG  23  16.293  11.995   3.360
  188    HD2  ARG  23           2HD      ARG  23  17.687  12.612   1.444
  189    HD3  ARG  23           1HD      ARG  23  17.739  14.288   2.001
  190    HE   ARG  23           HE       ARG  23  18.715  12.648   4.053
  191   HH11  ARG  23          1HH1      ARG  23  19.696  13.637   0.824
  192   HH12  ARG  23          2HH1      ARG  23  21.388  13.466   1.160
  193   HH21  ARG  23          1HH2      ARG  23  20.947  12.467   4.478
  194   HH22  ARG  23          2HH2      ARG  23  22.095  12.806   3.226
  195    H    GLU  24           H        GLU  24  13.154  15.483   2.253
  196    HA   GLU  24           HA       GLU  24  11.947  16.622   0.756
  197    HB2  GLU  24           2HB      GLU  24  12.940  15.130  -0.950
  198    HB3  GLU  24           1HB      GLU  24  11.644  13.964  -0.707
  199    HG2  GLU  24           2HG      GLU  24  10.006  15.644  -1.530
  200    HG3  GLU  24           1HG      GLU  24  11.329  16.774  -1.828
  201    H    GLY  25           H        GLY  25  10.137  13.547   0.681
  202    HA2  GLY  25           2HA      GLY  25   8.026  13.977   2.317
  203    HA3  GLY  25           1HA      GLY  25   7.600  14.904   0.882
  204    H    MET  26           H        MET  26   9.155  12.921  -0.762
  205    HA   MET  26           HA       MET  26   8.523  11.398  -2.315
  206    HB2  MET  26           2HB      MET  26   9.774  10.125  -0.616
  207    HB3  MET  26           1HB      MET  26   8.281   9.757   0.231
  208    HG2  MET  26           2HG      MET  26   9.154   7.863  -1.122
  209    HG3  MET  26           1HG      MET  26   7.525   8.351  -1.583
  210    HE1  MET  26           3HE      MET  26  11.290   9.377  -4.081
  211    HE2  MET  26           1HE      MET  26  11.346   8.375  -2.632
  212    HE3  MET  26           2HE      MET  26  10.968  10.093  -2.502
  213    H    THR  27           H        THR  27   6.622  12.693  -2.765
  214    HA   THR  27           HA       THR  27   4.478  13.298  -2.993
  215    HB   THR  27           HB       THR  27   2.880  11.544  -3.736
  216    HG1  THR  27           HG1      THR  27   4.115   9.907  -2.280
  217   HG21  THR  27          3HG2      THR  27   4.461  12.526  -5.372
  218   HG22  THR  27          1HG2      THR  27   4.095  10.843  -5.753
  219   HG23  THR  27          2HG2      THR  27   5.634  11.260  -4.996
  220    H    SER  28           H        SER  28   3.608  14.241  -1.273
  221    HA   SER  28           HA       SER  28   2.792  12.740   1.110
  222    HB2  SER  28           2HB      SER  28   2.370  15.041   2.066
  223    HB3  SER  28           1HB      SER  28   4.034  14.795   1.545
  224    HG   SER  28           HG       SER  28   2.185  15.916  -0.248
  225    H    ASP  29           H        ASP  29   1.175  11.613  -0.193
  226    HA   ASP  29           HA       ASP  29  -1.288  13.155  -0.777
  227    HB2  ASP  29           2HB      ASP  29   0.087  10.997  -2.408
  228    HB3  ASP  29           1HB      ASP  29  -1.642  11.267  -2.580
  229    H    THR  30           H        THR  30  -3.211  11.800  -0.951
  230    HA   THR  30           HA       THR  30  -3.279   9.520   0.930
  231    HB   THR  30           HB       THR  30  -5.529  11.564   0.612
  232    HG1  THR  30           HG1      THR  30  -3.190  11.779   2.022
  233   HG21  THR  30          3HG2      THR  30  -6.342  10.636   2.749
  234   HG22  THR  30          1HG2      THR  30  -4.976   9.506   2.793
  235   HG23  THR  30          2HG2      THR  30  -6.205   9.368   1.536
  236    H    TYR  31           H        TYR  31  -3.338   7.951  -0.605
  237    HA   TYR  31           HA       TYR  31  -4.911   8.121  -3.038
  238    HB2  TYR  31           2HB      TYR  31  -3.323   5.760  -1.934
  239    HB3  TYR  31           1HB      TYR  31  -3.912   5.949  -3.579
  240    HD1  TYR  31           HD2      TYR  31  -1.440   7.226  -1.104
  241    HD2  TYR  31           HD1      TYR  31  -2.612   7.178  -5.211
  242    HE1  TYR  31           HE2      TYR  31   0.697   8.208  -1.746
  243    HE2  TYR  31           HE1      TYR  31  -0.449   8.156  -5.830
  244    HH   TYR  31           HH       TYR  31   1.378   9.517  -4.752
  245    H    THR  32           H        THR  32  -7.066   8.047  -2.507
  246    HA   THR  32           HA       THR  32  -8.111   5.705  -1.022
  247    HB   THR  32           HB       THR  32 -10.033   7.266  -0.360
  248    HG1  THR  32           HG1      THR  32  -9.718   9.464  -0.640
  249   HG21  THR  32          3HG2      THR  32  -8.839   8.386   1.478
  250   HG22  THR  32          1HG2      THR  32  -7.294   8.072   0.680
  251   HG23  THR  32          2HG2      THR  32  -8.264   6.728   1.284
  252    H    LYS  33           H        LYS  33  -9.191   8.304  -3.242
  253    HA   LYS  33           HA       LYS  33 -11.424   6.707  -4.115
  254    HB2  LYS  33           2HB      LYS  33 -12.131   8.737  -5.352
  255    HB3  LYS  33           1HB      LYS  33 -11.759   9.082  -3.664
  256    HG2  LYS  33           2HG      LYS  33  -9.545   9.971  -4.324
  257    HG3  LYS  33           1HG      LYS  33  -9.915   9.628  -6.016
  258    HD2  LYS  33           2HD      LYS  33 -11.450  11.560  -4.231
  259    HD3  LYS  33           1HD      LYS  33 -10.236  12.021  -5.427
  260    HE2  LYS  33           2HE      LYS  33 -11.652  11.088  -7.221
  261    HE3  LYS  33           1HE      LYS  33 -12.865  10.619  -6.031
  262    HZ1  LYS  33           3HZ      LYS  33 -13.416  12.674  -7.151
  263    HZ2  LYS  33           1HZ      LYS  33 -11.998  13.400  -6.585
  264    HZ3  LYS  33           2HZ      LYS  33 -13.201  12.925  -5.495
  265    H    VAL  34           H        VAL  34  -8.344   6.691  -5.093
  266    HA   VAL  34           HA       VAL  34  -7.104   6.027  -6.865
  267    HB   VAL  34           HB       VAL  34  -9.720   4.932  -7.997
  268   HG11  VAL  34          1HG1      VAL  34  -8.330   3.190  -9.082
  269   HG12  VAL  34          2HG1      VAL  34  -6.879   3.947  -8.419
  270   HG13  VAL  34          3HG1      VAL  34  -7.858   4.811  -9.602
  271   HG21  VAL  34          3HG2      VAL  34  -9.504   4.148  -5.683
  272   HG22  VAL  34          1HG2      VAL  34  -7.871   3.567  -6.010
  273   HG23  VAL  34          2HG2      VAL  34  -9.253   2.804  -6.800
  274    H    ASP  35           H        ASP  35  -6.735   6.396  -9.279
  275    HA   ASP  35           HA       ASP  35  -6.608   7.647 -11.153
  276    HB2  ASP  35           2HB      ASP  35  -9.497   8.416 -10.516
  277    HB3  ASP  35           1HB      ASP  35  -8.672   8.833 -12.013
  278    H    ASP  36           H        ASP  36  -5.018   9.087 -10.550
  279    HA   ASP  36           HA       ASP  36  -5.853  11.855 -10.207
  280    HB2  ASP  36           2HB      ASP  36  -5.660  11.091  -7.840
  281    HB3  ASP  36           1HB      ASP  36  -4.014  10.543  -8.137
  282    H    SER  37           H        SER  37  -2.792  10.118  -9.646
  283    HA   SER  37           HA       SER  37  -1.623  10.722 -12.179
  284    HB2  SER  37           2HB      SER  37  -1.586  13.001 -11.034
  285    HB3  SER  37           1HB      SER  37  -0.519  12.311  -9.815
  286    HG   SER  37           HG       SER  37  -0.033  12.838 -12.534
  287    H    GLN  38           H        GLN  38  -2.067   8.531 -10.199
  288    HA   GLN  38           HA       GLN  38   0.698   7.758  -9.552
  289    HB2  GLN  38           2HB      GLN  38  -0.134   6.359  -7.778
  290    HB3  GLN  38           1HB      GLN  38  -0.824   7.957  -7.578
  291    HG2  GLN  38           2HG      GLN  38  -2.312   5.587  -8.752
  292    HG3  GLN  38           1HG      GLN  38  -2.365   6.049  -7.056
  293   HE21  GLN  38          1HE2      GLN  38  -3.449   7.976  -6.474
  294   HE22  GLN  38          2HE2      GLN  38  -4.626   8.689  -7.514
  295    HA   PRO  39           HA       PRO  39   0.789   4.600 -12.729
  296    HB2  PRO  39           2HB      PRO  39   1.902   2.915 -10.466
  297    HB3  PRO  39           1HB      PRO  39   2.499   3.100 -12.131
  298    HG2  PRO  39           2HG      PRO  39   3.701   4.390 -10.154
  299    HG3  PRO  39           1HG      PRO  39   3.432   5.186 -11.723
  300    HD2  PRO  39           2HD      PRO  39   1.995   5.620  -9.127
  301    HD3  PRO  39           1HD      PRO  39   2.362   6.776 -10.425
  302    H    ALA  40           H        ALA  40  -0.376   2.868 -13.459
  303    HA   ALA  40           HA       ALA  40  -2.829   2.127 -12.377
  304    HB1  ALA  40           3HB      ALA  40  -2.252   1.828 -14.768
  305    HB2  ALA  40           1HB      ALA  40  -2.867   0.326 -14.070
  306    HB3  ALA  40           2HB      ALA  40  -1.134   0.533 -14.339
  307    H    PHE  41           H        PHE  41   0.340   0.671 -12.005
  308    HA   PHE  41           HA       PHE  41  -0.100  -1.657 -10.591
  309    HB2  PHE  41           2HB      PHE  41   2.078   0.419 -10.086
  310    HB3  PHE  41           1HB      PHE  41   2.125  -1.253  -9.550
  311    HD1  PHE  41           HD2      PHE  41   2.335   0.976 -12.505
  312    HD2  PHE  41           HD1      PHE  41   2.751  -3.042 -11.083
  313    HE1  PHE  41           HE2      PHE  41   3.479   0.356 -14.586
  314    HE2  PHE  41           HE1      PHE  41   3.901  -3.649 -13.168
  315    HZ   PHE  41           HZ       PHE  41   4.268  -1.955 -14.921
  316    H    ILE  42           H        ILE  42   0.161   1.650  -9.312
  317    HA   ILE  42           HA       ILE  42  -0.361   0.992  -6.576
  318    HB   ILE  42           HB       ILE  42  -0.549   3.696  -7.986
  319   HG12  ILE  42          2HG1      ILE  42   1.715   2.735  -8.269
  320   HG13  ILE  42          1HG1      ILE  42   1.768   4.120  -7.185
  321   HG21  ILE  42          1HG2      ILE  42  -0.208   4.704  -5.744
  322   HG22  ILE  42          2HG2      ILE  42  -0.265   3.097  -5.015
  323   HG23  ILE  42          3HG2      ILE  42  -1.693   3.751  -5.817
  324   HD11  ILE  42          3HD1      ILE  42   3.213   2.354  -6.406
  325   HD12  ILE  42          1HD1      ILE  42   1.863   1.217  -6.375
  326   HD13  ILE  42          2HD1      ILE  42   1.887   2.592  -5.270
  327    H    ASN  43           H        ASN  43  -2.365   1.809  -9.383
  328    HA   ASN  43           HA       ASN  43  -4.749   2.526  -7.942
  329    HB2  ASN  43           2HB      ASN  43  -4.281   1.653 -10.822
  330    HB3  ASN  43           1HB      ASN  43  -5.885   1.990 -10.196
  331   HD21  ASN  43          1HD2      ASN  43  -2.891   3.784  -9.522
  332   HD22  ASN  43          2HD2      ASN  43  -3.424   5.250 -10.255
  333    H    ASP  44           H        ASP  44  -3.366  -0.430  -9.264
  334    HA   ASP  44           HA       ASP  44  -5.540  -2.181  -8.837
  335    HB2  ASP  44           2HB      ASP  44  -3.679  -2.767 -10.347
  336    HB3  ASP  44           1HB      ASP  44  -2.557  -2.783  -8.993
  337    H    ILE  45           H        ILE  45  -2.712  -1.281  -6.837
  338    HA   ILE  45           HA       ILE  45  -3.125  -2.977  -4.640
  339    HB   ILE  45           HB       ILE  45  -2.000  -0.135  -4.514
  340   HG12  ILE  45          2HG1      ILE  45  -0.498  -2.782  -4.821
  341   HG13  ILE  45          1HG1      ILE  45  -0.722  -1.591  -6.096
  342   HG21  ILE  45          1HG2      ILE  45  -0.878  -0.874  -2.420
  343   HG22  ILE  45          2HG2      ILE  45  -1.692  -2.436  -2.537
  344   HG23  ILE  45          3HG2      ILE  45  -2.635  -0.967  -2.281
  345   HD11  ILE  45          3HD1      ILE  45   1.511  -1.462  -5.158
  346   HD12  ILE  45          1HD1      ILE  45   0.853  -1.186  -3.545
  347   HD13  ILE  45          2HD1      ILE  45   0.626   0.023  -4.814
  348    H    LEU  46           H        LEU  46  -4.366   0.301  -5.249
  349    HA   LEU  46           HA       LEU  46  -5.898   0.633  -2.914
  350    HB2  LEU  46           2HB      LEU  46  -6.353   1.780  -5.695
  351    HB3  LEU  46           1HB      LEU  46  -7.119   2.373  -4.224
  352    HG   LEU  46           HG       LEU  46  -4.127   2.422  -4.777
  353   HD11  LEU  46          1HD1      LEU  46  -4.355   4.845  -4.996
  354   HD12  LEU  46          2HD1      LEU  46  -6.108   4.710  -4.823
  355   HD13  LEU  46          3HD1      LEU  46  -5.300   3.999  -6.224
  356   HD21  LEU  46          3HD2      LEU  46  -3.957   3.782  -2.750
  357   HD22  LEU  46          1HD2      LEU  46  -4.631   2.194  -2.384
  358   HD23  LEU  46          2HD2      LEU  46  -5.689   3.607  -2.463
  359    H    LYS  47           H        LYS  47  -6.627  -0.919  -5.988
  360    HA   LYS  47           HA       LYS  47  -9.425  -1.404  -5.382
  361    HB2  LYS  47           2HB      LYS  47  -7.692  -2.301  -7.718
  362    HB3  LYS  47           1HB      LYS  47  -9.420  -2.627  -7.581
  363    HG2  LYS  47           2HG      LYS  47  -9.909  -0.228  -7.636
  364    HG3  LYS  47           1HG      LYS  47  -8.184   0.146  -7.679
  365    HD2  LYS  47           2HD      LYS  47  -8.032  -1.062  -9.874
  366    HD3  LYS  47           1HD      LYS  47  -9.781  -1.303  -9.825
  367    HE2  LYS  47           2HE      LYS  47  -8.381   1.398  -9.880
  368    HE3  LYS  47           1HE      LYS  47  -9.120   0.610 -11.272
  369    HZ1  LYS  47           3HZ      LYS  47 -11.262   0.702 -10.070
  370    HZ2  LYS  47           1HZ      LYS  47 -10.618   2.234 -10.400
  371    HZ3  LYS  47           2HZ      LYS  47 -10.521   1.592  -8.842
  372    H    VAL  48           H        VAL  48  -6.475  -3.019  -4.588
  373    HA   VAL  48           HA       VAL  48  -7.422  -5.710  -4.419
  374    HB   VAL  48           HB       VAL  48  -5.333  -4.353  -2.629
  375   HG11  VAL  48          1HG1      VAL  48  -5.889  -7.335  -2.976
  376   HG12  VAL  48          2HG1      VAL  48  -6.218  -6.385  -1.525
  377   HG13  VAL  48          3HG1      VAL  48  -4.555  -6.640  -2.050
  378   HG21  VAL  48          3HG2      VAL  48  -3.653  -5.501  -4.039
  379   HG22  VAL  48          1HG2      VAL  48  -4.628  -4.370  -4.975
  380   HG23  VAL  48          2HG2      VAL  48  -4.941  -6.102  -5.086
  381    H    GLU  49           H        GLU  49  -9.301  -6.145  -3.431
  382    HA   GLU  49           HA       GLU  49 -10.566  -4.683  -1.432
  383    HB2  GLU  49           2HB      GLU  49 -11.916  -6.808  -1.041
  384    HB3  GLU  49           1HB      GLU  49 -11.887  -6.205  -2.694
  385    HG2  GLU  49           2HG      GLU  49 -10.251  -7.911  -3.324
  386    HG3  GLU  49           1HG      GLU  49 -10.171  -8.488  -1.661
  387    H    GLY  50           H        GLY  50  -9.793  -4.207   0.483
  388    HA2  GLY  50           2HA      GLY  50  -9.294  -5.460   2.712
  389    HA3  GLY  50           1HA      GLY  50  -7.849  -5.966   1.838
  390    H    VAL  51           H        VAL  51  -7.391  -3.609   0.387
  391    HA   VAL  51           HA       VAL  51  -5.574  -2.376   2.133
  392    HB   VAL  51           HB       VAL  51  -6.488  -1.717  -0.688
  393   HG11  VAL  51          1HG1      VAL  51  -4.243  -0.285   0.792
  394   HG12  VAL  51          2HG1      VAL  51  -5.751   0.440   0.236
  395   HG13  VAL  51          3HG1      VAL  51  -4.577  -0.156  -0.936
  396   HG21  VAL  51          3HG2      VAL  51  -3.893  -2.882   0.410
  397   HG22  VAL  51          1HG2      VAL  51  -4.248  -2.577  -1.295
  398   HG23  VAL  51          2HG2      VAL  51  -5.181  -3.776  -0.405
  399    H    LYS  52           H        LYS  52  -8.677  -1.205   0.977
  400    HA   LYS  52           HA       LYS  52 -10.109   0.419   1.449
  401    HB2  LYS  52           2HB      LYS  52 -10.054  -0.332   3.745
  402    HB3  LYS  52           1HB      LYS  52  -8.541   0.509   4.039
  403    HG2  LYS  52           2HG      LYS  52  -9.768   2.700   3.675
  404    HG3  LYS  52           1HG      LYS  52 -11.270   1.774   3.598
  405    HD2  LYS  52           2HD      LYS  52  -9.365   1.872   5.977
  406    HD3  LYS  52           1HD      LYS  52 -10.872   2.784   5.839
  407    HE2  LYS  52           2HE      LYS  52 -12.154   0.697   5.795
  408    HE3  LYS  52           1HE      LYS  52 -10.665  -0.247   5.842
  409    HZ1  LYS  52           3HZ      LYS  52 -11.619   1.585   7.963
  410    HZ2  LYS  52           1HZ      LYS  52 -10.197   0.676   8.012
  411    HZ3  LYS  52           2HZ      LYS  52 -11.698  -0.101   7.996
  412    H    SER  53           H        SER  53  -7.099   1.719   2.901
  413    HA   SER  53           HA       SER  53  -7.033   3.918   0.937
  414    HB2  SER  53           2HB      SER  53  -6.895   5.599   2.817
  415    HB3  SER  53           1HB      SER  53  -8.470   4.820   2.673
  416    HG   SER  53           HG       SER  53  -7.303   3.288   4.336
  417    H    ILE  54           H        ILE  54  -5.049   5.062   0.907
  418    HA   ILE  54           HA       ILE  54  -2.779   4.000   2.471
  419    HB   ILE  54           HB       ILE  54  -2.891   4.482  -0.541
  420   HG12  ILE  54          2HG1      ILE  54  -1.977   2.068   1.096
  421   HG13  ILE  54          1HG1      ILE  54  -3.482   2.202   0.195
  422   HG21  ILE  54          1HG2      ILE  54  -0.428   4.191  -0.655
  423   HG22  ILE  54          2HG2      ILE  54  -0.350   4.215   1.108
  424   HG23  ILE  54          3HG2      ILE  54  -0.888   5.647   0.231
  425   HD11  ILE  54          3HD1      ILE  54  -1.885   0.822  -0.982
  426   HD12  ILE  54          1HD1      ILE  54  -0.702   2.131  -0.975
  427   HD13  ILE  54          2HD1      ILE  54  -2.196   2.294  -1.900
  428    H    PHE  55           H        PHE  55  -1.671   5.613   3.450
  429    HA   PHE  55           HA       PHE  55  -1.888   8.382   2.428
  430    HB2  PHE  55           2HB      PHE  55  -2.969   8.018   4.676
  431    HB3  PHE  55           1HB      PHE  55  -1.403   7.527   5.312
  432    HD1  PHE  55           HD1      PHE  55  -3.124  10.371   3.615
  433    HD2  PHE  55           HD2      PHE  55   0.071   9.189   6.194
  434    HE1  PHE  55           HE1      PHE  55  -2.608  12.725   4.055
  435    HE2  PHE  55           HE2      PHE  55   0.580  11.552   6.626
  436    HZ   PHE  55           HZ       PHE  55  -0.759  13.320   5.559
  437    H    HIS  56           H        HIS  56  -0.078   8.683   1.273
  438    HA   HIS  56           HA       HIS  56   2.498   7.571   2.168
  439    HB2  HIS  56           2HB      HIS  56   1.558   7.312  -0.226
  440    HB3  HIS  56           1HB      HIS  56   1.910   9.016  -0.444
  441    HD1  HIS  56           HD1      HIS  56   3.259   7.591  -2.440
  442    HD2  HIS  56           HD2      HIS  56   4.905   7.709   1.377
  443    HE1  HIS  56           HE1      HIS  56   5.642   6.844  -2.708
  444    HE2  HIS  56           HE2      HIS  56   6.624   6.941  -0.386
  445    H    VAL  57           H        VAL  57   3.933   8.864   3.191
  446    HA   VAL  57           HA       VAL  57   4.388  11.601   2.429
  447    HB   VAL  57           HB       VAL  57   2.389  11.844   3.997
  448   HG11  VAL  57          1HG1      VAL  57   2.878  10.064   5.595
  449   HG12  VAL  57          2HG1      VAL  57   2.692  11.613   6.419
  450   HG13  VAL  57          3HG1      VAL  57   4.304  10.940   6.161
  451   HG21  VAL  57          3HG2      VAL  57   4.940  13.202   4.946
  452   HG22  VAL  57          1HG2      VAL  57   3.294  13.750   5.284
  453   HG23  VAL  57          2HG2      VAL  57   3.903  13.752   3.630
  454    H    MET  58           H        MET  58   6.333  12.431   3.314
  455    HA   MET  58           HA       MET  58   8.433  12.467   4.066
  456    HB2  MET  58           2HB      MET  58   7.514  11.921   6.290
  457    HB3  MET  58           1HB      MET  58   7.578  10.203   5.926
  458    HG2  MET  58           2HG      MET  58   9.423  10.846   7.382
  459    HG3  MET  58           1HG      MET  58  10.034  10.319   5.812
  460    HE1  MET  58           3HE      MET  58   8.424  13.831   6.843
  461    HE2  MET  58           1HE      MET  58   9.892  14.744   7.194
  462    HE3  MET  58           2HE      MET  58   9.433  13.386   8.221
  463    H    ASP  59           H        ASP  59   7.784   8.989   4.241
  464    HA   ASP  59           HA       ASP  59   9.172   8.438   1.745
  465    HB2  ASP  59           2HB      ASP  59  10.592   6.681   2.730
  466    HB3  ASP  59           1HB      ASP  59  10.947   8.241   3.456
  467    H    PHE  60           H        PHE  60   6.978   7.499   4.308
  468    HA   PHE  60           HA       PHE  60   6.895   4.719   3.477
  469    HB2  PHE  60           2HB      PHE  60   5.666   4.323   5.557
  470    HB3  PHE  60           1HB      PHE  60   7.163   5.193   5.843
  471    HD1  PHE  60           HD2      PHE  60   7.124   7.562   6.592
  472    HD2  PHE  60           HD1      PHE  60   3.471   5.406   6.025
  473    HE1  PHE  60           HE2      PHE  60   5.904   9.267   7.859
  474    HE2  PHE  60           HE1      PHE  60   2.265   7.130   7.300
  475    HZ   PHE  60           HZ       PHE  60   3.477   9.072   8.200
  476    H    ILE  61           H        ILE  61   5.158   3.552   3.010
  477    HA   ILE  61           HA       ILE  61   2.741   4.883   1.979
  478    HB   ILE  61           HB       ILE  61   3.788   2.022   1.626
  479   HG12  ILE  61          2HG1      ILE  61   3.852   4.361  -0.348
  480   HG13  ILE  61          1HG1      ILE  61   5.241   3.749   0.541
  481   HG21  ILE  61          1HG2      ILE  61   1.507   3.400   0.160
  482   HG22  ILE  61          2HG2      ILE  61   1.333   2.146   1.389
  483   HG23  ILE  61          3HG2      ILE  61   2.107   1.769  -0.149
  484   HD11  ILE  61          3HD1      ILE  61   5.038   1.605  -0.668
  485   HD12  ILE  61          1HD1      ILE  61   5.277   2.980  -1.747
  486   HD13  ILE  61          2HD1      ILE  61   3.675   2.268  -1.574
  487    H    SER  62           H        SER  62   1.490   5.219   3.810
  488    HA   SER  62           HA       SER  62   1.254   3.233   5.923
  489    HB2  SER  62           2HB      SER  62   1.387   5.697   6.386
  490    HB3  SER  62           1HB      SER  62  -0.173   5.911   5.611
  491    HG   SER  62           HG       SER  62   0.017   4.065   7.694
  492    H    VAL  63           H        VAL  63   0.264   1.474   4.886
  493    HA   VAL  63           HA       VAL  63  -2.229   1.816   3.402
  494    HB   VAL  63           HB       VAL  63  -0.867  -0.792   4.224
  495   HG11  VAL  63          1HG1      VAL  63  -2.197  -1.811   2.382
  496   HG12  VAL  63          2HG1      VAL  63  -2.989  -0.259   2.099
  497   HG13  VAL  63          3HG1      VAL  63  -3.239  -1.110   3.623
  498   HG21  VAL  63          3HG2      VAL  63  -0.607   0.744   1.608
  499   HG22  VAL  63          1HG2      VAL  63   0.090  -0.845   1.943
  500   HG23  VAL  63          2HG2      VAL  63   0.651   0.572   2.833
  501    H    ASP  64           H        ASP  64  -3.924   2.358   4.648
  502    HA   ASP  64           HA       ASP  64  -4.420   1.111   7.265
  503    HB2  ASP  64           2HB      ASP  64  -4.586   3.572   7.066
  504    HB3  ASP  64           1HB      ASP  64  -5.822   3.402   5.850
  505    H    LYS  65           H        LYS  65  -5.175  -0.882   6.851
  506    HA   LYS  65           HA       LYS  65  -7.103  -1.441   4.751
  507    HB2  LYS  65           2HB      LYS  65  -6.728  -3.794   5.324
  508    HB3  LYS  65           1HB      LYS  65  -5.190  -2.964   5.121
  509    HG2  LYS  65           2HG      LYS  65  -4.738  -2.993   7.454
  510    HG3  LYS  65           1HG      LYS  65  -6.407  -3.382   7.860
  511    HD2  LYS  65           2HD      LYS  65  -6.088  -5.607   6.739
  512    HD3  LYS  65           1HD      LYS  65  -4.382  -5.213   6.535
  513    HE2  LYS  65           2HE      LYS  65  -4.813  -6.644   8.527
  514    HE3  LYS  65           1HE      LYS  65  -4.071  -5.103   8.942
  515    HZ1  LYS  65           3HZ      LYS  65  -5.864  -5.737  10.453
  516    HZ2  LYS  65           1HZ      LYS  65  -6.964  -5.709   9.175
  517    HZ3  LYS  65           2HZ      LYS  65  -6.207  -4.280   9.659
  518    H    GLU  66           H        GLU  66  -8.775  -3.311   5.527
  519    HA   GLU  66           HA       GLU  66 -10.701  -2.387   7.333
  520    HB2  GLU  66           2HB      GLU  66 -10.117  -5.042   6.033
  521    HB3  GLU  66           1HB      GLU  66 -11.235  -5.056   7.383
  522    HG2  GLU  66           2HG      GLU  66 -12.472  -4.959   5.320
  523    HG3  GLU  66           1HG      GLU  66 -12.708  -3.460   6.208
  524    H    ASN  67           H        ASN  67 -11.433  -3.666   9.306
  525    HA   ASN  67           HA       ASN  67  -9.760  -3.103  11.436
  526    HB2  ASN  67           2HB      ASN  67 -12.106  -5.042  11.328
  527    HB3  ASN  67           1HB      ASN  67 -11.329  -4.538  12.823
  528   HD21  ASN  67          1HD2      ASN  67 -13.278  -3.651  13.599
  529   HD22  ASN  67          2HD2      ASN  67 -13.933  -2.175  12.978
  530    H    ASP  68           H        ASP  68 -10.659  -6.498  10.576
  531    HA   ASP  68           HA       ASP  68  -8.148  -7.399  11.823
  532    HB2  ASP  68           2HB      ASP  68  -9.130  -9.671  11.771
  533    HB3  ASP  68           1HB      ASP  68 -10.183  -8.526  12.587
  534    H    ALA  69           H        ALA  69  -9.963  -8.029   8.781
  535    HA   ALA  69           HA       ALA  69  -9.363  -8.983   6.801
  536    HB1  ALA  69           3HB      ALA  69  -7.847  -7.506   5.526
  537    HB2  ALA  69           1HB      ALA  69  -7.323  -6.762   7.037
  538    HB3  ALA  69           2HB      ALA  69  -8.992  -6.588   6.505
  539    H    ASN  70           H        ASN  70  -6.822  -9.116   5.451
  540    HA   ASN  70           HA       ASN  70  -4.997 -10.642   7.177
  541    HB2  ASN  70           2HB      ASN  70  -6.230 -11.718   4.602
  542    HB3  ASN  70           1HB      ASN  70  -4.672 -12.296   5.182
  543   HD21  ASN  70          1HD2      ASN  70  -8.122 -12.221   5.834
  544   HD22  ASN  70          2HD2      ASN  70  -8.124 -13.512   6.981
  545    H    TRP  71           H        TRP  71  -3.294  -9.278   7.112
  546    HA   TRP  71           HA       TRP  71  -2.258  -7.898   4.867
  547    HB2  TRP  71           2HB      TRP  71  -0.940  -8.931   7.403
  548    HB3  TRP  71           1HB      TRP  71   0.004  -8.135   6.157
  549    HD1  TRP  71           HD1      TRP  71  -1.312  -7.258   9.349
  550    HE1  TRP  71           HE1      TRP  71  -1.796  -4.736   9.544
  551    HE3  TRP  71           HE3      TRP  71  -1.317  -6.009   4.371
  552    HZ2  TRP  71           HZ2      TRP  71  -2.141  -2.525   7.842
  553    HZ3  TRP  71           HZ3      TRP  71  -1.732  -3.666   3.751
  554    HH2  TRP  71           HH2      TRP  71  -2.135  -1.964   5.452
  555    H    GLU  72           H        GLU  72  -1.986 -11.206   5.947
  556    HA   GLU  72           HA       GLU  72   0.252 -12.058   4.491
  557    HB2  GLU  72           2HB      GLU  72  -0.988 -13.209   6.455
  558    HB3  GLU  72           1HB      GLU  72  -2.084 -13.843   5.240
  559    HG2  GLU  72           2HG      GLU  72  -0.403 -15.506   5.791
  560    HG3  GLU  72           1HG      GLU  72  -0.196 -14.976   4.120
  561    H    THR  73           H        THR  73  -3.007 -11.457   3.489
  562    HA   THR  73           HA       THR  73  -2.759 -12.873   0.940
  563    HB   THR  73           HB       THR  73  -5.068 -11.196   2.015
  564    HG1  THR  73           HG1      THR  73  -4.191 -13.757   2.561
  565   HG21  THR  73          3HG2      THR  73  -6.449 -12.402   0.363
  566   HG22  THR  73          1HG2      THR  73  -5.019 -13.271  -0.214
  567   HG23  THR  73          2HG2      THR  73  -5.152 -11.530  -0.453
  568    H    VAL  74           H        VAL  74  -2.988  -9.558   2.189
  569    HA   VAL  74           HA       VAL  74  -3.241  -8.270  -0.367
  570    HB   VAL  74           HB       VAL  74  -2.645  -7.136   2.409
  571   HG11  VAL  74          1HG1      VAL  74  -1.851  -5.541   0.717
  572   HG12  VAL  74          2HG1      VAL  74  -3.303  -4.916   1.498
  573   HG13  VAL  74          3HG1      VAL  74  -3.406  -5.620  -0.118
  574   HG21  VAL  74          3HG2      VAL  74  -5.039  -6.459   2.406
  575   HG22  VAL  74          1HG2      VAL  74  -4.862  -8.210   2.263
  576   HG23  VAL  74          2HG2      VAL  74  -5.260  -7.243   0.841
  577    H    LEU  75           H        LEU  75  -0.554  -8.454   1.994
  578    HA   LEU  75           HA       LEU  75   1.195  -6.708   0.734
  579    HB2  LEU  75           2HB      LEU  75   1.837  -8.992   2.609
  580    HB3  LEU  75           1HB      LEU  75   3.029  -7.815   2.076
  581    HG   LEU  75           HG       LEU  75   0.538  -7.206   3.725
  582   HD11  LEU  75          1HD1      LEU  75   2.085  -6.711   5.544
  583   HD12  LEU  75          2HD1      LEU  75   3.458  -7.164   4.534
  584   HD13  LEU  75          3HD1      LEU  75   2.268  -8.379   5.008
  585   HD21  LEU  75          3HD2      LEU  75   1.080  -5.317   2.246
  586   HD22  LEU  75          1HD2      LEU  75   2.747  -5.322   2.829
  587   HD23  LEU  75          2HD2      LEU  75   1.422  -4.918   3.928
  588    HA   PRO  76           HA       PRO  76   3.168 -10.866  -1.570
  589    HB2  PRO  76           2HB      PRO  76   0.280 -11.523  -2.258
  590    HB3  PRO  76           1HB      PRO  76   1.705 -12.590  -2.287
  591    HG2  PRO  76           2HG      PRO  76   0.026 -12.650  -0.231
  592    HG3  PRO  76           1HG      PRO  76   1.779 -12.790   0.021
  593    HD2  PRO  76           2HD      PRO  76  -0.022 -10.521   0.681
  594    HD3  PRO  76           1HD      PRO  76   1.564 -10.942   1.367
  595    H    LYS  77           H        LYS  77   0.213  -9.054  -2.433
  596    HA   LYS  77           HA       LYS  77   0.940  -8.710  -5.196
  597    HB2  LYS  77           2HB      LYS  77  -1.205  -7.340  -3.530
  598    HB3  LYS  77           1HB      LYS  77  -1.027  -7.184  -5.277
  599    HG2  LYS  77           2HG      LYS  77  -1.312  -9.776  -5.315
  600    HG3  LYS  77           1HG      LYS  77  -1.919  -9.589  -3.666
  601    HD2  LYS  77           2HD      LYS  77  -3.797  -9.599  -5.226
  602    HD3  LYS  77           1HD      LYS  77  -3.649  -7.994  -4.508
  603    HE2  LYS  77           2HE      LYS  77  -2.408  -7.243  -6.568
  604    HE3  LYS  77           1HE      LYS  77  -2.711  -8.825  -7.286
  605    HZ1  LYS  77           3HZ      LYS  77  -4.256  -7.045  -7.978
  606    HZ2  LYS  77           1HZ      LYS  77  -4.834  -6.964  -6.394
  607    HZ3  LYS  77           2HZ      LYS  77  -5.038  -8.380  -7.288
  608    H    VAL  78           H        VAL  78   1.003  -6.665  -2.292
  609    HA   VAL  78           HA       VAL  78   1.665  -4.193  -3.489
  610    HB   VAL  78           HB       VAL  78   2.379  -5.154  -0.673
  611   HG11  VAL  78          1HG1      VAL  78   2.402  -2.745  -0.063
  612   HG12  VAL  78          2HG1      VAL  78   2.127  -2.317  -1.753
  613   HG13  VAL  78          3HG1      VAL  78   3.627  -3.115  -1.281
  614   HG21  VAL  78          3HG2      VAL  78   0.281  -4.065   0.054
  615   HG22  VAL  78          1HG2      VAL  78  -0.048  -5.357  -1.102
  616   HG23  VAL  78          2HG2      VAL  78  -0.108  -3.670  -1.622
  617    H    GLU  79           H        GLU  79   3.744  -6.644  -1.970
  618    HA   GLU  79           HA       GLU  79   6.269  -5.579  -2.446
  619    HB2  GLU  79           2HB      GLU  79   5.455  -8.515  -2.372
  620    HB3  GLU  79           1HB      GLU  79   7.103  -7.913  -2.188
  621    HG2  GLU  79           2HG      GLU  79   6.518  -6.826  -0.100
  622    HG3  GLU  79           1HG      GLU  79   4.823  -7.267  -0.297
  623    H    ALA  80           H        ALA  80   4.262  -7.708  -4.448
  624    HA   ALA  80           HA       ALA  80   6.033  -8.304  -6.530
  625    HB1  ALA  80           3HB      ALA  80   4.045  -8.968  -7.807
  626    HB2  ALA  80           1HB      ALA  80   3.011  -8.102  -6.661
  627    HB3  ALA  80           2HB      ALA  80   3.927  -9.512  -6.133
  628    H    VAL  81           H        VAL  81   4.054  -5.438  -6.004
  629    HA   VAL  81           HA       VAL  81   4.096  -4.317  -8.607
  630    HB   VAL  81           HB       VAL  81   3.866  -3.053  -5.840
  631   HG11  VAL  81          1HG1      VAL  81   2.985  -0.995  -6.961
  632   HG12  VAL  81          2HG1      VAL  81   3.517  -1.652  -8.512
  633   HG13  VAL  81          3HG1      VAL  81   4.703  -1.273  -7.266
  634   HG21  VAL  81          3HG2      VAL  81   1.475  -2.842  -6.420
  635   HG22  VAL  81          1HG2      VAL  81   2.005  -4.521  -6.482
  636   HG23  VAL  81          2HG2      VAL  81   1.775  -3.611  -7.977
  637    H    PHE  82           H        PHE  82   6.207  -3.769  -5.804
  638    HA   PHE  82           HA       PHE  82   8.094  -2.120  -7.244
  639    HB2  PHE  82           2HB      PHE  82   8.544  -3.475  -4.561
  640    HB3  PHE  82           1HB      PHE  82   9.261  -1.976  -5.154
  641    HD1  PHE  82           HD1      PHE  82   7.367  -0.151  -5.879
  642    HD2  PHE  82           HD2      PHE  82   6.871  -3.229  -2.954
  643    HE1  PHE  82           HE1      PHE  82   5.523   1.106  -4.864
  644    HE2  PHE  82           HE2      PHE  82   5.032  -1.965  -1.944
  645    HZ   PHE  82           HZ       PHE  82   4.352   0.184  -2.908
  646    H    GLU  83           H        GLU  83   7.749  -5.524  -6.571
  647    HA   GLU  83           HA       GLU  83  10.490  -6.189  -7.378
  648    HB2  GLU  83           2HB      GLU  83   9.524  -7.308  -5.344
  649    HB3  GLU  83           1HB      GLU  83   8.274  -8.030  -6.346
  650    HG2  GLU  83           2HG      GLU  83   9.962  -9.315  -7.579
  651    HG3  GLU  83           1HG      GLU  83  11.250  -8.530  -6.676
  652    H    LEU  84           H        LEU  84   9.802  -5.211  -9.465
  653    HA   LEU  84           HA       LEU  84   8.349  -6.914 -11.329
  654    HB2  LEU  84           2HB      LEU  84   9.980  -4.379 -11.740
  655    HB3  LEU  84           1HB      LEU  84   9.102  -5.199 -13.021
  656    HG   LEU  84           HG       LEU  84   7.851  -3.874 -10.580
  657   HD11  LEU  84          1HD1      LEU  84   6.939  -2.238 -12.174
  658   HD12  LEU  84          2HD1      LEU  84   7.829  -3.011 -13.488
  659   HD13  LEU  84          3HD1      LEU  84   8.703  -2.223 -12.173
  660   HD21  LEU  84          3HD2      LEU  84   6.526  -5.811 -11.268
  661   HD22  LEU  84          1HD2      LEU  84   6.511  -5.240 -12.940
  662   HD23  LEU  84          2HD2      LEU  84   5.683  -4.321 -11.679
  663    H    GLU  85           H        GLU  85  10.139  -8.502 -10.237
  664    HA   GLU  85           HA       GLU  85  12.236  -9.489 -10.252
  665    HB2  GLU  85           2HB      GLU  85  12.196 -11.170 -12.174
  666    HB3  GLU  85           1HB      GLU  85  10.776 -11.123 -11.137
  667    HG2  GLU  85           2HG      GLU  85   9.600  -9.759 -12.843
  668    HG3  GLU  85           1HG      GLU  85  11.012  -9.868 -13.893
  669    H    HIS  86           H        HIS  86  13.722  -7.804 -10.302
  670    HA   HIS  86           HA       HIS  86  14.393  -6.244 -12.544
  671    HB2  HIS  86           2HB      HIS  86  15.990  -6.701  -9.981
  672    HB3  HIS  86           1HB      HIS  86  16.294  -5.412 -11.138
  673    HD1  HIS  86           HD1      HIS  86  14.381  -6.205  -8.141
  674    HD2  HIS  86           HD2      HIS  86  14.069  -3.470 -11.257
  675    HE1  HIS  86           HE1      HIS  86  12.801  -4.432  -7.329
  676    HE2  HIS  86           HE2      HIS  86  12.761  -2.705  -9.164
  677    H    HIS  87           H        HIS  87  14.805  -7.706 -14.241
  678    HA   HIS  87           HA       HIS  87  17.428  -9.078 -14.226
  679    HB2  HIS  87           2HB      HIS  87  15.574 -10.582 -14.764
  680    HB3  HIS  87           1HB      HIS  87  14.969  -9.474 -15.988
  681    HD1  HIS  87           HD1      HIS  87  15.346 -10.614 -18.178
  682    HD2  HIS  87           HD2      HIS  87  18.596 -11.045 -15.631
  683    HE1  HIS  87           HE1      HIS  87  17.113 -11.785 -19.526
  684    HE2  HIS  87           HE2      HIS  87  19.047 -12.103 -17.943
  685    H    HIS  88           H        HIS  88  15.305  -6.943 -16.136
  686    HA   HIS  88           HA       HIS  88  17.263  -6.099 -18.002
  687    HB2  HIS  88           2HB      HIS  88  15.752  -4.330 -18.612
  688    HB3  HIS  88           1HB      HIS  88  14.767  -5.737 -18.261
  689    HD1  HIS  88           HD1      HIS  88  15.502  -2.282 -17.062
  690    HD2  HIS  88           HD2      HIS  88  13.057  -5.467 -16.006
  691    HE1  HIS  88           HE1      HIS  88  13.858  -1.347 -15.416
  692    HE2  HIS  88           HE2      HIS  88  12.285  -3.255 -14.930
  693    H    HIS  89           H        HIS  89  18.219  -3.881 -18.050
  694    HA   HIS  89           HA       HIS  89  19.656  -3.355 -15.603
  695    HB2  HIS  89           2HB      HIS  89  19.713  -1.885 -18.276
  696    HB3  HIS  89           1HB      HIS  89  20.880  -1.688 -16.969
  697    HD1  HIS  89           HD1      HIS  89  21.058  -3.029 -20.073
  698    HD2  HIS  89           HD2      HIS  89  21.633  -4.777 -16.350
  699    HE1  HIS  89           HE1      HIS  89  22.426  -5.093 -20.493
  700    HE2  HIS  89           HE2      HIS  89  22.563  -6.247 -18.258
  701    H    HIS  90           H        HIS  90  19.873  -0.435 -15.756
  702    HA   HIS  90           HA       HIS  90  17.650   0.279 -14.132
  703    HB2  HIS  90           2HB      HIS  90  18.573   2.491 -13.998
  704    HB3  HIS  90           1HB      HIS  90  19.940   1.387 -14.019
  705    HD1  HIS  90           HD1      HIS  90  18.227   4.029 -16.083
  706    HD2  HIS  90           HD2      HIS  90  21.633   1.635 -16.269
  707    HE1  HIS  90           HE1      HIS  90  19.585   4.929 -17.997
  708    HE2  HIS  90           HE2      HIS  90  21.584   3.400 -18.160
  709    H    HIS  91           H        HIS  91  15.689   1.226 -14.652
  710    HA   HIS  91           HA       HIS  91  15.110   1.882 -17.448
  711    HB2  HIS  91           2HB      HIS  91  13.361   0.691 -16.182
  712    HB3  HIS  91           1HB      HIS  91  13.318   1.972 -14.971
  713    HD1  HIS  91           HD1      HIS  91  11.418   3.544 -15.318
  714    HD2  HIS  91           HD2      HIS  91  12.682   1.858 -18.905
  715    HE1  HIS  91           HE1      HIS  91   9.929   4.520 -17.092
  716    HE2  HIS  91           HE2      HIS  91  10.590   3.338 -19.218
  Start of MODEL    8
    1    H1   MET   1           1H       MET   1  10.624   3.945  -6.612
    2    H2   MET   1           2H       MET   1   9.737   2.513  -6.747
    3    H3   MET   1           3H       MET   1  11.401   2.498  -7.015
    4    HA   MET   1           HA       MET   1  11.854   3.008  -4.753
    5    HB2  MET   1           2HB      MET   1   8.835   2.914  -4.321
    6    HB3  MET   1           1HB      MET   1  10.055   3.186  -3.082
    7    HG2  MET   1           2HG      MET   1   9.123   5.309  -3.539
    8    HG3  MET   1           1HG      MET   1  10.677   5.310  -4.374
    9    HE1  MET   1           3HE      MET   1   7.187   3.633  -5.404
   10    HE2  MET   1           1HE      MET   1   6.559   4.905  -6.451
   11    HE3  MET   1           2HE      MET   1   6.773   5.209  -4.727
   12    H    LYS   2           H        LYS   2  12.030   1.365  -3.179
   13    HA   LYS   2           HA       LYS   2  10.893  -1.304  -3.806
   14    HB2  LYS   2           2HB      LYS   2  13.641  -0.465  -2.813
   15    HB3  LYS   2           1HB      LYS   2  13.022  -2.054  -2.388
   16    HG2  LYS   2           2HG      LYS   2  13.388  -1.048  -5.230
   17    HG3  LYS   2           1HG      LYS   2  14.525  -2.087  -4.359
   18    HD2  LYS   2           2HD      LYS   2  12.687  -3.794  -4.105
   19    HD3  LYS   2           1HD      LYS   2  11.648  -2.775  -5.105
   20    HE2  LYS   2           2HE      LYS   2  13.235  -3.024  -6.988
   21    HE3  LYS   2           1HE      LYS   2  14.266  -4.048  -5.981
   22    HZ1  LYS   2           3HZ      LYS   2  11.450  -4.650  -6.673
   23    HZ2  LYS   2           1HZ      LYS   2  12.512  -5.655  -5.828
   24    HZ3  LYS   2           2HZ      LYS   2  12.791  -5.305  -7.462
   25    H    ILE   3           H        ILE   3  11.197  -2.692  -1.653
   26    HA   ILE   3           HA       ILE   3  10.013  -1.221   0.626
   27    HB   ILE   3           HB       ILE   3  10.278  -4.244   0.192
   28   HG12  ILE   3          2HG1      ILE   3   7.771  -2.508  -0.072
   29   HG13  ILE   3          1HG1      ILE   3   8.677  -3.180  -1.422
   30   HG21  ILE   3          1HG2      ILE   3   8.752  -2.699   2.335
   31   HG22  ILE   3          2HG2      ILE   3  10.248  -3.605   2.575
   32   HG23  ILE   3          3HG2      ILE   3   8.769  -4.454   2.137
   33   HD11  ILE   3          3HD1      ILE   3   7.188  -4.750   0.680
   34   HD12  ILE   3          1HD1      ILE   3   8.126  -5.448  -0.645
   35   HD13  ILE   3          2HD1      ILE   3   6.692  -4.480  -0.990
   36    H    ILE   4           H        ILE   4  11.673  -0.414   1.859
   37    HA   ILE   4           HA       ILE   4  14.133  -1.906   2.348
   38    HB   ILE   4           HB       ILE   4  13.141   0.724   3.560
   39   HG12  ILE   4          2HG1      ILE   4  13.579   0.886   1.127
   40   HG13  ILE   4          1HG1      ILE   4  14.759   1.818   2.036
   41   HG21  ILE   4          1HG2      ILE   4  15.479   1.061   4.357
   42   HG22  ILE   4          2HG2      ILE   4  15.898  -0.560   3.801
   43   HG23  ILE   4          3HG2      ILE   4  14.726  -0.350   5.103
   44   HD11  ILE   4          3HD1      ILE   4  15.206  -0.877   0.756
   45   HD12  ILE   4          1HD1      ILE   4  16.399   0.009   1.710
   46   HD13  ILE   4          2HD1      ILE   4  15.806   0.681   0.193
   47    H    SER   5           H        SER   5  11.240  -0.887   4.173
   48    HA   SER   5           HA       SER   5  11.514  -3.182   5.980
   49    HB2  SER   5           2HB      SER   5  11.201  -0.338   7.052
   50    HB3  SER   5           1HB      SER   5  11.254  -1.815   8.013
   51    HG   SER   5           HG       SER   5  13.426  -2.018   6.792
   52    H    ILE   6           H        ILE   6   9.534  -4.163   6.032
   53    HA   ILE   6           HA       ILE   6   7.053  -2.626   5.738
   54    HB   ILE   6           HB       ILE   6   7.376  -5.599   6.431
   55   HG12  ILE   6          2HG1      ILE   6   6.858  -4.323   3.703
   56   HG13  ILE   6          1HG1      ILE   6   8.378  -5.045   4.212
   57   HG21  ILE   6          1HG2      ILE   6   5.175  -4.691   7.079
   58   HG22  ILE   6          2HG2      ILE   6   5.007  -5.809   5.727
   59   HG23  ILE   6          3HG2      ILE   6   4.929  -4.068   5.444
   60   HD11  ILE   6          3HD1      ILE   6   7.155  -6.510   2.738
   61   HD12  ILE   6          1HD1      ILE   6   5.768  -6.502   3.825
   62   HD13  ILE   6          2HD1      ILE   6   7.290  -7.232   4.340
   63    H    SER   7           H        SER   7   7.661  -1.247   7.521
   64    HA   SER   7           HA       SER   7   7.839  -2.274  10.207
   65    HB2  SER   7           2HB      SER   7   7.810   0.256  10.761
   66    HB3  SER   7           1HB      SER   7   9.151  -0.326   9.779
   67    HG   SER   7           HG       SER   7   6.881   0.560   8.444
   68    H    GLU   8           H        GLU   8   5.976  -3.379  10.575
   69    HA   GLU   8           HA       GLU   8   3.323  -2.429  10.119
   70    HB2  GLU   8           2HB      GLU   8   2.648  -4.475  11.306
   71    HB3  GLU   8           1HB      GLU   8   3.927  -4.841  10.160
   72    HG2  GLU   8           2HG      GLU   8   5.576  -4.791  12.034
   73    HG3  GLU   8           1HG      GLU   8   4.249  -4.521  13.160
   74    H    THR   9           H        THR   9   1.830  -2.780  12.201
   75    HA   THR   9           HA       THR   9   2.775  -1.211  14.503
   76    HB   THR   9           HB       THR   9   0.586   0.106  14.397
   77    HG1  THR   9           HG1      THR   9  -0.725  -0.121  12.712
   78   HG21  THR   9          3HG2      THR   9   1.303   1.720  12.674
   79   HG22  THR   9          1HG2      THR   9   2.423   0.530  12.005
   80   HG23  THR   9          2HG2      THR   9   2.685   1.178  13.626
   81    HA   PRO  10           HA       PRO  10   0.380  -4.337  16.791
   82    HB2  PRO  10           2HB      PRO  10  -0.607  -2.749  18.889
   83    HB3  PRO  10           1HB      PRO  10   1.020  -3.458  18.851
   84    HG2  PRO  10           2HG      PRO  10   0.154  -0.680  18.116
   85    HG3  PRO  10           1HG      PRO  10   1.587  -1.210  19.030
   86    HD2  PRO  10           2HD      PRO  10   1.785  -0.500  16.448
   87    HD3  PRO  10           1HD      PRO  10   2.748  -1.850  17.087
   88    H    ASN  11           H        ASN  11  -1.157  -1.158  16.334
   89    HA   ASN  11           HA       ASN  11  -3.781  -2.227  15.768
   90    HB2  ASN  11           2HB      ASN  11  -4.275   0.136  15.042
   91    HB3  ASN  11           1HB      ASN  11  -3.703   0.009  16.694
   92   HD21  ASN  11          1HD2      ASN  11  -3.656   2.153  14.503
   93   HD22  ASN  11          2HD2      ASN  11  -2.034   2.748  14.547
   94    H    HIS  12           H        HIS  12  -3.064  -3.812  14.248
   95    HA   HIS  12           HA       HIS  12  -1.453  -3.126  11.949
   96    HB2  HIS  12           2HB      HIS  12  -1.619  -5.586  11.433
   97    HB3  HIS  12           1HB      HIS  12  -1.017  -5.232  13.047
   98    HD1  HIS  12           HD1      HIS  12  -2.622  -5.743  15.047
   99    HD2  HIS  12           HD2      HIS  12  -3.992  -7.089  11.360
  100    HE1  HIS  12           HE1      HIS  12  -4.505  -7.317  15.565
  101    HE2  HIS  12           HE2      HIS  12  -5.420  -7.976  13.321
  102    H    ASN  13           H        ASN  13  -4.385  -2.149  12.179
  103    HA   ASN  13           HA       ASN  13  -5.742  -2.831   9.839
  104    HB2  ASN  13           2HB      ASN  13  -6.687  -1.284  11.498
  105    HB3  ASN  13           1HB      ASN  13  -5.408  -0.119  11.204
  106   HD21  ASN  13          1HD2      ASN  13  -8.394  -1.444  10.046
  107   HD22  ASN  13          2HD2      ASN  13  -8.684  -0.271   8.814
  108    H    THR  14           H        THR  14  -2.878  -0.850  10.405
  109    HA   THR  14           HA       THR  14  -2.476  -0.469   7.494
  110    HB   THR  14           HB       THR  14  -3.136   1.663   8.628
  111    HG1  THR  14           HG1      THR  14  -1.927   2.400   7.077
  112   HG21  THR  14          3HG2      THR  14  -1.586   2.797  10.174
  113   HG22  THR  14          1HG2      THR  14  -0.533   1.380  10.183
  114   HG23  THR  14          2HG2      THR  14  -2.155   1.279  10.873
  115    H    MET  15           H        MET  15  -0.284  -0.365   6.799
  116    HA   MET  15           HA       MET  15   1.883  -1.012   8.707
  117    HB2  MET  15           2HB      MET  15   1.566  -2.285   5.946
  118    HB3  MET  15           1HB      MET  15   3.014  -2.399   6.935
  119    HG2  MET  15           2HG      MET  15   1.694  -3.620   8.651
  120    HG3  MET  15           1HG      MET  15   0.311  -3.586   7.557
  121    HE1  MET  15           3HE      MET  15   2.027  -5.579   4.465
  122    HE2  MET  15           1HE      MET  15   2.373  -3.880   4.776
  123    HE3  MET  15           2HE      MET  15   0.719  -4.477   4.886
  124    H    LYS  16           H        LYS  16   3.750   0.075   8.288
  125    HA   LYS  16           HA       LYS  16   3.728   2.193   6.242
  126    HB2  LYS  16           2HB      LYS  16   5.619   1.663   8.569
  127    HB3  LYS  16           1HB      LYS  16   5.723   3.040   7.472
  128    HG2  LYS  16           2HG      LYS  16   3.624   3.928   8.298
  129    HG3  LYS  16           1HG      LYS  16   3.351   2.485   9.282
  130    HD2  LYS  16           2HD      LYS  16   4.211   4.471  10.575
  131    HD3  LYS  16           1HD      LYS  16   5.204   3.022  10.735
  132    HE2  LYS  16           2HE      LYS  16   6.841   3.921   9.152
  133    HE3  LYS  16           1HE      LYS  16   5.814   5.317   8.832
  134    HZ1  LYS  16           3HZ      LYS  16   7.095   4.661  11.423
  135    HZ2  LYS  16           1HZ      LYS  16   6.114   6.006  11.122
  136    HZ3  LYS  16           2HZ      LYS  16   7.602   5.849  10.335
  137    H    ILE  17           H        ILE  17   4.591   1.618   4.329
  138    HA   ILE  17           HA       ILE  17   6.812  -0.277   4.104
  139    HB   ILE  17           HB       ILE  17   5.344   1.296   1.931
  140   HG12  ILE  17          2HG1      ILE  17   4.987  -1.644   2.689
  141   HG13  ILE  17          1HG1      ILE  17   3.916  -0.357   3.232
  142   HG21  ILE  17          1HG2      ILE  17   7.284  -1.047   1.651
  143   HG22  ILE  17          2HG2      ILE  17   7.601   0.629   1.196
  144   HG23  ILE  17          3HG2      ILE  17   6.379  -0.299   0.330
  145   HD11  ILE  17          3HD1      ILE  17   2.970  -1.554   1.365
  146   HD12  ILE  17          1HD1      ILE  17   4.380  -1.186   0.374
  147   HD13  ILE  17          2HD1      ILE  17   3.311   0.114   0.909
  148    H    THR  18           H        THR  18   8.513   0.764   5.007
  149    HA   THR  18           HA       THR  18   9.291   3.456   4.605
  150    HB   THR  18           HB       THR  18  11.000   1.063   5.441
  151    HG1  THR  18           HG1      THR  18   9.072   1.686   6.758
  152   HG21  THR  18          3HG2      THR  18  11.513   4.040   5.860
  153   HG22  THR  18          1HG2      THR  18  12.385   3.005   4.726
  154   HG23  THR  18          2HG2      THR  18  12.515   2.718   6.460
  155    H    LEU  19           H        LEU  19  10.072   4.330   2.787
  156    HA   LEU  19           HA       LEU  19  11.057   2.679   0.581
  157    HB2  LEU  19           2HB      LEU  19  10.567   5.684   0.748
  158    HB3  LEU  19           1HB      LEU  19  10.931   4.780  -0.717
  159    HG   LEU  19           HG       LEU  19   8.402   4.552   0.966
  160   HD11  LEU  19          1HD1      LEU  19   8.804   5.622  -1.836
  161   HD12  LEU  19          2HD1      LEU  19   8.450   6.567  -0.387
  162   HD13  LEU  19          3HD1      LEU  19   7.254   5.435  -1.012
  163   HD21  LEU  19          3HD2      LEU  19   7.569   2.969  -0.751
  164   HD22  LEU  19          1HD2      LEU  19   8.962   2.331   0.118
  165   HD23  LEU  19          2HD2      LEU  19   9.158   2.968  -1.515
  166    H    SER  20           H        SER  20  12.823   4.783  -0.506
  167    HA   SER  20           HA       SER  20  15.221   3.566   0.426
  168    HB2  SER  20           2HB      SER  20  14.857   5.886  -1.512
  169    HB3  SER  20           1HB      SER  20  16.301   4.885  -1.356
  170    HG   SER  20           HG       SER  20  14.915   4.246  -3.088
  171    H    GLU  21           H        GLU  21  13.656   5.877   2.077
  172    HA   GLU  21           HA       GLU  21  14.101   7.281   3.751
  173    HB2  GLU  21           2HB      GLU  21  16.972   6.298   3.476
  174    HB3  GLU  21           1HB      GLU  21  16.375   7.298   4.797
  175    HG2  GLU  21           2HG      GLU  21  14.846   5.473   5.480
  176    HG3  GLU  21           1HG      GLU  21  15.472   4.470   4.167
  177    H    SER  22           H        SER  22  13.789   9.345   3.191
  178    HA   SER  22           HA       SER  22  15.882  10.879   1.816
  179    HB2  SER  22           2HB      SER  22  12.980  10.748   0.865
  180    HB3  SER  22           1HB      SER  22  14.232  11.800   0.200
  181    HG   SER  22           HG       SER  22  15.356   9.561  -0.008
  182    H    ARG  23           H        ARG  23  15.210  13.279   1.727
  183    HA   ARG  23           HA       ARG  23  14.668  14.363   4.245
  184    HB2  ARG  23           2HB      ARG  23  14.666  15.519   1.451
  185    HB3  ARG  23           1HB      ARG  23  14.000  16.492   2.748
  186    HG2  ARG  23           2HG      ARG  23  16.305  17.121   2.352
  187    HG3  ARG  23           1HG      ARG  23  16.148  16.402   3.954
  188    HD2  ARG  23           2HD      ARG  23  17.118  14.304   3.134
  189    HD3  ARG  23           1HD      ARG  23  17.195  14.963   1.493
  190    HE   ARG  23           HE       ARG  23  18.634  16.770   2.855
  191   HH11  ARG  23          1HH1      ARG  23  18.884  13.264   2.859
  192   HH12  ARG  23          2HH1      ARG  23  20.584  13.277   3.202
  193   HH21  ARG  23          1HH2      ARG  23  20.866  16.737   3.227
  194   HH22  ARG  23          2HH2      ARG  23  21.693  15.224   3.404
  195    H    GLU  24           H        GLU  24  12.842  14.997   5.286
  196    HA   GLU  24           HA       GLU  24  10.566  13.437   4.990
  197    HB2  GLU  24           2HB      GLU  24  10.929  16.010   6.572
  198    HB3  GLU  24           1HB      GLU  24   9.575  14.899   6.772
  199    HG2  GLU  24           2HG      GLU  24  11.040  13.143   7.562
  200    HG3  GLU  24           1HG      GLU  24  12.472  14.108   7.195
  201    H    GLY  25           H        GLY  25   9.700  13.590   2.982
  202    HA2  GLY  25           2HA      GLY  25   7.582  15.511   2.624
  203    HA3  GLY  25           1HA      GLY  25   8.860  15.641   1.413
  204    H    MET  26           H        MET  26   9.491  13.627   0.297
  205    HA   MET  26           HA       MET  26   9.058  11.918  -1.126
  206    HB2  MET  26           2HB      MET  26   9.323  10.760   1.080
  207    HB3  MET  26           1HB      MET  26   7.581  10.794   1.293
  208    HG2  MET  26           2HG      MET  26   8.300   8.584   0.610
  209    HG3  MET  26           1HG      MET  26   7.333   9.305  -0.671
  210    HE1  MET  26           3HE      MET  26  11.183   9.678   0.353
  211    HE2  MET  26           1HE      MET  26  11.896   8.597  -0.847
  212    HE3  MET  26           2HE      MET  26  10.832   7.947   0.400
  213    H    THR  27           H        THR  27   7.075  14.113  -1.107
  214    HA   THR  27           HA       THR  27   5.092  14.819  -1.861
  215    HB   THR  27           HB       THR  27   4.335  12.082  -2.918
  216    HG1  THR  27           HG1      THR  27   6.530  12.536  -3.544
  217   HG21  THR  27          3HG2      THR  27   3.295  13.369  -4.750
  218   HG22  THR  27          1HG2      THR  27   3.875  14.875  -4.030
  219   HG23  THR  27          2HG2      THR  27   2.672  13.896  -3.188
  220    H    SER  28           H        SER  28   3.126  15.105  -0.954
  221    HA   SER  28           HA       SER  28   2.351  13.369   1.315
  222    HB2  SER  28           2HB      SER  28   1.112  15.420   2.133
  223    HB3  SER  28           1HB      SER  28   2.856  15.653   2.015
  224    HG   SER  28           HG       SER  28   0.883  16.526   0.165
  225    H    ASP  29           H        ASP  29   0.643  12.100   0.949
  226    HA   ASP  29           HA       ASP  29  -1.451  12.783  -0.997
  227    HB2  ASP  29           2HB      ASP  29   0.018  10.096  -0.997
  228    HB3  ASP  29           1HB      ASP  29  -1.283  10.579  -2.081
  229    H    THR  30           H        THR  30  -3.330  11.536  -0.773
  230    HA   THR  30           HA       THR  30  -3.624   9.523   1.286
  231    HB   THR  30           HB       THR  30  -4.156  11.399   2.678
  232    HG1  THR  30           HG1      THR  30  -6.684  11.134   2.616
  233   HG21  THR  30          3HG2      THR  30  -4.444  13.165   0.982
  234   HG22  THR  30          1HG2      THR  30  -5.795  13.163   2.120
  235   HG23  THR  30          2HG2      THR  30  -5.998  12.475   0.508
  236    H    TYR  31           H        TYR  31  -4.080   8.059  -0.270
  237    HA   TYR  31           HA       TYR  31  -5.938   8.640  -2.456
  238    HB2  TYR  31           2HB      TYR  31  -4.029   6.312  -2.000
  239    HB3  TYR  31           1HB      TYR  31  -5.062   6.488  -3.414
  240    HD1  TYR  31           HD1      TYR  31  -4.703   9.419  -4.013
  241    HD2  TYR  31           HD2      TYR  31  -1.834   6.433  -2.921
  242    HE1  TYR  31           HE1      TYR  31  -2.961  10.645  -5.233
  243    HE2  TYR  31           HE2      TYR  31  -0.092   7.670  -4.136
  244    HH   TYR  31           HH       TYR  31  -0.466  10.847  -5.154
  245    H    THR  32           H        THR  32  -7.947   8.502  -1.357
  246    HA   THR  32           HA       THR  32  -8.740   5.934  -0.146
  247    HB   THR  32           HB       THR  32 -10.905   7.066   0.360
  248    HG1  THR  32           HG1      THR  32 -10.280   9.609  -0.222
  249   HG21  THR  32          3HG2      THR  32 -10.084   8.773   1.955
  250   HG22  THR  32          1HG2      THR  32  -8.509   8.771   1.159
  251   HG23  THR  32          2HG2      THR  32  -9.072   7.330   2.008
  252    H    LYS  33           H        LYS  33  -8.928   7.696  -3.074
  253    HA   LYS  33           HA       LYS  33 -10.837   5.834  -4.334
  254    HB2  LYS  33           2HB      LYS  33 -11.210   8.413  -4.284
  255    HB3  LYS  33           1HB      LYS  33  -9.872   8.525  -5.416
  256    HG2  LYS  33           2HG      LYS  33 -11.148   7.182  -7.055
  257    HG3  LYS  33           1HG      LYS  33 -12.477   7.036  -5.904
  258    HD2  LYS  33           2HD      LYS  33 -11.464   9.658  -7.078
  259    HD3  LYS  33           1HD      LYS  33 -12.876   8.769  -7.655
  260    HE2  LYS  33           2HE      LYS  33 -12.539  10.011  -4.902
  261    HE3  LYS  33           1HE      LYS  33 -13.574  10.606  -6.201
  262    HZ1  LYS  33           3HZ      LYS  33 -14.875   9.396  -4.607
  263    HZ2  LYS  33           1HZ      LYS  33 -13.881   8.035  -4.740
  264    HZ3  LYS  33           2HZ      LYS  33 -14.836   8.515  -6.049
  265    H    VAL  34           H        VAL  34  -9.876   6.306  -7.018
  266    HA   VAL  34           HA       VAL  34  -7.103   5.427  -7.209
  267    HB   VAL  34           HB       VAL  34  -9.393   3.742  -8.404
  268   HG11  VAL  34          1HG1      VAL  34  -7.374   3.731  -9.797
  269   HG12  VAL  34          2HG1      VAL  34  -7.628   2.143  -9.076
  270   HG13  VAL  34          3HG1      VAL  34  -6.396   3.226  -8.420
  271   HG21  VAL  34          3HG2      VAL  34  -7.581   2.963  -6.087
  272   HG22  VAL  34          1HG2      VAL  34  -8.740   1.897  -6.889
  273   HG23  VAL  34          2HG2      VAL  34  -9.308   3.302  -5.988
  274    H    ASP  35           H        ASP  35  -6.865   7.434  -8.229
  275    HA   ASP  35           HA       ASP  35  -7.670   7.806 -10.942
  276    HB2  ASP  35           2HB      ASP  35  -9.806   8.338  -9.465
  277    HB3  ASP  35           1HB      ASP  35  -8.949   9.806  -9.013
  278    H    ASP  36           H        ASP  36  -7.565  10.911 -10.193
  279    HA   ASP  36           HA       ASP  36  -6.112  12.582 -10.155
  280    HB2  ASP  36           2HB      ASP  36  -5.636  11.907  -7.863
  281    HB3  ASP  36           1HB      ASP  36  -4.521  10.660  -8.401
  282    H    SER  37           H        SER  37  -3.401  10.353 -10.067
  283    HA   SER  37           HA       SER  37  -3.074   9.820 -12.821
  284    HB2  SER  37           2HB      SER  37  -0.987  11.244 -13.172
  285    HB3  SER  37           1HB      SER  37  -2.480  12.176 -13.069
  286    HG   SER  37           HG       SER  37  -1.895  12.368 -10.736
  287    H    GLN  38           H        GLN  38  -2.926   8.714 -10.020
  288    HA   GLN  38           HA       GLN  38  -0.273   8.140  -9.249
  289    HB2  GLN  38           2HB      GLN  38  -1.327   6.516  -7.683
  290    HB3  GLN  38           1HB      GLN  38  -2.149   8.074  -7.652
  291    HG2  GLN  38           2HG      GLN  38  -3.944   7.197  -9.056
  292    HG3  GLN  38           1HG      GLN  38  -3.107   5.659  -9.201
  293   HE21  GLN  38          1HE2      GLN  38  -4.808   4.486  -8.366
  294   HE22  GLN  38          2HE2      GLN  38  -5.307   4.578  -6.718
  295    HA   PRO  39           HA       PRO  39   1.071   4.914 -12.101
  296    HB2  PRO  39           2HB      PRO  39   2.009   3.491  -9.593
  297    HB3  PRO  39           1HB      PRO  39   2.901   3.849 -11.090
  298    HG2  PRO  39           2HG      PRO  39   3.326   5.290  -8.899
  299    HG3  PRO  39           1HG      PRO  39   3.292   6.059 -10.503
  300    HD2  PRO  39           2HD      PRO  39   1.206   6.130  -8.339
  301    HD3  PRO  39           1HD      PRO  39   1.663   7.377  -9.519
  302    H    ALA  40           H        ALA  40   0.254   3.047 -12.953
  303    HA   ALA  40           HA       ALA  40  -2.236   2.037 -12.155
  304    HB1  ALA  40           3HB      ALA  40  -1.941   0.367 -13.937
  305    HB2  ALA  40           1HB      ALA  40  -0.221   0.761 -14.031
  306    HB3  ALA  40           2HB      ALA  40  -1.427   1.966 -14.479
  307    H    PHE  41           H        PHE  41   1.011   0.903 -11.466
  308    HA   PHE  41           HA       PHE  41   0.391  -1.612 -10.323
  309    HB2  PHE  41           2HB      PHE  41   2.746   0.218  -9.683
  310    HB3  PHE  41           1HB      PHE  41   2.662  -1.516  -9.384
  311    HD1  PHE  41           HD1      PHE  41   2.332  -3.062 -11.477
  312    HD2  PHE  41           HD2      PHE  41   3.661   0.998 -11.729
  313    HE1  PHE  41           HE1      PHE  41   3.272  -3.499 -13.709
  314    HE2  PHE  41           HE2      PHE  41   4.598   0.550 -13.954
  315    HZ   PHE  41           HZ       PHE  41   4.407  -1.695 -14.949
  316    H    ILE  42           H        ILE  42   0.531   1.663  -8.957
  317    HA   ILE  42           HA       ILE  42  -0.035   0.917  -6.227
  318    HB   ILE  42           HB       ILE  42  -0.339   3.628  -7.618
  319   HG12  ILE  42          2HG1      ILE  42   1.999   2.833  -7.728
  320   HG13  ILE  42          1HG1      ILE  42   1.878   4.197  -6.627
  321   HG21  ILE  42          1HG2      ILE  42  -0.262   3.022  -4.633
  322   HG22  ILE  42          2HG2      ILE  42  -1.661   3.580  -5.549
  323   HG23  ILE  42          3HG2      ILE  42  -0.265   4.636  -5.349
  324   HD11  ILE  42          3HD1      ILE  42   3.379   2.521  -5.761
  325   HD12  ILE  42          1HD1      ILE  42   2.117   1.291  -5.854
  326   HD13  ILE  42          2HD1      ILE  42   1.958   2.638  -4.725
  327    H    ASN  43           H        ASN  43  -1.949   1.522  -9.129
  328    HA   ASN  43           HA       ASN  43  -4.499   2.005  -7.943
  329    HB2  ASN  43           2HB      ASN  43  -3.730   0.811 -10.644
  330    HB3  ASN  43           1HB      ASN  43  -5.393   1.052 -10.160
  331   HD21  ASN  43          1HD2      ASN  43  -2.823   3.380  -9.426
  332   HD22  ASN  43          2HD2      ASN  43  -3.395   4.588 -10.518
  333    H    ASP  44           H        ASP  44  -2.700  -0.892  -8.899
  334    HA   ASP  44           HA       ASP  44  -4.614  -2.879  -8.461
  335    HB2  ASP  44           2HB      ASP  44  -2.465  -3.304  -9.611
  336    HB3  ASP  44           1HB      ASP  44  -1.589  -3.060  -8.103
  337    H    ILE  45           H        ILE  45  -2.218  -1.496  -6.186
  338    HA   ILE  45           HA       ILE  45  -2.671  -3.125  -3.956
  339    HB   ILE  45           HB       ILE  45  -1.998  -0.141  -3.863
  340   HG12  ILE  45          2HG1      ILE  45  -0.093  -2.528  -3.977
  341   HG13  ILE  45          1HG1      ILE  45  -0.405  -1.413  -5.302
  342   HG21  ILE  45          1HG2      ILE  45  -2.680  -0.992  -1.659
  343   HG22  ILE  45          2HG2      ILE  45  -0.950  -0.658  -1.660
  344   HG23  ILE  45          3HG2      ILE  45  -1.527  -2.321  -1.782
  345   HD11  ILE  45          3HD1      ILE  45   0.912  -0.731  -2.672
  346   HD12  ILE  45          1HD1      ILE  45   0.579   0.413  -3.977
  347   HD13  ILE  45          2HD1      ILE  45   1.703  -0.921  -4.234
  348    H    LEU  46           H        LEU  46  -4.185  -0.031  -4.818
  349    HA   LEU  46           HA       LEU  46  -6.078   0.038  -2.710
  350    HB2  LEU  46           2HB      LEU  46  -5.887   1.438  -5.384
  351    HB3  LEU  46           1HB      LEU  46  -7.213   1.753  -4.268
  352    HG   LEU  46           HG       LEU  46  -4.306   2.065  -3.422
  353   HD11  LEU  46          1HD1      LEU  46  -4.479   4.458  -3.794
  354   HD12  LEU  46          2HD1      LEU  46  -6.077   4.258  -4.515
  355   HD13  LEU  46          3HD1      LEU  46  -4.655   3.573  -5.307
  356   HD21  LEU  46          3HD2      LEU  46  -5.248   3.456  -1.628
  357   HD22  LEU  46          1HD2      LEU  46  -5.943   1.836  -1.602
  358   HD23  LEU  46          2HD2      LEU  46  -6.878   3.185  -2.251
  359    H    LYS  47           H        LYS  47  -6.200  -1.470  -5.897
  360    HA   LYS  47           HA       LYS  47  -8.999  -2.107  -5.921
  361    HB2  LYS  47           2HB      LYS  47  -6.667  -3.257  -7.489
  362    HB3  LYS  47           1HB      LYS  47  -8.337  -3.757  -7.747
  363    HG2  LYS  47           2HG      LYS  47  -8.947  -1.527  -8.476
  364    HG3  LYS  47           1HG      LYS  47  -7.333  -0.918  -8.092
  365    HD2  LYS  47           2HD      LYS  47  -6.381  -2.488  -9.803
  366    HD3  LYS  47           1HD      LYS  47  -8.026  -2.981 -10.223
  367    HE2  LYS  47           2HE      LYS  47  -6.906  -0.169 -10.482
  368    HE3  LYS  47           1HE      LYS  47  -7.131  -1.313 -11.807
  369    HZ1  LYS  47           3HZ      LYS  47  -9.495  -1.287 -11.390
  370    HZ2  LYS  47           1HZ      LYS  47  -8.934   0.279 -11.679
  371    HZ3  LYS  47           2HZ      LYS  47  -9.294  -0.210 -10.104
  372    H    VAL  48           H        VAL  48  -6.267  -3.534  -4.298
  373    HA   VAL  48           HA       VAL  48  -7.094  -6.229  -4.162
  374    HB   VAL  48           HB       VAL  48  -5.521  -4.688  -2.041
  375   HG11  VAL  48          1HG1      VAL  48  -4.692  -6.909  -1.299
  376   HG12  VAL  48          2HG1      VAL  48  -5.773  -7.699  -2.448
  377   HG13  VAL  48          3HG1      VAL  48  -6.440  -6.769  -1.103
  378   HG21  VAL  48          3HG2      VAL  48  -4.361  -4.620  -4.200
  379   HG22  VAL  48          1HG2      VAL  48  -4.493  -6.374  -4.363
  380   HG23  VAL  48          2HG2      VAL  48  -3.496  -5.673  -3.086
  381    H    GLU  49           H        GLU  49  -8.941  -6.988  -3.372
  382    HA   GLU  49           HA       GLU  49 -10.800  -5.676  -1.750
  383    HB2  GLU  49           2HB      GLU  49 -10.364  -8.616  -2.383
  384    HB3  GLU  49           1HB      GLU  49 -11.618  -8.130  -1.253
  385    HG2  GLU  49           2HG      GLU  49 -12.528  -8.527  -3.495
  386    HG3  GLU  49           1HG      GLU  49 -12.762  -6.858  -2.983
  387    H    GLY  50           H        GLY  50 -10.220  -4.851   0.119
  388    HA2  GLY  50           2HA      GLY  50  -9.833  -5.795   2.541
  389    HA3  GLY  50           1HA      GLY  50  -8.227  -6.081   1.861
  390    H    VAL  51           H        VAL  51  -7.694  -3.981   0.326
  391    HA   VAL  51           HA       VAL  51  -6.835  -2.047   2.210
  392    HB   VAL  51           HB       VAL  51  -6.789  -1.903  -0.837
  393   HG11  VAL  51          1HG1      VAL  51  -6.511   0.368   0.122
  394   HG12  VAL  51          2HG1      VAL  51  -5.002  -0.196  -0.591
  395   HG13  VAL  51          3HG1      VAL  51  -5.209  -0.214   1.164
  396   HG21  VAL  51          3HG2      VAL  51  -4.438  -2.644  -0.608
  397   HG22  VAL  51          1HG2      VAL  51  -5.557  -3.835   0.054
  398   HG23  VAL  51          2HG2      VAL  51  -4.645  -2.784   1.140
  399    H    LYS  52           H        LYS  52  -7.697  -0.205   2.890
  400    HA   LYS  52           HA       LYS  52 -10.315   0.660   1.923
  401    HB2  LYS  52           2HB      LYS  52 -10.062   0.255   4.354
  402    HB3  LYS  52           1HB      LYS  52  -8.742   1.418   4.433
  403    HG2  LYS  52           2HG      LYS  52 -10.255   3.251   3.929
  404    HG3  LYS  52           1HG      LYS  52 -11.577   2.129   3.624
  405    HD2  LYS  52           2HD      LYS  52 -11.985   3.073   5.769
  406    HD3  LYS  52           1HD      LYS  52 -11.429   1.428   6.062
  407    HE2  LYS  52           2HE      LYS  52  -9.558   3.813   6.214
  408    HE3  LYS  52           1HE      LYS  52 -10.514   3.288   7.595
  409    HZ1  LYS  52           3HZ      LYS  52  -8.345   2.348   7.732
  410    HZ2  LYS  52           1HZ      LYS  52  -8.442   1.716   6.168
  411    HZ3  LYS  52           2HZ      LYS  52  -9.429   1.096   7.390
  412    H    SER  53           H        SER  53  -7.032   1.917   2.639
  413    HA   SER  53           HA       SER  53  -7.007   3.603   0.334
  414    HB2  SER  53           2HB      SER  53  -6.773   5.797   1.638
  415    HB3  SER  53           1HB      SER  53  -8.395   5.117   1.574
  416    HG   SER  53           HG       SER  53  -7.109   4.152   3.708
  417    H    ILE  54           H        ILE  54  -5.005   5.210   0.549
  418    HA   ILE  54           HA       ILE  54  -2.762   3.955   2.027
  419    HB   ILE  54           HB       ILE  54  -2.709   4.927  -0.880
  420   HG12  ILE  54          2HG1      ILE  54  -2.121   2.155   0.277
  421   HG13  ILE  54          1HG1      ILE  54  -3.580   2.607  -0.599
  422   HG21  ILE  54          1HG2      ILE  54  -0.356   4.034   0.841
  423   HG22  ILE  54          2HG2      ILE  54  -0.653   5.665   0.239
  424   HG23  ILE  54          3HG2      ILE  54  -0.283   4.367  -0.893
  425   HD11  ILE  54          3HD1      ILE  54  -0.778   2.479  -1.711
  426   HD12  ILE  54          1HD1      ILE  54  -2.195   3.033  -2.610
  427   HD13  ILE  54          2HD1      ILE  54  -2.108   1.370  -2.034
  428    H    PHE  55           H        PHE  55  -2.314   5.510   3.533
  429    HA   PHE  55           HA       PHE  55  -2.123   8.347   2.799
  430    HB2  PHE  55           2HB      PHE  55  -3.051   7.666   5.044
  431    HB3  PHE  55           1HB      PHE  55  -1.488   6.965   5.455
  432    HD1  PHE  55           HD1      PHE  55  -2.874  10.224   4.170
  433    HD2  PHE  55           HD2      PHE  55  -0.081   8.308   6.790
  434    HE1  PHE  55           HE1      PHE  55  -2.165  12.413   5.024
  435    HE2  PHE  55           HE2      PHE  55   0.621  10.507   7.636
  436    HZ   PHE  55           HZ       PHE  55  -0.421  12.560   6.757
  437    H    HIS  56           H        HIS  56  -0.215   9.255   2.179
  438    HA   HIS  56           HA       HIS  56   2.327   7.736   2.437
  439    HB2  HIS  56           2HB      HIS  56   1.384   7.241   0.222
  440    HB3  HIS  56           1HB      HIS  56   1.119   8.949  -0.100
  441    HD1  HIS  56           HD1      HIS  56   2.604   9.284  -2.067
  442    HD2  HIS  56           HD2      HIS  56   4.579   7.361   1.034
  443    HE1  HIS  56           HE1      HIS  56   4.976   9.039  -2.837
  444    HE2  HIS  56           HE2      HIS  56   6.166   7.934  -0.916
  445    H    VAL  57           H        VAL  57   3.909   9.048   3.276
  446    HA   VAL  57           HA       VAL  57   4.263  11.785   2.517
  447    HB   VAL  57           HB       VAL  57   2.235  11.938   4.075
  448   HG11  VAL  57          1HG1      VAL  57   4.202  11.189   6.253
  449   HG12  VAL  57          2HG1      VAL  57   2.842  10.211   5.696
  450   HG13  VAL  57          3HG1      VAL  57   2.546  11.753   6.500
  451   HG21  VAL  57          3HG2      VAL  57   4.699  13.480   4.969
  452   HG22  VAL  57          1HG2      VAL  57   3.029  13.923   5.333
  453   HG23  VAL  57          2HG2      VAL  57   3.601  13.938   3.665
  454    H    MET  58           H        MET  58   6.053  12.771   3.596
  455    HA   MET  58           HA       MET  58   8.110  13.023   4.248
  456    HB2  MET  58           2HB      MET  58   8.810  12.332   6.483
  457    HB3  MET  58           1HB      MET  58   7.183  12.981   6.469
  458    HG2  MET  58           2HG      MET  58   6.248  10.775   6.721
  459    HG3  MET  58           1HG      MET  58   7.845  10.038   6.586
  460    HE1  MET  58           3HE      MET  58   9.562  11.110   9.909
  461    HE2  MET  58           1HE      MET  58   9.676  11.952   8.365
  462    HE3  MET  58           2HE      MET  58   9.700  10.188   8.412
  463    H    ASP  59           H        ASP  59   7.784   9.480   4.774
  464    HA   ASP  59           HA       ASP  59   9.740   8.997   2.682
  465    HB2  ASP  59           2HB      ASP  59  11.228   7.637   4.033
  466    HB3  ASP  59           1HB      ASP  59  11.092   9.221   4.789
  467    H    PHE  60           H        PHE  60   7.180   7.879   4.803
  468    HA   PHE  60           HA       PHE  60   7.418   5.093   3.885
  469    HB2  PHE  60           2HB      PHE  60   5.930   4.536   5.772
  470    HB3  PHE  60           1HB      PHE  60   7.326   5.456   6.317
  471    HD1  PHE  60           HD1      PHE  60   3.652   5.625   5.725
  472    HD2  PHE  60           HD2      PHE  60   7.044   7.658   7.353
  473    HE1  PHE  60           HE1      PHE  60   2.164   7.232   6.830
  474    HE2  PHE  60           HE2      PHE  60   5.533   9.254   8.456
  475    HZ   PHE  60           HZ       PHE  60   3.098   9.054   8.183
  476    H    ILE  61           H        ILE  61   5.667   3.911   3.100
  477    HA   ILE  61           HA       ILE  61   3.278   5.376   2.126
  478    HB   ILE  61           HB       ILE  61   4.317   2.626   1.249
  479   HG12  ILE  61          2HG1      ILE  61   4.517   5.305  -0.197
  480   HG13  ILE  61          1HG1      ILE  61   5.856   4.362   0.444
  481   HG21  ILE  61          1HG2      ILE  61   2.077   4.297   0.044
  482   HG22  ILE  61          2HG2      ILE  61   1.864   2.854   1.036
  483   HG23  ILE  61          3HG2      ILE  61   2.638   2.728  -0.542
  484   HD11  ILE  61          3HD1      ILE  61   4.075   3.616  -1.877
  485   HD12  ILE  61          1HD1      ILE  61   5.347   2.588  -1.208
  486   HD13  ILE  61          2HD1      ILE  61   5.758   4.135  -1.945
  487    H    SER  62           H        SER  62   2.067   5.318   4.030
  488    HA   SER  62           HA       SER  62   1.711   2.870   5.554
  489    HB2  SER  62           2HB      SER  62   1.811   5.157   6.636
  490    HB3  SER  62           1HB      SER  62   0.263   5.537   5.890
  491    HG   SER  62           HG       SER  62   0.332   3.173   7.322
  492    H    VAL  63           H        VAL  63   0.794   1.496   4.015
  493    HA   VAL  63           HA       VAL  63  -1.743   2.085   2.726
  494    HB   VAL  63           HB       VAL  63  -0.297  -0.607   3.004
  495   HG11  VAL  63          1HG1      VAL  63  -1.687  -1.326   1.071
  496   HG12  VAL  63          2HG1      VAL  63  -2.521   0.231   1.086
  497   HG13  VAL  63          3HG1      VAL  63  -2.691  -0.875   2.451
  498   HG21  VAL  63          3HG2      VAL  63   0.565  -0.224   0.716
  499   HG22  VAL  63          1HG2      VAL  63   1.131   1.028   1.823
  500   HG23  VAL  63          2HG2      VAL  63  -0.177   1.378   0.692
  501    H    ASP  64           H        ASP  64  -3.656   1.932   3.815
  502    HA   ASP  64           HA       ASP  64  -3.855   0.117   6.151
  503    HB2  ASP  64           2HB      ASP  64  -5.623   1.560   7.038
  504    HB3  ASP  64           1HB      ASP  64  -4.163   2.497   6.758
  505    H    LYS  65           H        LYS  65  -5.895  -0.940   6.466
  506    HA   LYS  65           HA       LYS  65  -7.473  -1.391   4.017
  507    HB2  LYS  65           2HB      LYS  65  -7.348  -3.813   4.337
  508    HB3  LYS  65           1HB      LYS  65  -5.741  -3.132   4.117
  509    HG2  LYS  65           2HG      LYS  65  -5.388  -3.261   6.571
  510    HG3  LYS  65           1HG      LYS  65  -6.966  -4.029   6.742
  511    HD2  LYS  65           2HD      LYS  65  -6.127  -5.822   5.124
  512    HD3  LYS  65           1HD      LYS  65  -4.526  -5.092   5.287
  513    HE2  LYS  65           2HE      LYS  65  -6.162  -6.552   7.348
  514    HE3  LYS  65           1HE      LYS  65  -4.496  -6.836   6.852
  515    HZ1  LYS  65           3HZ      LYS  65  -3.930  -4.706   7.913
  516    HZ2  LYS  65           1HZ      LYS  65  -4.540  -5.847   8.999
  517    HZ3  LYS  65           2HZ      LYS  65  -5.518  -4.582   8.471
  518    H    GLU  66           H        GLU  66  -9.135  -3.390   5.086
  519    HA   GLU  66           HA       GLU  66 -11.077  -1.968   6.511
  520    HB2  GLU  66           2HB      GLU  66 -10.669  -4.968   6.212
  521    HB3  GLU  66           1HB      GLU  66 -12.124  -4.237   6.886
  522    HG2  GLU  66           2HG      GLU  66 -12.574  -3.111   4.755
  523    HG3  GLU  66           1HG      GLU  66 -11.094  -3.780   4.069
  524    H    ASN  67           H        ASN  67 -12.017  -2.869   8.655
  525    HA   ASN  67           HA       ASN  67 -10.701  -1.483  10.539
  526    HB2  ASN  67           2HB      ASN  67 -12.143  -2.598  12.285
  527    HB3  ASN  67           1HB      ASN  67 -13.007  -1.988  10.882
  528   HD21  ASN  67          1HD2      ASN  67 -13.743  -4.074  12.851
  529   HD22  ASN  67          2HD2      ASN  67 -14.099  -5.483  11.915
  530    H    ASP  68           H        ASP  68 -10.371  -5.050  10.296
  531    HA   ASP  68           HA       ASP  68  -7.776  -4.758  11.716
  532    HB2  ASP  68           2HB      ASP  68  -9.554  -5.720  13.253
  533    HB3  ASP  68           1HB      ASP  68  -9.724  -7.079  12.146
  534    H    ALA  69           H        ALA  69  -9.716  -7.244  10.048
  535    HA   ALA  69           HA       ALA  69  -9.399  -8.649   8.321
  536    HB1  ALA  69           3HB      ALA  69  -9.708  -6.486   7.181
  537    HB2  ALA  69           1HB      ALA  69  -8.674  -7.568   6.244
  538    HB3  ALA  69           2HB      ALA  69  -7.961  -6.243   7.163
  539    H    ASN  70           H        ASN  70  -7.276  -8.979   6.401
  540    HA   ASN  70           HA       ASN  70  -4.983  -9.910   8.060
  541    HB2  ASN  70           2HB      ASN  70  -6.420 -11.529   5.906
  542    HB3  ASN  70           1HB      ASN  70  -4.896 -12.004   6.658
  543   HD21  ASN  70          1HD2      ASN  70  -4.922 -12.515   8.936
  544   HD22  ASN  70          2HD2      ASN  70  -6.374 -13.065   9.690
  545    H    TRP  71           H        TRP  71  -3.156  -8.998   7.365
  546    HA   TRP  71           HA       TRP  71  -2.720  -7.999   4.702
  547    HB2  TRP  71           2HB      TRP  71  -0.841  -8.382   7.069
  548    HB3  TRP  71           1HB      TRP  71  -0.272  -7.790   5.513
  549    HD1  TRP  71           HD1      TRP  71  -1.513  -6.494   8.737
  550    HE1  TRP  71           HE1      TRP  71  -2.123  -4.000   8.536
  551    HE3  TRP  71           HE3      TRP  71  -1.552  -6.029   3.627
  552    HZ2  TRP  71           HZ2      TRP  71  -2.570  -2.112   6.527
  553    HZ3  TRP  71           HZ3      TRP  71  -2.086  -3.826   2.659
  554    HH2  TRP  71           HH2      TRP  71  -2.584  -1.912   4.083
  555    H    GLU  72           H        GLU  72  -2.630 -11.119   6.013
  556    HA   GLU  72           HA       GLU  72  -0.514 -12.379   4.633
  557    HB2  GLU  72           2HB      GLU  72  -3.193 -13.488   5.593
  558    HB3  GLU  72           1HB      GLU  72  -1.896 -14.495   4.960
  559    HG2  GLU  72           2HG      GLU  72  -1.907 -14.576   7.389
  560    HG3  GLU  72           1HG      GLU  72  -0.427 -13.815   6.813
  561    H    THR  73           H        THR  73  -3.632 -11.307   3.645
  562    HA   THR  73           HA       THR  73  -3.687 -12.748   1.111
  563    HB   THR  73           HB       THR  73  -5.710 -10.694   2.122
  564    HG1  THR  73           HG1      THR  73  -5.301 -13.397   2.907
  565   HG21  THR  73          3HG2      THR  73  -6.024 -13.176   0.378
  566   HG22  THR  73          1HG2      THR  73  -6.017 -11.512  -0.206
  567   HG23  THR  73          2HG2      THR  73  -7.317 -12.070   0.845
  568    H    VAL  74           H        VAL  74  -3.394  -9.439   2.364
  569    HA   VAL  74           HA       VAL  74  -3.524  -8.173  -0.235
  570    HB   VAL  74           HB       VAL  74  -2.874  -6.951   2.487
  571   HG11  VAL  74          1HG1      VAL  74  -3.693  -5.608  -0.123
  572   HG12  VAL  74          2HG1      VAL  74  -2.110  -5.515   0.652
  573   HG13  VAL  74          3HG1      VAL  74  -3.513  -4.792   1.433
  574   HG21  VAL  74          3HG2      VAL  74  -5.558  -7.083   1.041
  575   HG22  VAL  74          1HG2      VAL  74  -5.242  -6.238   2.559
  576   HG23  VAL  74          2HG2      VAL  74  -5.119  -7.996   2.486
  577    H    LEU  75           H        LEU  75  -0.985  -8.587   2.228
  578    HA   LEU  75           HA       LEU  75   0.962  -6.880   1.309
  579    HB2  LEU  75           2HB      LEU  75   0.854  -8.137   3.523
  580    HB3  LEU  75           1HB      LEU  75   1.570  -9.510   2.714
  581    HG   LEU  75           HG       LEU  75   2.983  -6.810   2.927
  582   HD11  LEU  75          1HD1      LEU  75   3.267  -9.165   4.826
  583   HD12  LEU  75          2HD1      LEU  75   2.514  -7.612   5.198
  584   HD13  LEU  75          3HD1      LEU  75   4.237  -7.688   4.841
  585   HD21  LEU  75          3HD2      LEU  75   5.058  -8.114   2.548
  586   HD22  LEU  75          1HD2      LEU  75   3.943  -8.262   1.192
  587   HD23  LEU  75          2HD2      LEU  75   4.103  -9.584   2.347
  588    HA   PRO  76           HA       PRO  76   3.040 -10.610  -1.347
  589    HB2  PRO  76           2HB      PRO  76   1.009 -12.135  -2.624
  590    HB3  PRO  76           1HB      PRO  76   2.020 -12.686  -1.273
  591    HG2  PRO  76           2HG      PRO  76  -0.740 -11.510  -1.212
  592    HG3  PRO  76           1HG      PRO  76  -0.074 -12.877  -0.287
  593    HD2  PRO  76           2HD      PRO  76  -0.356 -10.508   0.896
  594    HD3  PRO  76           1HD      PRO  76   1.120 -11.460   1.189
  595    H    LYS  77           H        LYS  77  -0.152  -9.233  -2.172
  596    HA   LYS  77           HA       LYS  77   0.418  -8.776  -4.949
  597    HB2  LYS  77           2HB      LYS  77  -1.754  -7.644  -3.136
  598    HB3  LYS  77           1HB      LYS  77  -1.672  -7.351  -4.874
  599    HG2  LYS  77           2HG      LYS  77  -1.837  -9.820  -5.254
  600    HG3  LYS  77           1HG      LYS  77  -2.055 -10.039  -3.512
  601    HD2  LYS  77           2HD      LYS  77  -4.147  -8.826  -3.542
  602    HD3  LYS  77           1HD      LYS  77  -3.885  -8.292  -5.204
  603    HE2  LYS  77           2HE      LYS  77  -4.104 -10.631  -5.986
  604    HE3  LYS  77           1HE      LYS  77  -4.370 -11.160  -4.324
  605    HZ1  LYS  77           3HZ      LYS  77  -6.361  -9.795  -4.249
  606    HZ2  LYS  77           1HZ      LYS  77  -6.442 -10.914  -5.515
  607    HZ3  LYS  77           2HZ      LYS  77  -6.103  -9.292  -5.845
  608    H    VAL  78           H        VAL  78   0.551  -6.760  -2.038
  609    HA   VAL  78           HA       VAL  78   1.194  -4.285  -3.292
  610    HB   VAL  78           HB       VAL  78   1.941  -5.175  -0.460
  611   HG11  VAL  78          1HG1      VAL  78   1.572  -2.380  -1.616
  612   HG12  VAL  78          2HG1      VAL  78   3.109  -3.121  -1.163
  613   HG13  VAL  78          3HG1      VAL  78   1.911  -2.756   0.077
  614   HG21  VAL  78          3HG2      VAL  78  -0.185  -4.132   0.273
  615   HG22  VAL  78          1HG2      VAL  78  -0.474  -5.485  -0.822
  616   HG23  VAL  78          2HG2      VAL  78  -0.621  -3.829  -1.410
  617    H    GLU  79           H        GLU  79   3.118  -6.918  -1.999
  618    HA   GLU  79           HA       GLU  79   5.725  -5.950  -2.224
  619    HB2  GLU  79           2HB      GLU  79   5.158  -7.982  -0.988
  620    HB3  GLU  79           1HB      GLU  79   4.591  -8.767  -2.454
  621    HG2  GLU  79           2HG      GLU  79   6.938  -8.729  -3.329
  622    HG3  GLU  79           1HG      GLU  79   7.466  -8.053  -1.785
  623    H    ALA  80           H        ALA  80   3.689  -7.718  -4.539
  624    HA   ALA  80           HA       ALA  80   5.420  -8.140  -6.675
  625    HB1  ALA  80           3HB      ALA  80   3.397  -8.370  -8.056
  626    HB2  ALA  80           1HB      ALA  80   2.438  -7.561  -6.810
  627    HB3  ALA  80           2HB      ALA  80   3.166  -9.132  -6.483
  628    H    VAL  81           H        VAL  81   3.756  -5.219  -5.734
  629    HA   VAL  81           HA       VAL  81   3.910  -3.753  -8.165
  630    HB   VAL  81           HB       VAL  81   3.554  -2.935  -5.252
  631   HG11  VAL  81          1HG1      VAL  81   3.224  -1.130  -7.671
  632   HG12  VAL  81          2HG1      VAL  81   4.436  -0.964  -6.407
  633   HG13  VAL  81          3HG1      VAL  81   2.731  -0.733  -6.025
  634   HG21  VAL  81          3HG2      VAL  81   1.759  -4.333  -6.167
  635   HG22  VAL  81          1HG2      VAL  81   1.562  -3.235  -7.537
  636   HG23  VAL  81          2HG2      VAL  81   1.171  -2.694  -5.906
  637    H    PHE  82           H        PHE  82   5.909  -3.536  -5.181
  638    HA   PHE  82           HA       PHE  82   7.924  -1.871  -6.343
  639    HB2  PHE  82           2HB      PHE  82   8.147  -3.633  -3.861
  640    HB3  PHE  82           1HB      PHE  82   9.172  -2.252  -4.264
  641    HD1  PHE  82           HD1      PHE  82   8.232   0.070  -4.194
  642    HD2  PHE  82           HD2      PHE  82   5.940  -3.317  -2.944
  643    HE1  PHE  82           HE1      PHE  82   6.596   1.559  -3.125
  644    HE2  PHE  82           HE2      PHE  82   4.322  -1.828  -1.877
  645    HZ   PHE  82           HZ       PHE  82   4.640   0.589  -1.983
  646    H    GLU  83           H        GLU  83   7.478  -5.349  -6.348
  647    HA   GLU  83           HA       GLU  83  10.250  -5.964  -6.931
  648    HB2  GLU  83           2HB      GLU  83   7.747  -7.690  -6.958
  649    HB3  GLU  83           1HB      GLU  83   9.361  -8.308  -7.303
  650    HG2  GLU  83           2HG      GLU  83   8.536  -6.989  -4.695
  651    HG3  GLU  83           1HG      GLU  83   8.601  -8.729  -4.966
  652    H    LEU  84           H        LEU  84   7.295  -6.627  -8.816
  653    HA   LEU  84           HA       LEU  84   6.748  -6.658 -10.984
  654    HB2  LEU  84           2HB      LEU  84   9.279  -5.051 -11.496
  655    HB3  LEU  84           1HB      LEU  84   8.051  -5.392 -12.707
  656    HG   LEU  84           HG       LEU  84   7.703  -3.688 -10.208
  657   HD11  LEU  84          1HD1      LEU  84   7.655  -2.904 -13.135
  658   HD12  LEU  84          2HD1      LEU  84   8.932  -2.540 -11.971
  659   HD13  LEU  84          3HD1      LEU  84   7.331  -1.833 -11.767
  660   HD21  LEU  84          3HD2      LEU  84   5.618  -4.428 -12.288
  661   HD22  LEU  84          1HD2      LEU  84   5.409  -3.221 -11.015
  662   HD23  LEU  84          2HD2      LEU  84   5.633  -4.915 -10.591
  663    H    GLU  85           H        GLU  85  10.220  -7.303 -10.592
  664    HA   GLU  85           HA       GLU  85  10.608  -9.315 -12.474
  665    HB2  GLU  85           2HB      GLU  85  12.226  -8.069 -10.674
  666    HB3  GLU  85           1HB      GLU  85  11.948  -9.541  -9.766
  667    HG2  GLU  85           2HG      GLU  85  13.267  -9.267 -12.485
  668    HG3  GLU  85           1HG      GLU  85  14.029  -9.711 -10.962
  669    H    HIS  86           H        HIS  86  10.281 -11.573 -12.413
  670    HA   HIS  86           HA       HIS  86   8.259 -12.636 -10.676
  671    HB2  HIS  86           2HB      HIS  86   8.807 -14.857 -11.796
  672    HB3  HIS  86           1HB      HIS  86   8.262 -13.572 -12.858
  673    HD1  HIS  86           HD1      HIS  86  11.781 -14.688 -11.730
  674    HD2  HIS  86           HD2      HIS  86   9.650 -13.743 -15.162
  675    HE1  HIS  86           HE1      HIS  86  13.364 -15.073 -13.618
  676    HE2  HIS  86           HE2      HIS  86  12.111 -14.314 -15.658
  677    H    HIS  87           H        HIS  87   9.267 -12.092  -8.661
  678    HA   HIS  87           HA       HIS  87  11.806 -13.075  -7.859
  679    HB2  HIS  87           2HB      HIS  87  11.191 -12.200  -5.594
  680    HB3  HIS  87           1HB      HIS  87  10.986 -11.022  -6.877
  681    HD1  HIS  87           HD1      HIS  87   8.498 -10.427  -7.542
  682    HD2  HIS  87           HD2      HIS  87   8.895 -12.762  -4.128
  683    HE1  HIS  87           HE1      HIS  87   6.279 -10.306  -6.377
  684    HE2  HIS  87           HE2      HIS  87   6.601 -11.588  -4.239
  685    H    HIS  88           H        HIS  88  12.198 -15.127  -7.606
  686    HA   HIS  88           HA       HIS  88  10.175 -16.990  -6.525
  687    HB2  HIS  88           2HB      HIS  88  12.743 -17.578  -8.077
  688    HB3  HIS  88           1HB      HIS  88  11.556 -18.773  -7.560
  689    HD1  HIS  88           HD1      HIS  88  12.548 -17.511 -10.544
  690    HD2  HIS  88           HD2      HIS  88   8.817 -17.534  -8.709
  691    HE1  HIS  88           HE1      HIS  88  10.880 -17.266 -12.404
  692    HE2  HIS  88           HE2      HIS  88   8.636 -17.508 -11.287
  693    H    HIS  89           H        HIS  89  10.749 -18.416  -4.853
  694    HA   HIS  89           HA       HIS  89  12.490 -17.431  -2.834
  695    HB2  HIS  89           2HB      HIS  89  10.434 -18.715  -2.324
  696    HB3  HIS  89           1HB      HIS  89  11.125 -20.148  -3.079
  697    HD1  HIS  89           HD1      HIS  89  12.384 -21.682  -1.542
  698    HD2  HIS  89           HD2      HIS  89  11.926 -17.885   0.090
  699    HE1  HIS  89           HE1      HIS  89  13.299 -21.834   0.789
  700    HE2  HIS  89           HE2      HIS  89  13.138 -19.496   1.705
  701    H    HIS  90           H        HIS  90  12.920 -19.701  -5.446
  702    HA   HIS  90           HA       HIS  90  15.735 -20.183  -4.618
  703    HB2  HIS  90           2HB      HIS  90  15.707 -22.320  -5.670
  704    HB3  HIS  90           1HB      HIS  90  14.179 -22.251  -4.810
  705    HD1  HIS  90           HD1      HIS  90  15.521 -23.200  -7.972
  706    HD2  HIS  90           HD2      HIS  90  11.985 -21.388  -6.760
  707    HE1  HIS  90           HE1      HIS  90  13.928 -23.495  -9.884
  708    HE2  HIS  90           HE2      HIS  90  11.879 -22.202  -9.205
  709    H    HIS  91           H        HIS  91  17.333 -20.023  -6.304
  710    HA   HIS  91           HA       HIS  91  16.562 -18.368  -8.611
  711    HB2  HIS  91           2HB      HIS  91  18.554 -17.687  -7.286
  712    HB3  HIS  91           1HB      HIS  91  19.331 -19.227  -7.642
  713    HD1  HIS  91           HD1      HIS  91  20.761 -19.272  -9.688
  714    HD2  HIS  91           HD2      HIS  91  18.110 -16.079  -9.732
  715    HE1  HIS  91           HE1      HIS  91  21.366 -17.922 -11.720
  716    HE2  HIS  91           HE2      HIS  91  19.889 -15.881 -11.592
  Start of MODEL    9
    1    H1   MET   1           1H       MET   1  11.725   4.464  -4.336
    2    H2   MET   1           2H       MET   1  11.364   3.187  -5.379
    3    H3   MET   1           3H       MET   1  12.102   2.881  -3.896
    4    HA   MET   1           HA       MET   1  10.176   3.676  -2.720
    5    HB2  MET   1           2HB      MET   1   8.960   3.908  -5.505
    6    HB3  MET   1           1HB      MET   1   8.056   4.047  -4.003
    7    HG2  MET   1           2HG      MET   1   9.370   6.046  -3.404
    8    HG3  MET   1           1HG      MET   1  10.250   5.915  -4.930
    9    HE1  MET   1           3HE      MET   1   7.906   9.059  -5.470
   10    HE2  MET   1           1HE      MET   1   9.572   8.482  -5.488
   11    HE3  MET   1           2HE      MET   1   8.684   8.576  -3.965
   12    H    LYS   2           H        LYS   2  10.517   1.612  -1.929
   13    HA   LYS   2           HA       LYS   2   8.566  -0.353  -2.700
   14    HB2  LYS   2           2HB      LYS   2  10.078  -2.227  -3.118
   15    HB3  LYS   2           1HB      LYS   2  10.373  -0.956  -4.295
   16    HG2  LYS   2           2HG      LYS   2  12.410  -0.286  -3.094
   17    HG3  LYS   2           1HG      LYS   2  12.095  -1.507  -1.855
   18    HD2  LYS   2           2HD      LYS   2  12.288  -3.290  -3.577
   19    HD3  LYS   2           1HD      LYS   2  12.634  -2.066  -4.800
   20    HE2  LYS   2           2HE      LYS   2  14.705  -1.455  -3.589
   21    HE3  LYS   2           1HE      LYS   2  14.346  -2.673  -2.365
   22    HZ1  LYS   2           3HZ      LYS   2  14.915  -3.170  -5.232
   23    HZ2  LYS   2           1HZ      LYS   2  14.457  -4.363  -4.126
   24    HZ3  LYS   2           2HZ      LYS   2  15.917  -3.536  -3.924
   25    H    ILE   3           H        ILE   3   8.695  -2.298  -1.179
   26    HA   ILE   3           HA       ILE   3   8.836  -1.408   1.518
   27    HB   ILE   3           HB       ILE   3   8.676  -4.295   0.526
   28   HG12  ILE   3          2HG1      ILE   3   6.415  -2.378   1.286
   29   HG13  ILE   3          1HG1      ILE   3   6.791  -2.920  -0.342
   30   HG21  ILE   3          1HG2      ILE   3   7.995  -3.142   3.266
   31   HG22  ILE   3          2HG2      ILE   3   9.382  -4.164   2.886
   32   HG23  ILE   3          3HG2      ILE   3   7.751  -4.820   2.768
   33   HD11  ILE   3          3HD1      ILE   3   4.860  -4.080   0.520
   34   HD12  ILE   3          1HD1      ILE   3   5.777  -4.636   1.921
   35   HD13  ILE   3          2HD1      ILE   3   6.190  -5.219   0.307
   36    H    ILE   4           H        ILE   4  10.832  -0.691   2.045
   37    HA   ILE   4           HA       ILE   4  13.216  -2.389   1.792
   38    HB   ILE   4           HB       ILE   4  12.819   0.493   2.722
   39   HG12  ILE   4          2HG1      ILE   4  12.559   0.067   0.274
   40   HG13  ILE   4          1HG1      ILE   4  13.923   1.114   0.631
   41   HG21  ILE   4          1HG2      ILE   4  15.457  -1.014   2.505
   42   HG22  ILE   4          2HG2      ILE   4  14.716  -0.403   3.985
   43   HG23  ILE   4          3HG2      ILE   4  15.297   0.727   2.763
   44   HD11  ILE   4          3HD1      ILE   4  14.076  -1.818  -0.068
   45   HD12  ILE   4          1HD1      ILE   4  15.450  -0.773   0.296
   46   HD13  ILE   4          2HD1      ILE   4  14.459  -0.461  -1.127
   47    H    SER   5           H        SER   5  11.137  -0.907   4.246
   48    HA   SER   5           HA       SER   5  11.894  -2.931   6.190
   49    HB2  SER   5           2HB      SER   5  13.544  -1.004   6.465
   50    HB3  SER   5           1HB      SER   5  12.179   0.023   6.901
   51    HG   SER   5           HG       SER   5  13.429  -2.004   8.322
   52    H    ILE   6           H        ILE   6  10.416  -2.927   8.037
   53    HA   ILE   6           HA       ILE   6   7.758  -1.726   7.467
   54    HB   ILE   6           HB       ILE   6   8.450  -4.430   8.732
   55   HG12  ILE   6          2HG1      ILE   6   8.495  -4.402   6.244
   56   HG13  ILE   6          1HG1      ILE   6   7.203  -5.422   6.857
   57   HG21  ILE   6          1HG2      ILE   6   5.681  -3.165   8.518
   58   HG22  ILE   6          2HG2      ILE   6   6.580  -3.480  10.005
   59   HG23  ILE   6          3HG2      ILE   6   6.013  -4.825   9.018
   60   HD11  ILE   6          3HD1      ILE   6   5.581  -3.649   6.363
   61   HD12  ILE   6          1HD1      ILE   6   6.468  -4.158   4.928
   62   HD13  ILE   6          2HD1      ILE   6   6.881  -2.642   5.726
   63    H    SER   7           H        SER   7   6.920  -0.512   9.045
   64    HA   SER   7           HA       SER   7   8.001  -0.627  11.802
   65    HB2  SER   7           2HB      SER   7   6.699   1.824  10.524
   66    HB3  SER   7           1HB      SER   7   7.584   1.744  12.048
   67    HG   SER   7           HG       SER   7   8.553   1.675   9.405
   68    H    GLU   8           H        GLU   8   6.520  -2.335  12.127
   69    HA   GLU   8           HA       GLU   8   3.674  -1.982  11.925
   70    HB2  GLU   8           2HB      GLU   8   3.497  -4.238  12.717
   71    HB3  GLU   8           1HB      GLU   8   4.851  -4.190  11.621
   72    HG2  GLU   8           2HG      GLU   8   5.003  -4.284  14.641
   73    HG3  GLU   8           1HG      GLU   8   5.324  -5.619  13.543
   74    H    THR   9           H        THR   9   2.500  -2.883  14.072
   75    HA   THR   9           HA       THR   9   3.372  -1.718  16.556
   76    HB   THR   9           HB       THR   9   2.703   0.393  15.645
   77    HG1  THR   9           HG1      THR   9   1.014   0.992  16.975
   78   HG21  THR   9          3HG2      THR   9   0.557   0.857  14.533
   79   HG22  THR   9          1HG2      THR   9   0.119  -0.847  14.654
   80   HG23  THR   9          2HG2      THR   9   1.479  -0.358  13.647
   81    HA   PRO  10           HA       PRO  10   0.364  -4.800  18.094
   82    HB2  PRO  10           2HB      PRO  10  -0.483  -3.585  20.449
   83    HB3  PRO  10           1HB      PRO  10   1.052  -4.461  20.291
   84    HG2  PRO  10           2HG      PRO  10   0.552  -1.506  20.121
   85    HG3  PRO  10           1HG      PRO  10   1.835  -2.384  20.990
   86    HD2  PRO  10           2HD      PRO  10   2.351  -1.238  18.627
   87    HD3  PRO  10           1HD      PRO  10   3.050  -2.824  19.027
   88    H    ASN  11           H        ASN  11  -0.458  -1.440  17.578
   89    HA   ASN  11           HA       ASN  11  -3.321  -1.840  17.354
   90    HB2  ASN  11           2HB      ASN  11  -2.355   0.393  17.904
   91    HB3  ASN  11           1HB      ASN  11  -1.535   0.431  16.346
   92   HD21  ASN  11          1HD2      ASN  11  -2.582   2.328  15.741
   93   HD22  ASN  11          2HD2      ASN  11  -4.251   2.383  15.304
   94    H    HIS  12           H        HIS  12  -4.462  -1.838  15.273
   95    HA   HIS  12           HA       HIS  12  -2.841  -3.253  13.210
   96    HB2  HIS  12           2HB      HIS  12  -5.658  -3.892  14.192
   97    HB3  HIS  12           1HB      HIS  12  -4.825  -4.729  12.882
   98    HD1  HIS  12           HD1      HIS  12  -5.739  -5.699  15.950
   99    HD2  HIS  12           HD2      HIS  12  -1.928  -5.234  14.352
  100    HE1  HIS  12           HE1      HIS  12  -4.230  -7.126  17.368
  101    HE2  HIS  12           HE2      HIS  12  -1.932  -6.833  16.385
  102    H    ASN  13           H        ASN  13  -4.635  -3.606  11.278
  103    HA   ASN  13           HA       ASN  13  -5.649  -2.792   9.451
  104    HB2  ASN  13           2HB      ASN  13  -6.079  -0.201  10.996
  105    HB3  ASN  13           1HB      ASN  13  -6.703  -0.519   9.383
  106   HD21  ASN  13          1HD2      ASN  13  -8.423  -1.973   9.132
  107   HD22  ASN  13          2HD2      ASN  13  -9.413  -2.449  10.469
  108    H    THR  14           H        THR  14  -3.765  -0.076  10.814
  109    HA   THR  14           HA       THR  14  -2.473   0.229   8.176
  110    HB   THR  14           HB       THR  14  -3.706   2.227   8.784
  111    HG1  THR  14           HG1      THR  14  -1.766   2.566   7.703
  112   HG21  THR  14          3HG2      THR  14  -3.729   2.027  11.254
  113   HG22  THR  14          1HG2      THR  14  -3.136   3.614  10.754
  114   HG23  THR  14          2HG2      THR  14  -2.001   2.383  11.308
  115    H    MET  15           H        MET  15  -0.341  -0.044   7.926
  116    HA   MET  15           HA       MET  15   1.446   0.285  10.270
  117    HB2  MET  15           2HB      MET  15   2.869  -1.557   9.650
  118    HB3  MET  15           1HB      MET  15   1.231  -2.182   9.756
  119    HG2  MET  15           2HG      MET  15   1.059  -2.391   7.391
  120    HG3  MET  15           1HG      MET  15   2.489  -1.402   7.121
  121    HE1  MET  15           3HE      MET  15   2.244  -4.240   9.883
  122    HE2  MET  15           1HE      MET  15   2.763  -5.648   8.958
  123    HE3  MET  15           2HE      MET  15   1.222  -4.871   8.591
  124    H    LYS  16           H        LYS  16   3.513   1.042   9.793
  125    HA   LYS  16           HA       LYS  16   3.578   2.909   7.535
  126    HB2  LYS  16           2HB      LYS  16   3.910   3.836   9.743
  127    HB3  LYS  16           1HB      LYS  16   5.138   2.641  10.139
  128    HG2  LYS  16           2HG      LYS  16   6.654   3.672   8.471
  129    HG3  LYS  16           1HG      LYS  16   5.415   4.879   8.115
  130    HD2  LYS  16           2HD      LYS  16   5.523   5.706  10.431
  131    HD3  LYS  16           1HD      LYS  16   6.711   4.465  10.839
  132    HE2  LYS  16           2HE      LYS  16   8.307   5.480   9.248
  133    HE3  LYS  16           1HE      LYS  16   7.115   6.712   8.833
  134    HZ1  LYS  16           3HZ      LYS  16   7.164   7.418  11.174
  135    HZ2  LYS  16           1HZ      LYS  16   8.654   7.593  10.397
  136    HZ3  LYS  16           2HZ      LYS  16   8.408   6.313  11.468
  137    H    ILE  17           H        ILE  17   4.305   1.769   5.734
  138    HA   ILE  17           HA       ILE  17   6.613   0.021   5.800
  139    HB   ILE  17           HB       ILE  17   5.077   1.168   3.416
  140   HG12  ILE  17          2HG1      ILE  17   4.968  -1.584   4.736
  141   HG13  ILE  17          1HG1      ILE  17   3.725  -0.353   4.838
  142   HG21  ILE  17          1HG2      ILE  17   6.252  -0.549   2.047
  143   HG22  ILE  17          2HG2      ILE  17   7.222  -1.008   3.449
  144   HG23  ILE  17          3HG2      ILE  17   7.384   0.605   2.754
  145   HD11  ILE  17          3HD1      ILE  17   3.348  -0.579   2.407
  146   HD12  ILE  17          1HD1      ILE  17   3.087  -2.087   3.288
  147   HD13  ILE  17          2HD1      ILE  17   4.570  -1.853   2.366
  148    H    THR  18           H        THR  18   8.541   0.867   6.094
  149    HA   THR  18           HA       THR  18   9.333   3.540   5.392
  150    HB   THR  18           HB       THR  18  10.981   1.163   6.376
  151    HG1  THR  18           HG1      THR  18  10.756   2.205   8.393
  152   HG21  THR  18          3HG2      THR  18  11.751   4.113   6.295
  153   HG22  THR  18          1HG2      THR  18  12.441   2.850   5.270
  154   HG23  THR  18          2HG2      THR  18  12.703   2.815   7.014
  155    H    LEU  19           H        LEU  19  10.259   4.237   3.556
  156    HA   LEU  19           HA       LEU  19  11.142   2.327   1.477
  157    HB2  LEU  19           2HB      LEU  19  10.656   5.320   1.173
  158    HB3  LEU  19           1HB      LEU  19  10.839   4.133  -0.111
  159    HG   LEU  19           HG       LEU  19   8.473   4.373   1.795
  160   HD11  LEU  19          1HD1      LEU  19   8.621   4.901  -1.181
  161   HD12  LEU  19          2HD1      LEU  19   8.466   6.112   0.095
  162   HD13  LEU  19          3HD1      LEU  19   7.164   4.961  -0.186
  163   HD21  LEU  19          3HD2      LEU  19   8.865   2.353  -0.440
  164   HD22  LEU  19          1HD2      LEU  19   7.377   2.594   0.482
  165   HD23  LEU  19          2HD2      LEU  19   8.827   2.006   1.292
  166    H    SER  20           H        SER  20  13.101   3.193   0.165
  167    HA   SER  20           HA       SER  20  15.296   3.418   2.024
  168    HB2  SER  20           2HB      SER  20  15.425   1.946   0.012
  169    HB3  SER  20           1HB      SER  20  15.359   3.370  -1.028
  170    HG   SER  20           HG       SER  20  17.383   3.855  -0.513
  171    H    GLU  21           H        GLU  21  13.530   5.630   0.005
  172    HA   GLU  21           HA       GLU  21  15.631   7.614  -0.157
  173    HB2  GLU  21           2HB      GLU  21  12.724   7.819  -1.028
  174    HB3  GLU  21           1HB      GLU  21  13.980   8.993  -1.385
  175    HG2  GLU  21           2HG      GLU  21  13.613   7.730  -3.369
  176    HG3  GLU  21           1HG      GLU  21  15.166   7.219  -2.717
  177    H    SER  22           H        SER  22  15.859   7.688   2.189
  178    HA   SER  22           HA       SER  22  13.937   9.288   3.693
  179    HB2  SER  22           2HB      SER  22  15.230   7.411   4.772
  180    HB3  SER  22           1HB      SER  22  16.712   8.323   4.513
  181    HG   SER  22           HG       SER  22  14.478   9.113   6.078
  182    H    ARG  23           H        ARG  23  14.942  11.235   4.912
  183    HA   ARG  23           HA       ARG  23  15.528  13.415   4.816
  184    HB2  ARG  23           2HB      ARG  23  17.561  12.598   2.684
  185    HB3  ARG  23           1HB      ARG  23  17.519  14.150   3.508
  186    HG2  ARG  23           2HG      ARG  23  18.018  11.484   4.875
  187    HG3  ARG  23           1HG      ARG  23  19.275  12.619   4.379
  188    HD2  ARG  23           2HD      ARG  23  17.080  13.192   6.397
  189    HD3  ARG  23           1HD      ARG  23  18.756  12.799   6.790
  190    HE   ARG  23           HE       ARG  23  19.056  14.945   5.196
  191   HH11  ARG  23          1HH1      ARG  23  16.978  14.465   7.982
  192   HH12  ARG  23          2HH1      ARG  23  17.018  16.139   8.436
  193   HH21  ARG  23          1HH2      ARG  23  19.100  17.119   5.821
  194   HH22  ARG  23          2HH2      ARG  23  18.207  17.630   7.226
  195    H    GLU  24           H        GLU  24  15.758  15.323   3.117
  196    HA   GLU  24           HA       GLU  24  14.566  16.713   1.816
  197    HB2  GLU  24           2HB      GLU  24  14.533  14.286  -0.017
  198    HB3  GLU  24           1HB      GLU  24  13.880  15.844  -0.500
  199    HG2  GLU  24           2HG      GLU  24  16.084  15.610  -1.429
  200    HG3  GLU  24           1HG      GLU  24  16.128  16.863  -0.192
  201    H    GLY  25           H        GLY  25  12.684  13.844   0.874
  202    HA2  GLY  25           2HA      GLY  25  10.587  13.366   2.160
  203    HA3  GLY  25           1HA      GLY  25  10.238  15.085   2.017
  204    H    MET  26           H        MET  26   8.902  12.574   0.966
  205    HA   MET  26           HA       MET  26   8.790  13.113  -1.907
  206    HB2  MET  26           2HB      MET  26   7.356  11.066  -0.154
  207    HB3  MET  26           1HB      MET  26   7.190  11.170  -1.903
  208    HG2  MET  26           2HG      MET  26   9.563  10.636  -2.180
  209    HG3  MET  26           1HG      MET  26   9.764  10.575  -0.425
  210    HE1  MET  26           3HE      MET  26  10.076   6.812  -1.334
  211    HE2  MET  26           1HE      MET  26  10.754   8.146  -0.403
  212    HE3  MET  26           2HE      MET  26  10.744   8.215  -2.167
  213    H    THR  27           H        THR  27   6.094  12.692  -2.432
  214    HA   THR  27           HA       THR  27   4.840  15.137  -1.415
  215    HB   THR  27           HB       THR  27   3.738  13.191  -3.480
  216    HG1  THR  27           HG1      THR  27   5.923  14.811  -3.626
  217   HG21  THR  27          3HG2      THR  27   2.531  15.146  -4.352
  218   HG22  THR  27          1HG2      THR  27   3.245  16.173  -3.110
  219   HG23  THR  27          2HG2      THR  27   2.115  14.893  -2.655
  220    H    SER  28           H        SER  28   2.750  15.140  -0.505
  221    HA   SER  28           HA       SER  28   2.094  12.832   1.163
  222    HB2  SER  28           2HB      SER  28   0.429  14.417   2.200
  223    HB3  SER  28           1HB      SER  28   2.096  14.981   2.291
  224    HG   SER  28           HG       SER  28  -0.034  16.166   1.165
  225    H    ASP  29           H        ASP  29   0.980  11.309   0.157
  226    HA   ASP  29           HA       ASP  29  -1.237  11.976  -1.687
  227    HB2  ASP  29           2HB      ASP  29   0.788   9.704  -1.887
  228    HB3  ASP  29           1HB      ASP  29  -0.612   9.897  -2.932
  229    H    THR  30           H        THR  30  -2.889  11.682  -0.175
  230    HA   THR  30           HA       THR  30  -3.142   9.103   1.195
  231    HB   THR  30           HB       THR  30  -5.152  11.405   1.156
  232    HG1  THR  30           HG1      THR  30  -2.717  11.454   2.146
  233   HG21  THR  30          3HG2      THR  30  -5.915  10.453   3.302
  234   HG22  THR  30          1HG2      THR  30  -4.726   9.156   3.175
  235   HG23  THR  30          2HG2      THR  30  -6.056   9.256   2.016
  236    H    TYR  31           H        TYR  31  -3.214   7.786  -0.673
  237    HA   TYR  31           HA       TYR  31  -5.248   8.104  -2.716
  238    HB2  TYR  31           2HB      TYR  31  -3.237   5.876  -2.196
  239    HB3  TYR  31           1HB      TYR  31  -4.317   5.930  -3.581
  240    HD1  TYR  31           HD1      TYR  31  -4.140   8.758  -4.448
  241    HD2  TYR  31           HD2      TYR  31  -1.065   6.109  -3.101
  242    HE1  TYR  31           HE1      TYR  31  -2.490   9.985  -5.793
  243    HE2  TYR  31           HE2      TYR  31   0.580   7.341  -4.443
  244    HH   TYR  31           HH       TYR  31  -0.023  10.365  -5.799
  245    H    THR  32           H        THR  32  -7.280   7.578  -2.240
  246    HA   THR  32           HA       THR  32  -7.893   5.259  -0.483
  247    HB   THR  32           HB       THR  32  -9.992   6.612   0.129
  248    HG1  THR  32           HG1      THR  32  -8.672   8.974  -0.568
  249   HG21  THR  32          3HG2      THR  32  -8.828   8.068   1.768
  250   HG22  THR  32          1HG2      THR  32  -7.306   7.824   0.907
  251   HG23  THR  32          2HG2      THR  32  -8.095   6.464   1.709
  252    H    LYS  33           H        LYS  33  -8.868   7.222  -3.263
  253    HA   LYS  33           HA       LYS  33 -10.371   4.970  -4.403
  254    HB2  LYS  33           2HB      LYS  33 -11.909   6.531  -3.063
  255    HB3  LYS  33           1HB      LYS  33 -11.552   7.780  -4.245
  256    HG2  LYS  33           2HG      LYS  33 -13.658   6.899  -4.874
  257    HG3  LYS  33           1HG      LYS  33 -12.521   6.199  -6.017
  258    HD2  LYS  33           2HD      LYS  33 -13.425   4.681  -3.540
  259    HD3  LYS  33           1HD      LYS  33 -14.375   4.663  -5.022
  260    HE2  LYS  33           2HE      LYS  33 -12.518   3.635  -6.241
  261    HE3  LYS  33           1HE      LYS  33 -11.487   3.736  -4.814
  262    HZ1  LYS  33           3HZ      LYS  33 -13.103   2.262  -3.683
  263    HZ2  LYS  33           1HZ      LYS  33 -12.311   1.545  -4.996
  264    HZ3  LYS  33           2HZ      LYS  33 -13.907   2.071  -5.158
  265    H    VAL  34           H        VAL  34  -7.824   5.927  -5.023
  266    HA   VAL  34           HA       VAL  34  -6.464   6.212  -6.781
  267    HB   VAL  34           HB       VAL  34  -9.031   5.887  -8.378
  268   HG11  VAL  34          1HG1      VAL  34  -7.630   5.481 -10.395
  269   HG12  VAL  34          2HG1      VAL  34  -6.191   5.961  -9.492
  270   HG13  VAL  34          3HG1      VAL  34  -7.468   7.138  -9.810
  271   HG21  VAL  34          3HG2      VAL  34  -8.155   3.607  -8.835
  272   HG22  VAL  34          1HG2      VAL  34  -8.342   3.895  -7.104
  273   HG23  VAL  34          2HG2      VAL  34  -6.739   3.950  -7.837
  274    H    ASP  35           H        ASP  35  -5.378   7.999  -7.290
  275    HA   ASP  35           HA       ASP  35  -6.776  10.514  -7.878
  276    HB2  ASP  35           2HB      ASP  35  -4.905  10.592  -6.253
  277    HB3  ASP  35           1HB      ASP  35  -3.798   9.970  -7.470
  278    H    ASP  36           H        ASP  36  -3.712   9.394  -9.311
  279    HA   ASP  36           HA       ASP  36  -4.320   8.824 -11.925
  280    HB2  ASP  36           2HB      ASP  36  -5.508  10.939 -12.196
  281    HB3  ASP  36           1HB      ASP  36  -4.186  11.849 -11.487
  282    H    SER  37           H        SER  37  -2.312  10.839  -9.830
  283    HA   SER  37           HA       SER  37   0.037  10.984 -11.395
  284    HB2  SER  37           2HB      SER  37   1.094  11.697  -9.167
  285    HB3  SER  37           1HB      SER  37  -0.321  12.624  -9.668
  286    HG   SER  37           HG       SER  37  -1.343  11.952  -7.965
  287    H    GLN  38           H        GLN  38  -0.945   8.783  -8.826
  288    HA   GLN  38           HA       GLN  38   1.300   7.149  -8.635
  289    HB2  GLN  38           2HB      GLN  38  -0.304   5.417  -7.768
  290    HB3  GLN  38           1HB      GLN  38  -0.510   6.993  -7.020
  291    HG2  GLN  38           2HG      GLN  38  -2.430   7.420  -8.578
  292    HG3  GLN  38           1HG      GLN  38  -2.266   5.767  -9.161
  293   HE21  GLN  38          1HE2      GLN  38  -1.691   4.711  -6.455
  294   HE22  GLN  38          2HE2      GLN  38  -3.189   4.732  -5.611
  295    HA   PRO  39           HA       PRO  39   1.425   4.649 -12.491
  296    HB2  PRO  39           2HB      PRO  39   2.226   2.543 -10.456
  297    HB3  PRO  39           1HB      PRO  39   2.964   2.940 -12.027
  298    HG2  PRO  39           2HG      PRO  39   4.106   3.751  -9.774
  299    HG3  PRO  39           1HG      PRO  39   4.067   4.805 -11.207
  300    HD2  PRO  39           2HD      PRO  39   2.438   4.992  -8.691
  301    HD3  PRO  39           1HD      PRO  39   3.057   6.284  -9.741
  302    H    ALA  40           H        ALA  40   0.229   3.000 -13.443
  303    HA   ALA  40           HA       ALA  40  -2.388   2.435 -12.636
  304    HB1  ALA  40           3HB      ALA  40  -2.409   0.772 -14.463
  305    HB2  ALA  40           1HB      ALA  40  -0.646   0.846 -14.557
  306    HB3  ALA  40           2HB      ALA  40  -1.612   2.262 -14.974
  307    H    PHE  41           H        PHE  41   0.597   0.742 -12.053
  308    HA   PHE  41           HA       PHE  41  -0.324  -1.730 -11.068
  309    HB2  PHE  41           2HB      PHE  41   2.223  -0.257 -10.265
  310    HB3  PHE  41           1HB      PHE  41   1.935  -1.991 -10.171
  311    HD1  PHE  41           HD1      PHE  41   1.651  -3.304 -12.369
  312    HD2  PHE  41           HD2      PHE  41   3.105   0.721 -12.259
  313    HE1  PHE  41           HE1      PHE  41   2.614  -3.581 -14.616
  314    HE2  PHE  41           HE2      PHE  41   4.064   0.433 -14.503
  315    HZ   PHE  41           HZ       PHE  41   3.823  -1.716 -15.686
  316    H    ILE  42           H        ILE  42   0.103   1.421  -9.492
  317    HA   ILE  42           HA       ILE  42  -0.371   0.439  -6.800
  318    HB   ILE  42           HB       ILE  42  -0.430   3.358  -7.698
  319   HG12  ILE  42          2HG1      ILE  42   1.732   2.233  -8.407
  320   HG13  ILE  42          1HG1      ILE  42   1.954   3.546  -7.264
  321   HG21  ILE  42          1HG2      ILE  42   0.144   2.092  -4.979
  322   HG22  ILE  42          2HG2      ILE  42  -1.309   2.985  -5.432
  323   HG23  ILE  42          3HG2      ILE  42   0.240   3.819  -5.339
  324   HD11  ILE  42          3HD1      ILE  42   3.410   1.642  -6.799
  325   HD12  ILE  42          1HD1      ILE  42   1.993   0.614  -6.574
  326   HD13  ILE  42          2HD1      ILE  42   2.297   1.954  -5.468
  327    H    ASN  43           H        ASN  43  -2.318   1.612  -9.473
  328    HA   ASN  43           HA       ASN  43  -4.718   2.235  -8.027
  329    HB2  ASN  43           2HB      ASN  43  -4.328   1.363 -10.923
  330    HB3  ASN  43           1HB      ASN  43  -5.840   1.948 -10.252
  331   HD21  ASN  43          1HD2      ASN  43  -4.730   4.095  -8.677
  332   HD22  ASN  43          2HD2      ASN  43  -4.190   5.296  -9.792
  333    H    ASP  44           H        ASP  44  -3.320  -0.674  -9.470
  334    HA   ASP  44           HA       ASP  44  -5.414  -2.507  -9.054
  335    HB2  ASP  44           2HB      ASP  44  -3.487  -3.092 -10.436
  336    HB3  ASP  44           1HB      ASP  44  -2.397  -2.911  -9.068
  337    H    ILE  45           H        ILE  45  -2.777  -1.451  -6.915
  338    HA   ILE  45           HA       ILE  45  -3.203  -3.116  -4.710
  339    HB   ILE  45           HB       ILE  45  -2.252  -0.212  -4.654
  340   HG12  ILE  45          2HG1      ILE  45  -0.653  -2.803  -4.852
  341   HG13  ILE  45          1HG1      ILE  45  -0.827  -1.586  -6.110
  342   HG21  ILE  45          1HG2      ILE  45  -1.171  -0.750  -2.501
  343   HG22  ILE  45          2HG2      ILE  45  -1.870  -2.370  -2.547
  344   HG23  ILE  45          3HG2      ILE  45  -2.920  -0.961  -2.411
  345   HD11  ILE  45          3HD1      ILE  45   0.402   0.021  -4.696
  346   HD12  ILE  45          1HD1      ILE  45   1.342  -1.423  -5.073
  347   HD13  ILE  45          2HD1      ILE  45   0.614  -1.243  -3.479
  348    H    LEU  46           H        LEU  46  -4.633   0.077  -5.426
  349    HA   LEU  46           HA       LEU  46  -6.309   0.223  -3.145
  350    HB2  LEU  46           2HB      LEU  46  -6.511   1.546  -5.869
  351    HB3  LEU  46           1HB      LEU  46  -7.583   1.937  -4.531
  352    HG   LEU  46           HG       LEU  46  -4.556   2.286  -4.469
  353   HD11  LEU  46          1HD1      LEU  46  -5.622   3.875  -6.026
  354   HD12  LEU  46          2HD1      LEU  46  -4.932   4.668  -4.619
  355   HD13  LEU  46          3HD1      LEU  46  -6.677   4.436  -4.725
  356   HD21  LEU  46          3HD2      LEU  46  -6.666   3.141  -2.451
  357   HD22  LEU  46          1HD2      LEU  46  -4.942   3.520  -2.366
  358   HD23  LEU  46          2HD2      LEU  46  -5.481   1.848  -2.238
  359    H    LYS  47           H        LYS  47  -6.830  -1.248  -6.325
  360    HA   LYS  47           HA       LYS  47  -9.629  -1.854  -5.839
  361    HB2  LYS  47           2HB      LYS  47  -7.723  -2.310  -8.124
  362    HB3  LYS  47           1HB      LYS  47  -9.135  -3.356  -8.028
  363    HG2  LYS  47           2HG      LYS  47  -9.550  -1.448  -9.498
  364    HG3  LYS  47           1HG      LYS  47 -10.626  -1.425  -8.099
  365    HD2  LYS  47           2HD      LYS  47  -9.162   0.291  -7.032
  366    HD3  LYS  47           1HD      LYS  47  -8.133   0.287  -8.468
  367    HE2  LYS  47           2HE      LYS  47 -11.054   1.105  -8.342
  368    HE3  LYS  47           1HE      LYS  47  -9.669   2.180  -8.545
  369    HZ1  LYS  47           3HZ      LYS  47 -10.600   0.117 -10.465
  370    HZ2  LYS  47           1HZ      LYS  47  -9.183   1.023 -10.645
  371    HZ3  LYS  47           2HZ      LYS  47 -10.683   1.792 -10.652
  372    H    VAL  48           H        VAL  48  -6.788  -3.265  -4.735
  373    HA   VAL  48           HA       VAL  48  -7.725  -5.939  -4.363
  374    HB   VAL  48           HB       VAL  48  -5.755  -4.291  -2.699
  375   HG11  VAL  48          1HG1      VAL  48  -6.304  -7.283  -2.533
  376   HG12  VAL  48          2HG1      VAL  48  -6.664  -6.080  -1.291
  377   HG13  VAL  48          3HG1      VAL  48  -4.990  -6.437  -1.711
  378   HG21  VAL  48          3HG2      VAL  48  -5.216  -6.426  -4.803
  379   HG22  VAL  48          1HG2      VAL  48  -3.995  -5.595  -3.838
  380   HG23  VAL  48          2HG2      VAL  48  -4.964  -4.690  -4.999
  381    H    GLU  49           H        GLU  49  -9.640  -6.325  -3.359
  382    HA   GLU  49           HA       GLU  49 -10.817  -4.808  -1.272
  383    HB2  GLU  49           2HB      GLU  49 -11.127  -7.765  -1.960
  384    HB3  GLU  49           1HB      GLU  49 -12.125  -6.913  -0.787
  385    HG2  GLU  49           2HG      GLU  49 -11.976  -6.350  -3.764
  386    HG3  GLU  49           1HG      GLU  49 -13.297  -7.152  -2.911
  387    H    GLY  50           H        GLY  50  -9.291  -4.267   0.209
  388    HA2  GLY  50           2HA      GLY  50  -8.609  -5.786   2.380
  389    HA3  GLY  50           1HA      GLY  50  -7.331  -6.108   1.212
  390    H    VAL  51           H        VAL  51  -7.009  -3.658  -0.010
  391    HA   VAL  51           HA       VAL  51  -5.133  -2.617   1.891
  392    HB   VAL  51           HB       VAL  51  -5.795  -1.738  -0.951
  393   HG11  VAL  51          1HG1      VAL  51  -3.463  -0.808   0.793
  394   HG12  VAL  51          2HG1      VAL  51  -4.814   0.197   0.261
  395   HG13  VAL  51          3HG1      VAL  51  -3.675  -0.444  -0.920
  396   HG21  VAL  51          3HG2      VAL  51  -3.700  -2.914  -1.522
  397   HG22  VAL  51          1HG2      VAL  51  -4.832  -4.010  -0.728
  398   HG23  VAL  51          2HG2      VAL  51  -3.463  -3.351   0.171
  399    H    LYS  52           H        LYS  52  -8.072  -1.263   0.469
  400    HA   LYS  52           HA       LYS  52  -9.536   0.325   1.014
  401    HB2  LYS  52           2HB      LYS  52  -9.488  -0.663   3.281
  402    HB3  LYS  52           1HB      LYS  52  -8.120   0.353   3.698
  403    HG2  LYS  52           2HG      LYS  52  -9.893   2.289   2.993
  404    HG3  LYS  52           1HG      LYS  52 -11.024   1.049   3.525
  405    HD2  LYS  52           2HD      LYS  52  -8.781   2.304   5.150
  406    HD3  LYS  52           1HD      LYS  52 -10.512   2.550   5.375
  407    HE2  LYS  52           2HE      LYS  52 -10.792   0.263   6.121
  408    HE3  LYS  52           1HE      LYS  52  -9.114  -0.119   5.735
  409    HZ1  LYS  52           3HZ      LYS  52  -8.430   1.495   7.422
  410    HZ2  LYS  52           1HZ      LYS  52  -9.362   0.246   8.074
  411    HZ3  LYS  52           2HZ      LYS  52 -10.050   1.765   7.823
  412    H    SER  53           H        SER  53  -6.625   1.467   2.735
  413    HA   SER  53           HA       SER  53  -6.601   3.938   1.104
  414    HB2  SER  53           2HB      SER  53  -7.814   4.396   3.221
  415    HB3  SER  53           1HB      SER  53  -6.432   3.815   4.148
  416    HG   SER  53           HG       SER  53  -5.228   5.556   3.348
  417    H    ILE  54           H        ILE  54  -4.637   4.979   0.955
  418    HA   ILE  54           HA       ILE  54  -2.164   3.693   1.951
  419    HB   ILE  54           HB       ILE  54  -2.713   4.798  -0.858
  420   HG12  ILE  54          2HG1      ILE  54  -1.810   2.017   0.022
  421   HG13  ILE  54          1HG1      ILE  54  -3.430   2.442  -0.513
  422   HG21  ILE  54          1HG2      ILE  54  -0.015   3.949   0.265
  423   HG22  ILE  54          2HG2      ILE  54  -0.500   5.594  -0.145
  424   HG23  ILE  54          3HG2      ILE  54  -0.337   4.385  -1.414
  425   HD11  ILE  54          3HD1      ILE  54  -2.255   1.315  -2.271
  426   HD12  ILE  54          1HD1      ILE  54  -0.918   2.459  -2.178
  427   HD13  ILE  54          2HD1      ILE  54  -2.501   2.996  -2.743
  428    H    PHE  55           H        PHE  55  -1.543   5.199   3.459
  429    HA   PHE  55           HA       PHE  55  -1.747   8.077   2.837
  430    HB2  PHE  55           2HB      PHE  55  -2.681   7.325   5.022
  431    HB3  PHE  55           1HB      PHE  55  -1.100   6.706   5.489
  432    HD1  PHE  55           HD1      PHE  55  -2.741   9.886   4.333
  433    HD2  PHE  55           HD2      PHE  55   0.327   8.125   6.740
  434    HE1  PHE  55           HE1      PHE  55  -2.159  12.103   5.213
  435    HE2  PHE  55           HE2      PHE  55   0.903  10.347   7.620
  436    HZ   PHE  55           HZ       PHE  55  -0.339  12.337   6.862
  437    H    HIS  56           H        HIS  56  -0.075   8.272   1.415
  438    HA   HIS  56           HA       HIS  56   2.675   7.532   2.153
  439    HB2  HIS  56           2HB      HIS  56   1.969   6.974  -0.109
  440    HB3  HIS  56           1HB      HIS  56   1.379   8.606  -0.399
  441    HD1  HIS  56           HD1      HIS  56   2.908   9.934  -1.814
  442    HD2  HIS  56           HD2      HIS  56   4.980   7.091   0.402
  443    HE1  HIS  56           HE1      HIS  56   5.293  10.110  -2.568
  444    HE2  HIS  56           HE2      HIS  56   6.500   8.299  -1.301
  445    H    VAL  57           H        VAL  57   4.150   9.030   2.862
  446    HA   VAL  57           HA       VAL  57   4.212  11.748   2.062
  447    HB   VAL  57           HB       VAL  57   2.302  11.914   3.710
  448   HG11  VAL  57          1HG1      VAL  57   2.965  10.187   5.303
  449   HG12  VAL  57          2HG1      VAL  57   2.667  11.726   6.111
  450   HG13  VAL  57          3HG1      VAL  57   4.323  11.181   5.832
  451   HG21  VAL  57          3HG2      VAL  57   3.112  13.893   4.947
  452   HG22  VAL  57          1HG2      VAL  57   3.661  13.918   3.267
  453   HG23  VAL  57          2HG2      VAL  57   4.778  13.462   4.557
  454    H    MET  58           H        MET  58   6.074  12.860   2.915
  455    HA   MET  58           HA       MET  58   8.293  12.911   2.894
  456    HB2  MET  58           2HB      MET  58   9.383  12.504   5.128
  457    HB3  MET  58           1HB      MET  58   7.989  13.564   5.135
  458    HG2  MET  58           2HG      MET  58   6.619  11.844   6.130
  459    HG3  MET  58           1HG      MET  58   7.924  10.667   5.981
  460    HE1  MET  58           3HE      MET  58   8.307  14.462   7.054
  461    HE2  MET  58           1HE      MET  58   8.173  14.342   8.809
  462    HE3  MET  58           2HE      MET  58   6.769  14.014   7.794
  463    H    ASP  59           H        ASP  59   8.303   9.735   4.654
  464    HA   ASP  59           HA       ASP  59   9.959   8.637   2.469
  465    HB2  ASP  59           2HB      ASP  59  11.777   8.019   3.927
  466    HB3  ASP  59           1HB      ASP  59  11.479   9.733   4.163
  467    H    PHE  60           H        PHE  60   7.212   8.112   3.685
  468    HA   PHE  60           HA       PHE  60   7.506   5.209   3.846
  469    HB2  PHE  60           2HB      PHE  60   6.301   4.965   5.944
  470    HB3  PHE  60           1HB      PHE  60   7.716   5.972   6.191
  471    HD1  PHE  60           HD2      PHE  60   7.465   8.409   6.662
  472    HD2  PHE  60           HD1      PHE  60   4.047   5.868   6.265
  473    HE1  PHE  60           HE2      PHE  60   6.067  10.088   7.774
  474    HE2  PHE  60           HE1      PHE  60   2.662   7.563   7.373
  475    HZ   PHE  60           HZ       PHE  60   3.668   9.676   8.118
  476    H    ILE  61           H        ILE  61   5.450   4.062   3.979
  477    HA   ILE  61           HA       ILE  61   3.106   5.391   2.764
  478    HB   ILE  61           HB       ILE  61   4.258   2.651   1.969
  479   HG12  ILE  61          2HG1      ILE  61   4.005   5.215   0.309
  480   HG13  ILE  61          1HG1      ILE  61   5.506   4.549   0.937
  481   HG21  ILE  61          1HG2      ILE  61   1.738   4.036   0.955
  482   HG22  ILE  61          2HG2      ILE  61   1.798   2.603   1.983
  483   HG23  ILE  61          3HG2      ILE  61   2.399   2.524   0.329
  484   HD11  ILE  61          3HD1      ILE  61   5.277   4.091  -1.421
  485   HD12  ILE  61          1HD1      ILE  61   3.732   3.287  -1.150
  486   HD13  ILE  61          2HD1      ILE  61   5.218   2.580  -0.513
  487    H    SER  62           H        SER  62   1.857   5.352   4.624
  488    HA   SER  62           HA       SER  62   1.629   3.004   6.297
  489    HB2  SER  62           2HB      SER  62   0.108   5.640   6.350
  490    HB3  SER  62           1HB      SER  62  -0.054   4.356   7.555
  491    HG   SER  62           HG       SER  62   2.500   5.307   6.946
  492    H    VAL  63           H        VAL  63   0.793   1.355   5.094
  493    HA   VAL  63           HA       VAL  63  -1.567   1.672   3.430
  494    HB   VAL  63           HB       VAL  63  -0.054  -0.861   4.251
  495   HG11  VAL  63          1HG1      VAL  63  -2.390  -1.427   3.693
  496   HG12  VAL  63          2HG1      VAL  63  -1.307  -2.013   2.433
  497   HG13  VAL  63          3HG1      VAL  63  -2.263  -0.552   2.164
  498   HG21  VAL  63          3HG2      VAL  63   0.001   0.690   1.627
  499   HG22  VAL  63          1HG2      VAL  63   0.864  -0.816   1.954
  500   HG23  VAL  63          2HG2      VAL  63   1.290   0.653   2.832
  501    H    ASP  64           H        ASP  64  -3.380   2.045   4.475
  502    HA   ASP  64           HA       ASP  64  -4.006   0.851   7.075
  503    HB2  ASP  64           2HB      ASP  64  -4.323   3.271   6.890
  504    HB3  ASP  64           1HB      ASP  64  -5.361   3.065   5.497
  505    H    LYS  65           H        LYS  65  -4.386  -1.268   6.362
  506    HA   LYS  65           HA       LYS  65  -6.325  -1.856   4.329
  507    HB2  LYS  65           2HB      LYS  65  -5.885  -4.168   4.721
  508    HB3  LYS  65           1HB      LYS  65  -4.340  -3.340   4.867
  509    HG2  LYS  65           2HG      LYS  65  -4.304  -3.592   7.228
  510    HG3  LYS  65           1HG      LYS  65  -6.008  -4.029   7.291
  511    HD2  LYS  65           2HD      LYS  65  -5.427  -6.132   5.999
  512    HD3  LYS  65           1HD      LYS  65  -3.723  -5.702   6.203
  513    HE2  LYS  65           2HE      LYS  65  -4.441  -7.315   7.912
  514    HE3  LYS  65           1HE      LYS  65  -3.986  -5.781   8.649
  515    HZ1  LYS  65           3HZ      LYS  65  -6.342  -5.220   8.796
  516    HZ2  LYS  65           1HZ      LYS  65  -6.000  -6.651   9.623
  517    HZ3  LYS  65           2HZ      LYS  65  -6.755  -6.704   8.118
  518    H    GLU  66           H        GLU  66  -8.064  -3.557   4.927
  519    HA   GLU  66           HA       GLU  66  -9.954  -2.316   6.697
  520    HB2  GLU  66           2HB      GLU  66 -10.143  -4.967   5.210
  521    HB3  GLU  66           1HB      GLU  66 -11.486  -4.052   5.896
  522    HG2  GLU  66           2HG      GLU  66 -11.104  -2.242   4.299
  523    HG3  GLU  66           1HG      GLU  66  -9.713  -3.096   3.631
  524    H    ASN  67           H        ASN  67 -11.311  -3.981   8.124
  525    HA   ASN  67           HA       ASN  67  -9.586  -4.739  10.276
  526    HB2  ASN  67           2HB      ASN  67 -12.575  -5.206   9.897
  527    HB3  ASN  67           1HB      ASN  67 -11.695  -5.546  11.384
  528   HD21  ASN  67          1HD2      ASN  67 -13.165  -3.095   9.455
  529   HD22  ASN  67          2HD2      ASN  67 -12.862  -1.770  10.522
  530    H    ASP  68           H        ASP  68 -11.907  -6.732   8.364
  531    HA   ASP  68           HA       ASP  68 -10.959  -9.186   9.487
  532    HB2  ASP  68           2HB      ASP  68 -13.313  -8.757   8.642
  533    HB3  ASP  68           1HB      ASP  68 -12.695  -8.847   6.997
  534    H    ALA  69           H        ALA  69 -10.538  -7.607   6.341
  535    HA   ALA  69           HA       ALA  69  -9.181  -9.557   4.879
  536    HB1  ALA  69           3HB      ALA  69 -10.059  -7.471   3.885
  537    HB2  ALA  69           1HB      ALA  69  -8.358  -7.704   3.479
  538    HB3  ALA  69           2HB      ALA  69  -8.817  -6.542   4.725
  539    H    ASN  70           H        ASN  70  -7.194 -10.439   5.060
  540    HA   ASN  70           HA       ASN  70  -5.531  -9.582   7.344
  541    HB2  ASN  70           2HB      ASN  70  -6.483 -11.919   7.194
  542    HB3  ASN  70           1HB      ASN  70  -5.511 -12.188   5.753
  543   HD21  ASN  70          1HD2      ASN  70  -4.493 -13.959   6.771
  544   HD22  ASN  70          2HD2      ASN  70  -3.288 -13.729   7.992
  545    H    TRP  71           H        TRP  71  -3.173  -9.525   7.187
  546    HA   TRP  71           HA       TRP  71  -2.145  -8.197   4.906
  547    HB2  TRP  71           2HB      TRP  71  -0.724  -9.460   7.278
  548    HB3  TRP  71           1HB      TRP  71   0.149  -8.613   6.004
  549    HD1  TRP  71           HD1      TRP  71  -1.461  -7.951   9.275
  550    HE1  TRP  71           HE1      TRP  71  -1.724  -5.422   9.666
  551    HE3  TRP  71           HE3      TRP  71  -0.475  -6.257   4.535
  552    HZ2  TRP  71           HZ2      TRP  71  -1.533  -3.037   8.196
  553    HZ3  TRP  71           HZ3      TRP  71  -0.536  -3.830   4.121
  554    HH2  TRP  71           HH2      TRP  71  -1.053  -2.252   5.915
  555    H    GLU  72           H        GLU  72  -2.424 -11.609   5.528
  556    HA   GLU  72           HA       GLU  72  -0.385 -12.502   3.740
  557    HB2  GLU  72           2HB      GLU  72  -2.879 -13.996   4.615
  558    HB3  GLU  72           1HB      GLU  72  -1.416 -14.712   3.947
  559    HG2  GLU  72           2HG      GLU  72  -1.705 -13.330   6.634
  560    HG3  GLU  72           1HG      GLU  72  -1.482 -15.053   6.349
  561    H    THR  73           H        THR  73  -3.609 -11.298   3.232
  562    HA   THR  73           HA       THR  73  -3.572 -11.964   0.372
  563    HB   THR  73           HB       THR  73  -5.629 -10.393   2.002
  564    HG1  THR  73           HG1      THR  73  -5.312 -13.125   1.334
  565   HG21  THR  73          3HG2      THR  73  -5.726  -9.841  -0.428
  566   HG22  THR  73          1HG2      THR  73  -7.147 -10.755   0.085
  567   HG23  THR  73          2HG2      THR  73  -5.856 -11.558  -0.810
  568    H    VAL  74           H        VAL  74  -3.424  -9.134   2.521
  569    HA   VAL  74           HA       VAL  74  -3.519  -7.146   0.472
  570    HB   VAL  74           HB       VAL  74  -2.711  -6.885   3.409
  571   HG11  VAL  74          1HG1      VAL  74  -1.882  -4.948   2.132
  572   HG12  VAL  74          2HG1      VAL  74  -3.217  -4.469   3.179
  573   HG13  VAL  74          3HG1      VAL  74  -3.489  -4.688   1.449
  574   HG21  VAL  74          3HG2      VAL  74  -5.021  -6.102   3.783
  575   HG22  VAL  74          1HG2      VAL  74  -5.013  -7.741   3.131
  576   HG23  VAL  74          2HG2      VAL  74  -5.406  -6.376   2.082
  577    H    LEU  75           H        LEU  75  -0.858  -8.101   2.667
  578    HA   LEU  75           HA       LEU  75   1.043  -6.264   1.783
  579    HB2  LEU  75           2HB      LEU  75   0.999  -7.583   3.954
  580    HB3  LEU  75           1HB      LEU  75   1.661  -8.947   3.081
  581    HG   LEU  75           HG       LEU  75   3.139  -6.283   3.304
  582   HD11  LEU  75          1HD1      LEU  75   2.740  -7.110   5.585
  583   HD12  LEU  75          2HD1      LEU  75   4.445  -7.235   5.158
  584   HD13  LEU  75          3HD1      LEU  75   3.428  -8.678   5.156
  585   HD21  LEU  75          3HD2      LEU  75   3.997  -7.721   1.508
  586   HD22  LEU  75          1HD2      LEU  75   4.158  -9.075   2.628
  587   HD23  LEU  75          2HD2      LEU  75   5.157  -7.635   2.827
  588    HA   PRO  76           HA       PRO  76   3.156  -9.848  -0.956
  589    HB2  PRO  76           2HB      PRO  76   1.379 -11.643  -2.147
  590    HB3  PRO  76           1HB      PRO  76   2.286 -11.985  -0.658
  591    HG2  PRO  76           2HG      PRO  76  -0.526 -10.975  -0.953
  592    HG3  PRO  76           1HG      PRO  76   0.099 -12.274   0.097
  593    HD2  PRO  76           2HD      PRO  76  -0.375  -9.860   1.129
  594    HD3  PRO  76           1HD      PRO  76   1.088 -10.751   1.609
  595    H    LYS  77           H        LYS  77  -0.085  -8.625  -1.666
  596    HA   LYS  77           HA       LYS  77   0.232  -8.387  -4.512
  597    HB2  LYS  77           2HB      LYS  77  -1.774  -7.174  -2.571
  598    HB3  LYS  77           1HB      LYS  77  -1.871  -6.974  -4.321
  599    HG2  LYS  77           2HG      LYS  77  -2.131  -9.376  -4.631
  600    HG3  LYS  77           1HG      LYS  77  -1.914  -9.656  -2.900
  601    HD2  LYS  77           2HD      LYS  77  -3.999  -8.554  -2.385
  602    HD3  LYS  77           1HD      LYS  77  -4.168  -7.979  -4.044
  603    HE2  LYS  77           2HE      LYS  77  -4.254 -10.891  -3.202
  604    HE3  LYS  77           1HE      LYS  77  -5.662  -9.883  -3.548
  605    HZ1  LYS  77           3HZ      LYS  77  -4.703  -9.538  -5.801
  606    HZ2  LYS  77           1HZ      LYS  77  -5.174 -11.128  -5.481
  607    HZ3  LYS  77           2HZ      LYS  77  -3.540 -10.708  -5.442
  608    H    VAL  78           H        VAL  78   0.550  -6.151  -1.781
  609    HA   VAL  78           HA       VAL  78   1.158  -3.787  -3.258
  610    HB   VAL  78           HB       VAL  78   2.047  -4.511  -0.416
  611   HG11  VAL  78          1HG1      VAL  78   1.792  -1.775  -1.731
  612   HG12  VAL  78          2HG1      VAL  78   3.298  -2.584  -1.292
  613   HG13  VAL  78          3HG1      VAL  78   2.180  -2.061  -0.031
  614   HG21  VAL  78          3HG2      VAL  78  -0.405  -4.692  -0.624
  615   HG22  VAL  78          1HG2      VAL  78  -0.484  -3.059  -1.293
  616   HG23  VAL  78          2HG2      VAL  78   0.037  -3.307   0.375
  617    H    GLU  79           H        GLU  79   3.169  -6.241  -1.692
  618    HA   GLU  79           HA       GLU  79   5.726  -5.285  -2.343
  619    HB2  GLU  79           2HB      GLU  79   5.263  -7.027  -0.633
  620    HB3  GLU  79           1HB      GLU  79   4.791  -8.153  -1.899
  621    HG2  GLU  79           2HG      GLU  79   7.152  -7.987  -2.801
  622    HG3  GLU  79           1HG      GLU  79   7.566  -7.045  -1.371
  623    H    ALA  80           H        ALA  80   3.493  -7.392  -4.093
  624    HA   ALA  80           HA       ALA  80   5.204  -8.318  -6.148
  625    HB1  ALA  80           3HB      ALA  80   3.151  -9.019  -7.302
  626    HB2  ALA  80           1HB      ALA  80   2.183  -8.037  -6.193
  627    HB3  ALA  80           2HB      ALA  80   3.085  -9.427  -5.587
  628    H    VAL  81           H        VAL  81   3.388  -5.347  -5.779
  629    HA   VAL  81           HA       VAL  81   3.508  -4.481  -8.505
  630    HB   VAL  81           HB       VAL  81   3.024  -3.051  -5.870
  631   HG11  VAL  81          1HG1      VAL  81   4.046  -1.347  -7.258
  632   HG12  VAL  81          2HG1      VAL  81   2.311  -1.044  -7.194
  633   HG13  VAL  81          3HG1      VAL  81   3.027  -1.778  -8.630
  634   HG21  VAL  81          3HG2      VAL  81   1.240  -4.543  -6.624
  635   HG22  VAL  81          1HG2      VAL  81   1.207  -3.763  -8.209
  636   HG23  VAL  81          2HG2      VAL  81   0.711  -2.871  -6.774
  637    H    PHE  82           H        PHE  82   5.580  -3.885  -5.662
  638    HA   PHE  82           HA       PHE  82   7.588  -2.426  -7.062
  639    HB2  PHE  82           2HB      PHE  82   7.955  -4.113  -4.557
  640    HB3  PHE  82           1HB      PHE  82   8.939  -2.740  -5.071
  641    HD1  PHE  82           HD2      PHE  82   7.161  -0.613  -5.734
  642    HD2  PHE  82           HD1      PHE  82   6.691  -3.555  -2.667
  643    HE1  PHE  82           HE2      PHE  82   5.645   0.891  -4.520
  644    HE2  PHE  82           HE1      PHE  82   5.170  -2.048  -1.471
  645    HZ   PHE  82           HZ       PHE  82   4.645   0.156  -2.402
  646    H    GLU  83           H        GLU  83   7.130  -5.888  -6.453
  647    HA   GLU  83           HA       GLU  83   9.514  -6.552  -8.074
  648    HB2  GLU  83           2HB      GLU  83   9.351  -7.191  -5.480
  649    HB3  GLU  83           1HB      GLU  83   8.306  -8.476  -6.056
  650    HG2  GLU  83           2HG      GLU  83  11.213  -8.036  -6.791
  651    HG3  GLU  83           1HG      GLU  83  10.572  -9.283  -5.733
  652    H    LEU  84           H        LEU  84   8.115  -6.302  -9.886
  653    HA   LEU  84           HA       LEU  84   5.731  -7.901 -10.298
  654    HB2  LEU  84           2HB      LEU  84   7.376  -6.063 -12.084
  655    HB3  LEU  84           1HB      LEU  84   5.915  -6.862 -12.639
  656    HG   LEU  84           HG       LEU  84   5.940  -4.939 -10.280
  657   HD11  LEU  84          1HD1      LEU  84   6.664  -3.696 -12.260
  658   HD12  LEU  84          2HD1      LEU  84   5.030  -3.227 -11.801
  659   HD13  LEU  84          3HD1      LEU  84   5.282  -4.303 -13.177
  660   HD21  LEU  84          3HD2      LEU  84   3.657  -6.001 -11.980
  661   HD22  LEU  84          1HD2      LEU  84   3.508  -4.827 -10.667
  662   HD23  LEU  84          2HD2      LEU  84   4.026  -6.475 -10.322
  663    H    GLU  85           H        GLU  85   7.935  -9.630  -9.756
  664    HA   GLU  85           HA       GLU  85   9.035 -11.479 -10.434
  665    HB2  GLU  85           2HB      GLU  85   6.874 -12.102 -11.507
  666    HB3  GLU  85           1HB      GLU  85   7.308 -11.194 -12.944
  667    HG2  GLU  85           2HG      GLU  85   7.505 -13.586 -13.319
  668    HG3  GLU  85           1HG      GLU  85   9.074 -12.802 -13.462
  669    H    HIS  86           H        HIS  86  10.726 -12.229 -12.251
  670    HA   HIS  86           HA       HIS  86  12.261  -9.923 -13.160
  671    HB2  HIS  86           2HB      HIS  86  13.289 -12.107 -12.286
  672    HB3  HIS  86           1HB      HIS  86  12.799 -12.862 -13.803
  673    HD1  HIS  86           HD1      HIS  86  14.712 -12.965 -15.381
  674    HD2  HIS  86           HD2      HIS  86  14.872  -9.560 -13.002
  675    HE1  HIS  86           HE1      HIS  86  16.775 -11.734 -16.113
  676    HE2  HIS  86           HE2      HIS  86  16.960  -9.786 -14.517
  677    H    HIS  87           H        HIS  87  10.266  -9.243 -14.305
  678    HA   HIS  87           HA       HIS  87  10.146  -9.696 -17.093
  679    HB2  HIS  87           2HB      HIS  87   9.064 -11.834 -16.460
  680    HB3  HIS  87           1HB      HIS  87   7.959 -11.000 -15.379
  681    HD1  HIS  87           HD1      HIS  87   5.845 -10.038 -16.397
  682    HD2  HIS  87           HD2      HIS  87   8.470 -11.536 -19.249
  683    HE1  HIS  87           HE1      HIS  87   4.550 -10.072 -18.545
  684    HE2  HIS  87           HE2      HIS  87   6.094 -11.146 -20.214
  685    H    HIS  88           H        HIS  88  10.223  -7.471 -17.105
  686    HA   HIS  88           HA       HIS  88   8.675  -5.733 -15.449
  687    HB2  HIS  88           2HB      HIS  88  10.913  -5.165 -16.406
  688    HB3  HIS  88           1HB      HIS  88  10.211  -5.135 -18.018
  689    HD1  HIS  88           HD1      HIS  88   9.670  -2.834 -18.802
  690    HD2  HIS  88           HD2      HIS  88   9.512  -3.108 -14.656
  691    HE1  HIS  88           HE1      HIS  88   9.203  -0.507 -17.993
  692    HE2  HIS  88           HE2      HIS  88   8.908  -0.744 -15.503
  693    H    HIS  89           H        HIS  89   7.920  -7.424 -18.301
  694    HA   HIS  89           HA       HIS  89   5.951  -7.875 -19.257
  695    HB2  HIS  89           2HB      HIS  89   4.674  -7.281 -17.270
  696    HB3  HIS  89           1HB      HIS  89   4.802  -5.567 -17.646
  697    HD1  HIS  89           HD1      HIS  89   2.689  -4.680 -18.560
  698    HD2  HIS  89           HD2      HIS  89   3.239  -8.651 -19.638
  699    HE1  HIS  89           HE1      HIS  89   0.666  -5.290 -19.919
  700    HE2  HIS  89           HE2      HIS  89   1.093  -7.656 -20.677
  701    H    HIS  90           H        HIS  90   6.244  -4.317 -19.094
  702    HA   HIS  90           HA       HIS  90   6.055  -2.655 -20.586
  703    HB2  HIS  90           2HB      HIS  90   7.607  -2.677 -22.466
  704    HB3  HIS  90           1HB      HIS  90   8.358  -3.422 -21.065
  705    HD1  HIS  90           HD1      HIS  90   9.180  -5.824 -21.333
  706    HD2  HIS  90           HD2      HIS  90   7.041  -4.471 -24.635
  707    HE1  HIS  90           HE1      HIS  90   9.532  -7.558 -23.125
  708    HE2  HIS  90           HE2      HIS  90   8.318  -6.668 -25.144
  709    H    HIS  91           H        HIS  91   5.827  -2.430 -23.369
  710    HA   HIS  91           HA       HIS  91   3.902  -4.334 -24.397
  711    HB2  HIS  91           2HB      HIS  91   2.115  -2.720 -24.927
  712    HB3  HIS  91           1HB      HIS  91   2.382  -2.773 -23.193
  713    HD1  HIS  91           HD1      HIS  91   2.697  -0.524 -26.164
  714    HD2  HIS  91           HD2      HIS  91   3.319  -0.366 -22.056
  715    HE1  HIS  91           HE1      HIS  91   3.000   1.907 -25.623
  716    HE2  HIS  91           HE2      HIS  91   3.489   1.974 -23.155
  Start of MODEL   10
    1    H1   MET   1           1H       MET   1  13.502   1.879  -4.090
    2    H2   MET   1           2H       MET   1  13.121   2.061  -2.461
    3    H3   MET   1           3H       MET   1  13.088   3.402  -3.484
    4    HA   MET   1           HA       MET   1  10.862   2.687  -3.025
    5    HB2  MET   1           2HB      MET   1  11.752   2.006  -5.869
    6    HB3  MET   1           1HB      MET   1  10.090   2.335  -5.385
    7    HG2  MET   1           2HG      MET   1  10.697   4.619  -4.761
    8    HG3  MET   1           1HG      MET   1  12.382   4.300  -5.168
    9    HE1  MET   1           3HE      MET   1  12.466   6.445  -6.731
   10    HE2  MET   1           1HE      MET   1  10.787   6.810  -6.307
   11    HE3  MET   1           2HE      MET   1  11.286   6.767  -7.998
   12    H    LYS   2           H        LYS   2  11.810   0.797  -1.593
   13    HA   LYS   2           HA       LYS   2  10.542  -1.713  -2.503
   14    HB2  LYS   2           2HB      LYS   2  13.335  -1.495  -1.289
   15    HB3  LYS   2           1HB      LYS   2  12.446  -3.009  -1.410
   16    HG2  LYS   2           2HG      LYS   2  12.407  -2.724  -3.893
   17    HG3  LYS   2           1HG      LYS   2  13.418  -1.294  -3.712
   18    HD2  LYS   2           2HD      LYS   2  14.266  -4.042  -2.716
   19    HD3  LYS   2           1HD      LYS   2  14.599  -3.476  -4.351
   20    HE2  LYS   2           2HE      LYS   2  16.574  -3.098  -3.037
   21    HE3  LYS   2           1HE      LYS   2  15.838  -1.528  -3.350
   22    HZ1  LYS   2           3HZ      LYS   2  15.534  -3.068  -0.828
   23    HZ2  LYS   2           1HZ      LYS   2  14.953  -1.507  -1.136
   24    HZ3  LYS   2           2HZ      LYS   2  16.614  -1.788  -1.066
   25    H    ILE   3           H        ILE   3  10.659  -3.298  -0.397
   26    HA   ILE   3           HA       ILE   3   9.510  -1.819   1.876
   27    HB   ILE   3           HB       ILE   3   9.794  -4.850   1.595
   28   HG12  ILE   3          2HG1      ILE   3   7.347  -3.158   0.875
   29   HG13  ILE   3          1HG1      ILE   3   8.425  -3.904  -0.296
   30   HG21  ILE   3          1HG2      ILE   3   7.995  -3.170   3.397
   31   HG22  ILE   3          2HG2      ILE   3   9.439  -4.047   3.907
   32   HG23  ILE   3          3HG2      ILE   3   8.028  -4.936   3.333
   33   HD11  ILE   3          3HD1      ILE   3   7.763  -6.123   0.520
   34   HD12  ILE   3          1HD1      ILE   3   6.388  -5.178  -0.050
   35   HD13  ILE   3          2HD1      ILE   3   6.672  -5.360   1.680
   36    H    ILE   4           H        ILE   4  11.294  -0.839   2.802
   37    HA   ILE   4           HA       ILE   4  13.673  -2.380   3.552
   38    HB   ILE   4           HB       ILE   4  13.020   0.585   3.898
   39   HG12  ILE   4          2HG1      ILE   4  13.288  -0.044   1.531
   40   HG13  ILE   4          1HG1      ILE   4  14.647   0.945   2.050
   41   HG21  ILE   4          1HG2      ILE   4  15.422   0.922   4.433
   42   HG22  ILE   4          2HG2      ILE   4  15.661  -0.827   4.441
   43   HG23  ILE   4          3HG2      ILE   4  14.606  -0.075   5.639
   44   HD11  ILE   4          3HD1      ILE   4  14.675  -2.060   1.726
   45   HD12  ILE   4          1HD1      ILE   4  16.040  -1.064   2.237
   46   HD13  ILE   4          2HD1      ILE   4  15.371  -0.881   0.616
   47    H    SER   5           H        SER   5  11.023  -0.599   5.084
   48    HA   SER   5           HA       SER   5  11.187  -2.304   7.462
   49    HB2  SER   5           2HB      SER   5  11.040   0.748   7.620
   50    HB3  SER   5           1HB      SER   5  10.923  -0.364   8.990
   51    HG   SER   5           HG       SER   5  13.104  -1.116   7.998
   52    H    ILE   6           H        ILE   6   9.147  -2.336   8.643
   53    HA   ILE   6           HA       ILE   6   6.806  -1.671   6.970
   54    HB   ILE   6           HB       ILE   6   7.173  -3.967   8.925
   55   HG12  ILE   6          2HG1      ILE   6   6.862  -3.927   5.886
   56   HG13  ILE   6          1HG1      ILE   6   8.325  -4.331   6.774
   57   HG21  ILE   6          1HG2      ILE   6   4.904  -4.726   8.279
   58   HG22  ILE   6          2HG2      ILE   6   4.683  -3.261   7.322
   59   HG23  ILE   6          3HG2      ILE   6   4.860  -3.153   9.075
   60   HD11  ILE   6          3HD1      ILE   6   7.198  -6.330   7.665
   61   HD12  ILE   6          1HD1      ILE   6   7.290  -6.311   5.903
   62   HD13  ILE   6          2HD1      ILE   6   5.771  -5.923   6.707
   63    H    SER   7           H        SER   7   7.195  -2.508  10.364
   64    HA   SER   7           HA       SER   7   6.335  -1.735  12.300
   65    HB2  SER   7           2HB      SER   7   7.940   0.131  11.895
   66    HB3  SER   7           1HB      SER   7   6.682   1.024  11.039
   67    HG   SER   7           HG       SER   7   7.046   0.597  13.759
   68    H    GLU   8           H        GLU   8   4.344  -2.711  11.977
   69    HA   GLU   8           HA       GLU   8   2.120  -1.292  10.783
   70    HB2  GLU   8           2HB      GLU   8   0.881  -3.335  11.055
   71    HB3  GLU   8           1HB      GLU   8   2.473  -3.782  10.494
   72    HG2  GLU   8           2HG      GLU   8   1.565  -3.969  13.382
   73    HG3  GLU   8           1HG      GLU   8   1.500  -5.304  12.242
   74    H    THR   9           H        THR   9   0.011  -1.969  12.310
   75    HA   THR   9           HA       THR   9   0.382  -0.723  14.948
   76    HB   THR   9           HB       THR   9  -2.056  -0.135  14.769
   77    HG1  THR   9           HG1      THR   9  -3.207  -0.580  12.993
   78   HG21  THR   9          3HG2      THR   9  -0.407   0.963  12.462
   79   HG22  THR   9          1HG2      THR   9  -0.375   1.564  14.122
   80   HG23  THR   9          2HG2      THR   9  -1.845   1.713  13.159
   81    HA   PRO  10           HA       PRO  10  -0.630  -4.694  16.715
   82    HB2  PRO  10           2HB      PRO  10  -2.445  -3.299  18.674
   83    HB3  PRO  10           1HB      PRO  10  -1.040  -4.341  18.986
   84    HG2  PRO  10           2HG      PRO  10  -0.889  -1.700  19.320
   85    HG3  PRO  10           1HG      PRO  10   0.487  -2.628  18.680
   86    HD2  PRO  10           2HD      PRO  10  -1.457  -0.875  17.190
   87    HD3  PRO  10           1HD      PRO  10   0.290  -1.088  16.954
   88    H    ASN  11           H        ASN  11  -3.404  -2.563  16.137
   89    HA   ASN  11           HA       ASN  11  -5.372  -4.680  15.990
   90    HB2  ASN  11           2HB      ASN  11  -6.907  -2.872  15.261
   91    HB3  ASN  11           1HB      ASN  11  -6.055  -2.443  16.731
   92   HD21  ASN  11          1HD2      ASN  11  -7.368  -0.740  14.717
   93   HD22  ASN  11          2HD2      ASN  11  -6.164   0.376  14.181
   94    H    HIS  12           H        HIS  12  -3.031  -3.420  13.890
   95    HA   HIS  12           HA       HIS  12  -2.278  -4.001  11.869
   96    HB2  HIS  12           2HB      HIS  12  -4.284  -6.276  12.141
   97    HB3  HIS  12           1HB      HIS  12  -3.104  -6.163  10.836
   98    HD1  HIS  12           HD1      HIS  12  -3.512  -7.665  14.057
   99    HD2  HIS  12           HD2      HIS  12  -0.321  -6.015  11.972
  100    HE1  HIS  12           HE1      HIS  12  -1.452  -8.578  15.161
  101    HE2  HIS  12           HE2      HIS  12   0.450  -7.715  13.755
  102    H    ASN  13           H        ASN  13  -4.492  -2.066  12.083
  103    HA   ASN  13           HA       ASN  13  -6.031  -2.379   9.651
  104    HB2  ASN  13           2HB      ASN  13  -5.670  -0.009  11.520
  105    HB3  ASN  13           1HB      ASN  13  -6.665   0.058  10.067
  106   HD21  ASN  13          1HD2      ASN  13  -8.544   0.452  11.306
  107   HD22  ASN  13          2HD2      ASN  13  -9.298  -0.782  12.250
  108    H    THR  14           H        THR  14  -3.195  -0.361  10.608
  109    HA   THR  14           HA       THR  14  -2.530  -0.142   7.728
  110    HB   THR  14           HB       THR  14  -3.397   2.056   8.375
  111    HG1  THR  14           HG1      THR  14  -1.414   1.791   7.021
  112   HG21  THR  14          3HG2      THR  14  -2.271   3.467  10.070
  113   HG22  THR  14          1HG2      THR  14  -1.212   2.119  10.502
  114   HG23  THR  14          2HG2      THR  14  -2.945   2.017  10.813
  115    H    MET  15           H        MET  15  -0.488  -0.498   7.157
  116    HA   MET  15           HA       MET  15   1.694  -0.351   9.140
  117    HB2  MET  15           2HB      MET  15   2.865  -2.208   8.048
  118    HB3  MET  15           1HB      MET  15   1.297  -2.743   8.622
  119    HG2  MET  15           2HG      MET  15   0.419  -2.844   6.400
  120    HG3  MET  15           1HG      MET  15   1.811  -1.987   5.741
  121    HE1  MET  15           3HE      MET  15   0.758  -5.308   7.667
  122    HE2  MET  15           1HE      MET  15   2.233  -4.824   8.504
  123    HE3  MET  15           2HE      MET  15   2.226  -6.269   7.494
  124    H    LYS  16           H        LYS  16   3.650   0.441   8.307
  125    HA   LYS  16           HA       LYS  16   3.353   2.187   5.953
  126    HB2  LYS  16           2HB      LYS  16   5.494   2.118   8.132
  127    HB3  LYS  16           1HB      LYS  16   5.350   3.340   6.870
  128    HG2  LYS  16           2HG      LYS  16   3.241   4.128   7.800
  129    HG3  LYS  16           1HG      LYS  16   3.246   2.832   9.003
  130    HD2  LYS  16           2HD      LYS  16   5.239   3.785  10.076
  131    HD3  LYS  16           1HD      LYS  16   5.357   5.023   8.819
  132    HE2  LYS  16           2HE      LYS  16   4.373   5.941  10.866
  133    HE3  LYS  16           1HE      LYS  16   3.202   5.975   9.547
  134    HZ1  LYS  16           3HZ      LYS  16   3.313   3.975  11.740
  135    HZ2  LYS  16           1HZ      LYS  16   2.204   3.961  10.468
  136    HZ3  LYS  16           2HZ      LYS  16   2.186   5.223  11.588
  137    H    ILE  17           H        ILE  17   5.109   2.279   4.365
  138    HA   ILE  17           HA       ILE  17   6.929  -0.061   4.277
  139    HB   ILE  17           HB       ILE  17   5.297   1.002   1.911
  140   HG12  ILE  17          2HG1      ILE  17   5.224  -1.758   3.225
  141   HG13  ILE  17          1HG1      ILE  17   4.031  -0.496   3.483
  142   HG21  ILE  17          1HG2      ILE  17   7.413  -1.197   1.899
  143   HG22  ILE  17          2HG2      ILE  17   7.572   0.400   1.165
  144   HG23  ILE  17          3HG2      ILE  17   6.393  -0.745   0.529
  145   HD11  ILE  17          3HD1      ILE  17   3.438  -0.614   1.094
  146   HD12  ILE  17          1HD1      ILE  17   3.193  -2.137   1.948
  147   HD13  ILE  17          2HD1      ILE  17   4.593  -1.934   0.900
  148    H    THR  18           H        THR  18   8.639   1.145   4.945
  149    HA   THR  18           HA       THR  18   9.499   3.658   4.017
  150    HB   THR  18           HB       THR  18  11.119   1.327   5.151
  151    HG1  THR  18           HG1      THR  18   9.381   2.845   6.282
  152   HG21  THR  18          3HG2      THR  18  12.880   2.985   5.693
  153   HG22  THR  18          1HG2      THR  18  11.993   4.232   4.827
  154   HG23  THR  18          2HG2      THR  18  12.659   2.853   3.945
  155    H    LEU  19           H        LEU  19   9.852   4.154   1.935
  156    HA   LEU  19           HA       LEU  19  10.592   2.165  -0.045
  157    HB2  LEU  19           2HB      LEU  19  10.137   5.167  -0.277
  158    HB3  LEU  19           1HB      LEU  19  10.482   4.112  -1.642
  159    HG   LEU  19           HG       LEU  19   7.988   4.080   0.099
  160   HD11  LEU  19          1HD1      LEU  19   6.814   4.648  -1.984
  161   HD12  LEU  19          2HD1      LEU  19   8.349   4.695  -2.854
  162   HD13  LEU  19          3HD1      LEU  19   8.019   5.866  -1.573
  163   HD21  LEU  19          3HD2      LEU  19   8.536   1.753  -0.414
  164   HD22  LEU  19          1HD2      LEU  19   8.703   2.137  -2.132
  165   HD23  LEU  19          2HD2      LEU  19   7.130   2.266  -1.341
  166    H    SER  20           H        SER  20  12.138   4.673   1.735
  167    HA   SER  20           HA       SER  20  14.284   4.709   2.480
  168    HB2  SER  20           2HB      SER  20  16.235   3.723   1.467
  169    HB3  SER  20           1HB      SER  20  14.940   2.526   1.380
  170    HG   SER  20           HG       SER  20  14.837   3.929  -0.860
  171    H    GLU  21           H        GLU  21  12.874   6.172  -0.152
  172    HA   GLU  21           HA       GLU  21  15.088   8.006  -0.732
  173    HB2  GLU  21           2HB      GLU  21  12.249   7.859  -1.850
  174    HB3  GLU  21           1HB      GLU  21  13.408   9.098  -2.312
  175    HG2  GLU  21           2HG      GLU  21  13.319   7.413  -4.035
  176    HG3  GLU  21           1HG      GLU  21  14.895   7.332  -3.247
  177    H    SER  22           H        SER  22  14.899   8.461   1.775
  178    HA   SER  22           HA       SER  22  12.809  10.091   2.785
  179    HB2  SER  22           2HB      SER  22  15.669   9.748   3.759
  180    HB3  SER  22           1HB      SER  22  14.417  10.614   4.652
  181    HG   SER  22           HG       SER  22  13.191   8.574   4.435
  182    H    ARG  23           H        ARG  23  12.450  11.644   1.208
  183    HA   ARG  23           HA       ARG  23  14.461  13.788   0.845
  184    HB2  ARG  23           2HB      ARG  23  13.393  12.518  -1.153
  185    HB3  ARG  23           1HB      ARG  23  11.902  13.362  -0.760
  186    HG2  ARG  23           2HG      ARG  23  12.945  15.518  -1.238
  187    HG3  ARG  23           1HG      ARG  23  14.512  14.736  -1.485
  188    HD2  ARG  23           2HD      ARG  23  12.024  14.341  -3.193
  189    HD3  ARG  23           1HD      ARG  23  13.475  15.238  -3.645
  190    HE   ARG  23           HE       ARG  23  14.445  12.772  -3.072
  191   HH11  ARG  23          1HH1      ARG  23  11.890  13.835  -5.251
  192   HH12  ARG  23          2HH1      ARG  23  12.129  12.518  -6.351
  193   HH21  ARG  23          1HH2      ARG  23  14.719  11.052  -4.537
  194   HH22  ARG  23          2HH2      ARG  23  13.715  10.962  -5.948
  195    H    GLU  24           H        GLU  24  12.106  13.024   2.920
  196    HA   GLU  24           HA       GLU  24  10.870  14.039   4.470
  197    HB2  GLU  24           2HB      GLU  24  12.398  16.503   3.574
  198    HB3  GLU  24           1HB      GLU  24  11.217  16.563   4.877
  199    HG2  GLU  24           2HG      GLU  24  13.494  16.397   5.753
  200    HG3  GLU  24           1HG      GLU  24  12.533  14.988   6.192
  201    H    GLY  25           H        GLY  25  10.802  16.589   1.984
  202    HA2  GLY  25           2HA      GLY  25   7.876  16.591   1.904
  203    HA3  GLY  25           1HA      GLY  25   8.966  17.686   1.067
  204    H    MET  26           H        MET  26   8.554  14.120   1.063
  205    HA   MET  26           HA       MET  26   8.509  14.080  -1.897
  206    HB2  MET  26           2HB      MET  26  10.000  12.500  -0.575
  207    HB3  MET  26           1HB      MET  26   8.557  11.734   0.066
  208    HG2  MET  26           2HG      MET  26   7.924  11.133  -2.305
  209    HG3  MET  26           1HG      MET  26   9.495  11.756  -2.818
  210    HE1  MET  26           3HE      MET  26   9.916   7.819  -3.087
  211    HE2  MET  26           1HE      MET  26  10.056   9.347  -3.960
  212    HE3  MET  26           2HE      MET  26   8.472   8.767  -3.442
  213    H    THR  27           H        THR  27   6.407  15.358  -0.897
  214    HA   THR  27           HA       THR  27   4.202  15.652  -0.979
  215    HB   THR  27           HB       THR  27   3.818  12.858  -2.128
  216    HG1  THR  27           HG1      THR  27   4.997  13.471  -3.763
  217   HG21  THR  27          3HG2      THR  27   2.331  15.462  -2.643
  218   HG22  THR  27          1HG2      THR  27   1.753  14.144  -1.619
  219   HG23  THR  27          2HG2      THR  27   1.953  13.891  -3.354
  220    H    SER  28           H        SER  28   2.236  15.163   0.118
  221    HA   SER  28           HA       SER  28   2.187  12.969   2.079
  222    HB2  SER  28           2HB      SER  28   1.217  14.609   3.766
  223    HB3  SER  28           1HB      SER  28   2.921  14.867   3.397
  224    HG   SER  28           HG       SER  28   1.062  16.266   1.858
  225    H    ASP  29           H        ASP  29   0.761  11.939   0.603
  226    HA   ASP  29           HA       ASP  29  -1.779  13.324  -0.085
  227    HB2  ASP  29           2HB      ASP  29   0.033  13.163  -1.928
  228    HB3  ASP  29           1HB      ASP  29  -0.284  11.443  -1.960
  229    H    THR  30           H        THR  30  -3.605  12.099  -0.174
  230    HA   THR  30           HA       THR  30  -3.502   9.353   0.903
  231    HB   THR  30           HB       THR  30  -4.941  10.886   2.169
  232    HG1  THR  30           HG1      THR  30  -6.717   9.196   0.714
  233   HG21  THR  30          3HG2      THR  30  -7.000  11.850   1.179
  234   HG22  THR  30          1HG2      THR  30  -6.508  11.272  -0.409
  235   HG23  THR  30          2HG2      THR  30  -5.545  12.502   0.418
  236    H    TYR  31           H        TYR  31  -4.664   7.715  -0.079
  237    HA   TYR  31           HA       TYR  31  -5.667   8.011  -2.823
  238    HB2  TYR  31           2HB      TYR  31  -3.580   5.928  -2.007
  239    HB3  TYR  31           1HB      TYR  31  -4.331   6.077  -3.593
  240    HD1  TYR  31           HD1      TYR  31  -4.011   8.516  -4.706
  241    HD2  TYR  31           HD2      TYR  31  -1.411   6.825  -1.772
  242    HE1  TYR  31           HE1      TYR  31  -2.200   9.986  -5.453
  243    HE2  TYR  31           HE2      TYR  31   0.401   8.294  -2.531
  244    HH   TYR  31           HH       TYR  31  -0.143  10.950  -4.567
  245    H    THR  32           H        THR  32  -7.680   7.164  -2.667
  246    HA   THR  32           HA       THR  32  -8.168   4.666  -1.146
  247    HB   THR  32           HB       THR  32 -10.372   5.622  -0.334
  248    HG1  THR  32           HG1      THR  32  -9.325   7.925  -1.581
  249   HG21  THR  32          3HG2      THR  32  -8.455   5.579   1.220
  250   HG22  THR  32          1HG2      THR  32  -9.483   6.983   1.502
  251   HG23  THR  32          2HG2      THR  32  -7.950   7.173   0.649
  252    H    LYS  33           H        LYS  33  -9.181   6.956  -3.627
  253    HA   LYS  33           HA       LYS  33 -11.411   5.203  -4.478
  254    HB2  LYS  33           2HB      LYS  33 -12.402   7.324  -5.368
  255    HB3  LYS  33           1HB      LYS  33 -12.134   7.368  -3.629
  256    HG2  LYS  33           2HG      LYS  33 -10.035   8.671  -4.012
  257    HG3  LYS  33           1HG      LYS  33 -10.389   8.682  -5.741
  258    HD2  LYS  33           2HD      LYS  33 -12.458   9.958  -5.328
  259    HD3  LYS  33           1HD      LYS  33 -12.164   9.899  -3.587
  260    HE2  LYS  33           2HE      LYS  33 -10.072  11.206  -3.917
  261    HE3  LYS  33           1HE      LYS  33 -10.414  11.293  -5.647
  262    HZ1  LYS  33           3HZ      LYS  33 -12.170  12.385  -3.513
  263    HZ2  LYS  33           1HZ      LYS  33 -12.408  12.536  -5.181
  264    HZ3  LYS  33           2HZ      LYS  33 -11.090  13.292  -4.442
  265    H    VAL  34           H        VAL  34  -8.699   4.770  -5.386
  266    HA   VAL  34           HA       VAL  34  -7.356   4.479  -7.195
  267    HB   VAL  34           HB       VAL  34 -10.032   4.415  -8.677
  268   HG11  VAL  34          1HG1      VAL  34  -8.182   4.633 -10.292
  269   HG12  VAL  34          2HG1      VAL  34  -8.890   3.020 -10.384
  270   HG13  VAL  34          3HG1      VAL  34  -7.351   3.261  -9.555
  271   HG21  VAL  34          3HG2      VAL  34  -9.931   1.961  -8.349
  272   HG22  VAL  34          1HG2      VAL  34  -9.962   2.821  -6.808
  273   HG23  VAL  34          2HG2      VAL  34  -8.446   2.144  -7.412
  274    H    ASP  35           H        ASP  35  -6.734   6.654  -6.593
  275    HA   ASP  35           HA       ASP  35  -7.772   8.997  -7.859
  276    HB2  ASP  35           2HB      ASP  35  -5.264   8.597  -6.164
  277    HB3  ASP  35           1HB      ASP  35  -5.939  10.159  -6.618
  278    H    ASP  36           H        ASP  36  -7.046  10.074  -9.646
  279    HA   ASP  36           HA       ASP  36  -4.979   8.956 -11.335
  280    HB2  ASP  36           2HB      ASP  36  -6.981   9.958 -12.351
  281    HB3  ASP  36           1HB      ASP  36  -6.643  11.502 -11.589
  282    H    SER  37           H        SER  37  -3.071   9.070 -10.205
  283    HA   SER  37           HA       SER  37  -1.420  11.334 -10.367
  284    HB2  SER  37           2HB      SER  37  -1.114  11.698  -7.830
  285    HB3  SER  37           1HB      SER  37  -2.617  12.323  -8.512
  286    HG   SER  37           HG       SER  37  -3.586  11.121  -7.091
  287    H    GLN  38           H        GLN  38  -1.944   8.752  -8.000
  288    HA   GLN  38           HA       GLN  38   0.633   7.722  -7.786
  289    HB2  GLN  38           2HB      GLN  38  -0.550   5.694  -6.832
  290    HB3  GLN  38           1HB      GLN  38  -1.099   7.218  -6.141
  291    HG2  GLN  38           2HG      GLN  38  -3.017   7.185  -7.760
  292    HG3  GLN  38           1HG      GLN  38  -2.514   5.570  -8.248
  293   HE21  GLN  38          1HE2      GLN  38  -4.985   6.575  -7.045
  294   HE22  GLN  38          2HE2      GLN  38  -5.234   5.649  -5.614
  295    HA   PRO  39           HA       PRO  39   1.361   5.042 -11.476
  296    HB2  PRO  39           2HB      PRO  39   2.262   3.100  -9.320
  297    HB3  PRO  39           1HB      PRO  39   3.070   3.555 -10.838
  298    HG2  PRO  39           2HG      PRO  39   3.911   4.545  -8.526
  299    HG3  PRO  39           1HG      PRO  39   3.868   5.561  -9.985
  300    HD2  PRO  39           2HD      PRO  39   2.030   5.587  -7.615
  301    HD3  PRO  39           1HD      PRO  39   2.564   6.925  -8.653
  302    H    ALA  40           H        ALA  40   0.350   3.252 -12.456
  303    HA   ALA  40           HA       ALA  40  -2.256   2.587 -11.752
  304    HB1  ALA  40           3HB      ALA  40  -2.120   0.833 -13.479
  305    HB2  ALA  40           1HB      ALA  40  -0.357   0.956 -13.476
  306    HB3  ALA  40           2HB      ALA  40  -1.335   2.316 -14.025
  307    H    PHE  41           H        PHE  41   0.738   0.963 -11.002
  308    HA   PHE  41           HA       PHE  41  -0.057  -1.472  -9.926
  309    HB2  PHE  41           2HB      PHE  41   2.272   0.275  -9.025
  310    HB3  PHE  41           1HB      PHE  41   2.123  -1.457  -8.759
  311    HD1  PHE  41           HD1      PHE  41   2.383  -3.045 -10.667
  312    HD2  PHE  41           HD2      PHE  41   2.992   1.155 -11.190
  313    HE1  PHE  41           HE1      PHE  41   3.531  -3.469 -12.797
  314    HE2  PHE  41           HE2      PHE  41   4.142   0.718 -13.318
  315    HZ   PHE  41           HZ       PHE  41   4.409  -1.593 -14.129
  316    H    ILE  42           H        ILE  42   0.148   1.709  -8.379
  317    HA   ILE  42           HA       ILE  42  -0.422   0.784  -5.706
  318    HB   ILE  42           HB       ILE  42  -0.570   3.668  -6.706
  319   HG12  ILE  42          2HG1      ILE  42   1.637   2.660  -7.328
  320   HG13  ILE  42          1HG1      ILE  42   1.810   3.930  -6.124
  321   HG21  ILE  42          1HG2      ILE  42  -0.014   4.253  -4.357
  322   HG22  ILE  42          2HG2      ILE  42  -0.033   2.541  -3.923
  323   HG23  ILE  42          3HG2      ILE  42  -1.515   3.332  -4.459
  324   HD11  ILE  42          3HD1      ILE  42   3.266   2.030  -5.658
  325   HD12  ILE  42          1HD1      ILE  42   1.864   0.964  -5.572
  326   HD13  ILE  42          2HD1      ILE  42   2.076   2.243  -4.374
  327    H    ASN  43           H        ASN  43  -2.294   1.957  -8.442
  328    HA   ASN  43           HA       ASN  43  -4.781   2.348  -7.054
  329    HB2  ASN  43           2HB      ASN  43  -4.168   1.876 -10.005
  330    HB3  ASN  43           1HB      ASN  43  -5.778   2.207  -9.386
  331   HD21  ASN  43          1HD2      ASN  43  -2.708   3.574 -10.172
  332   HD22  ASN  43          2HD2      ASN  43  -3.146   5.219  -9.904
  333    H    ASP  44           H        ASP  44  -3.179  -0.359  -8.676
  334    HA   ASP  44           HA       ASP  44  -5.304  -2.229  -8.545
  335    HB2  ASP  44           2HB      ASP  44  -2.290  -2.598  -8.717
  336    HB3  ASP  44           1HB      ASP  44  -3.392  -3.972  -8.657
  337    H    ILE  45           H        ILE  45  -2.795  -1.302  -6.233
  338    HA   ILE  45           HA       ILE  45  -3.302  -3.232  -4.238
  339    HB   ILE  45           HB       ILE  45  -2.406  -0.342  -3.790
  340   HG12  ILE  45          2HG1      ILE  45  -0.686  -2.854  -4.072
  341   HG13  ILE  45          1HG1      ILE  45  -0.899  -1.641  -5.327
  342   HG21  ILE  45          1HG2      ILE  45  -1.471  -1.149  -1.630
  343   HG22  ILE  45          2HG2      ILE  45  -2.176  -2.740  -1.922
  344   HG23  ILE  45          3HG2      ILE  45  -3.224  -1.341  -1.696
  345   HD11  ILE  45          3HD1      ILE  45   1.219  -1.360  -4.211
  346   HD12  ILE  45          1HD1      ILE  45   0.418  -1.216  -2.647
  347   HD13  ILE  45          2HD1      ILE  45   0.182   0.027  -3.880
  348    H    LEU  46           H        LEU  46  -4.737   0.011  -4.722
  349    HA   LEU  46           HA       LEU  46  -6.695  -0.108  -2.693
  350    HB2  LEU  46           2HB      LEU  46  -6.721   1.321  -5.369
  351    HB3  LEU  46           1HB      LEU  46  -7.948   1.566  -4.135
  352    HG   LEU  46           HG       LEU  46  -4.987   2.178  -3.787
  353   HD11  LEU  46          1HD1      LEU  46  -7.307   4.088  -4.213
  354   HD12  LEU  46          2HD1      LEU  46  -6.022   3.726  -5.371
  355   HD13  LEU  46          3HD1      LEU  46  -5.637   4.539  -3.857
  356   HD21  LEU  46          3HD2      LEU  46  -7.325   2.742  -1.920
  357   HD22  LEU  46          1HD2      LEU  46  -5.656   3.267  -1.677
  358   HD23  LEU  46          2HD2      LEU  46  -6.047   1.551  -1.656
  359    H    LYS  47           H        LYS  47  -6.712  -1.406  -5.975
  360    HA   LYS  47           HA       LYS  47  -9.478  -2.226  -5.953
  361    HB2  LYS  47           2HB      LYS  47  -7.180  -2.927  -7.828
  362    HB3  LYS  47           1HB      LYS  47  -8.845  -3.458  -8.073
  363    HG2  LYS  47           2HG      LYS  47  -9.591  -1.126  -8.273
  364    HG3  LYS  47           1HG      LYS  47  -7.950  -0.558  -7.953
  365    HD2  LYS  47           2HD      LYS  47  -7.169  -1.629 -10.051
  366    HD3  LYS  47           1HD      LYS  47  -8.812  -2.205 -10.367
  367    HE2  LYS  47           2HE      LYS  47  -9.603   0.155 -10.456
  368    HE3  LYS  47           1HE      LYS  47  -7.949   0.706 -10.184
  369    HZ1  LYS  47           3HZ      LYS  47  -8.911  -0.846 -12.527
  370    HZ2  LYS  47           1HZ      LYS  47  -7.311  -0.359 -12.272
  371    HZ3  LYS  47           2HZ      LYS  47  -8.521   0.797 -12.508
  372    H    VAL  48           H        VAL  48  -6.579  -3.587  -4.633
  373    HA   VAL  48           HA       VAL  48  -7.446  -6.308  -4.410
  374    HB   VAL  48           HB       VAL  48  -5.585  -4.706  -2.575
  375   HG11  VAL  48          1HG1      VAL  48  -6.499  -6.593  -1.308
  376   HG12  VAL  48          2HG1      VAL  48  -4.795  -6.877  -1.662
  377   HG13  VAL  48          3HG1      VAL  48  -6.040  -7.716  -2.592
  378   HG21  VAL  48          3HG2      VAL  48  -4.670  -4.936  -4.836
  379   HG22  VAL  48          1HG2      VAL  48  -4.902  -6.685  -4.781
  380   HG23  VAL  48          2HG2      VAL  48  -3.737  -5.912  -3.702
  381    H    GLU  49           H        GLU  49  -9.366  -6.807  -3.516
  382    HA   GLU  49           HA       GLU  49 -10.951  -5.125  -1.939
  383    HB2  GLU  49           2HB      GLU  49 -11.120  -8.149  -2.270
  384    HB3  GLU  49           1HB      GLU  49 -12.387  -7.139  -1.578
  385    HG2  GLU  49           2HG      GLU  49 -12.550  -5.921  -3.740
  386    HG3  GLU  49           1HG      GLU  49 -11.356  -7.020  -4.427
  387    H    GLY  50           H        GLY  50 -10.361  -4.396  -0.025
  388    HA2  GLY  50           2HA      GLY  50 -10.349  -5.407   2.406
  389    HA3  GLY  50           1HA      GLY  50  -8.790  -6.021   1.858
  390    H    VAL  51           H        VAL  51  -7.919  -3.943   0.284
  391    HA   VAL  51           HA       VAL  51  -6.842  -2.112   2.206
  392    HB   VAL  51           HB       VAL  51  -6.642  -2.018  -0.841
  393   HG11  VAL  51          1HG1      VAL  51  -4.912  -0.625   1.251
  394   HG12  VAL  51          2HG1      VAL  51  -6.057   0.160   0.161
  395   HG13  VAL  51          3HG1      VAL  51  -4.621  -0.625  -0.494
  396   HG21  VAL  51          3HG2      VAL  51  -5.789  -4.146   0.053
  397   HG22  VAL  51          1HG2      VAL  51  -4.742  -3.276   1.180
  398   HG23  VAL  51          2HG2      VAL  51  -4.464  -3.155  -0.560
  399    H    LYS  52           H        LYS  52  -7.640  -0.238   2.849
  400    HA   LYS  52           HA       LYS  52 -10.098   0.811   1.601
  401    HB2  LYS  52           2HB      LYS  52 -10.402  -0.063   3.861
  402    HB3  LYS  52           1HB      LYS  52  -9.063   0.902   4.468
  403    HG2  LYS  52           2HG      LYS  52 -10.312   2.936   4.243
  404    HG3  LYS  52           1HG      LYS  52 -11.587   2.130   3.324
  405    HD2  LYS  52           2HD      LYS  52 -12.236   2.598   5.699
  406    HD3  LYS  52           1HD      LYS  52 -12.306   0.884   5.290
  407    HE2  LYS  52           2HE      LYS  52 -11.340   1.220   7.509
  408    HE3  LYS  52           1HE      LYS  52 -10.146   0.525   6.413
  409    HZ1  LYS  52           3HZ      LYS  52 -10.338   3.381   7.173
  410    HZ2  LYS  52           1HZ      LYS  52  -9.179   2.708   6.145
  411    HZ3  LYS  52           2HZ      LYS  52  -9.217   2.273   7.772
  412    H    SER  53           H        SER  53  -6.860   1.671   2.693
  413    HA   SER  53           HA       SER  53  -7.014   4.234   1.325
  414    HB2  SER  53           2HB      SER  53  -7.883   4.769   3.612
  415    HB3  SER  53           1HB      SER  53  -6.397   4.137   4.319
  416    HG   SER  53           HG       SER  53  -6.794   6.572   3.634
  417    H    ILE  54           H        ILE  54  -4.945   5.285   1.173
  418    HA   ILE  54           HA       ILE  54  -2.481   3.908   1.972
  419    HB   ILE  54           HB       ILE  54  -3.185   4.548  -0.948
  420   HG12  ILE  54          2HG1      ILE  54  -2.174   1.938   0.266
  421   HG13  ILE  54          1HG1      ILE  54  -3.847   2.269  -0.163
  422   HG21  ILE  54          1HG2      ILE  54  -0.417   3.906   0.131
  423   HG22  ILE  54          2HG2      ILE  54  -0.945   5.447  -0.548
  424   HG23  ILE  54          3HG2      ILE  54  -0.846   4.021  -1.577
  425   HD11  ILE  54          3HD1      ILE  54  -2.844   0.916  -1.849
  426   HD12  ILE  54          1HD1      ILE  54  -1.509   2.048  -2.048
  427   HD13  ILE  54          2HD1      ILE  54  -3.143   2.514  -2.528
  428    H    PHE  55           H        PHE  55  -1.378   5.549   2.977
  429    HA   PHE  55           HA       PHE  55  -1.601   8.314   1.909
  430    HB2  PHE  55           2HB      PHE  55  -2.734   8.046   4.106
  431    HB3  PHE  55           1HB      PHE  55  -1.237   7.447   4.817
  432    HD1  PHE  55           HD1      PHE  55  -2.424  10.430   2.840
  433    HD2  PHE  55           HD2      PHE  55  -0.011   9.017   6.066
  434    HE1  PHE  55           HE1      PHE  55  -1.802  12.738   3.387
  435    HE2  PHE  55           HE2      PHE  55   0.607  11.331   6.612
  436    HZ   PHE  55           HZ       PHE  55  -0.287  13.197   5.276
  437    H    HIS  56           H        HIS  56   0.240   8.806   0.870
  438    HA   HIS  56           HA       HIS  56   2.819   7.624   1.724
  439    HB2  HIS  56           2HB      HIS  56   2.237   7.456  -0.678
  440    HB3  HIS  56           1HB      HIS  56   2.070   9.205  -0.781
  441    HD1  HIS  56           HD1      HIS  56   4.010  10.030  -2.099
  442    HD2  HIS  56           HD2      HIS  56   5.143   7.091   0.584
  443    HE1  HIS  56           HE1      HIS  56   6.478   9.752  -2.432
  444    HE2  HIS  56           HE2      HIS  56   7.160   8.000  -0.759
  445    H    VAL  57           H        VAL  57   4.093   8.793   3.053
  446    HA   VAL  57           HA       VAL  57   4.394  11.676   2.709
  447    HB   VAL  57           HB       VAL  57   2.509  11.474   4.324
  448   HG11  VAL  57          1HG1      VAL  57   3.062   9.320   5.320
  449   HG12  VAL  57          2HG1      VAL  57   2.778  10.552   6.551
  450   HG13  VAL  57          3HG1      VAL  57   4.428  10.060   6.159
  451   HG21  VAL  57          3HG2      VAL  57   5.014  12.572   5.640
  452   HG22  VAL  57          1HG2      VAL  57   3.354  12.972   6.093
  453   HG23  VAL  57          2HG2      VAL  57   3.977  13.445   4.511
  454    H    MET  58           H        MET  58   6.297  12.527   3.579
  455    HA   MET  58           HA       MET  58   8.499  12.632   4.020
  456    HB2  MET  58           2HB      MET  58   8.035  11.623   6.212
  457    HB3  MET  58           1HB      MET  58   8.111  10.008   5.520
  458    HG2  MET  58           2HG      MET  58  10.504  10.346   5.017
  459    HG3  MET  58           1HG      MET  58  10.412  11.968   5.710
  460    HE1  MET  58           3HE      MET  58  12.540   9.740   6.602
  461    HE2  MET  58           1HE      MET  58  12.501   9.872   8.358
  462    HE3  MET  58           2HE      MET  58  12.499  11.331   7.365
  463    H    ASP  59           H        ASP  59   8.158   9.135   3.653
  464    HA   ASP  59           HA       ASP  59   8.810   9.122   0.857
  465    HB2  ASP  59           2HB      ASP  59  10.766   7.678   0.952
  466    HB3  ASP  59           1HB      ASP  59  11.106   9.144   1.855
  467    H    PHE  60           H        PHE  60   7.667   7.610   3.771
  468    HA   PHE  60           HA       PHE  60   7.543   4.934   2.677
  469    HB2  PHE  60           2HB      PHE  60   6.585   4.297   4.887
  470    HB3  PHE  60           1HB      PHE  60   8.122   5.133   5.029
  471    HD1  PHE  60           HD1      PHE  60   4.464   5.442   5.558
  472    HD2  PHE  60           HD2      PHE  60   8.279   7.258   6.191
  473    HE1  PHE  60           HE1      PHE  60   3.446   7.039   7.117
  474    HE2  PHE  60           HE2      PHE  60   7.257   8.851   7.755
  475    HZ   PHE  60           HZ       PHE  60   4.830   8.763   8.197
  476    H    ILE  61           H        ILE  61   5.749   3.829   2.056
  477    HA   ILE  61           HA       ILE  61   3.235   5.281   1.626
  478    HB   ILE  61           HB       ILE  61   4.129   2.499   0.711
  479   HG12  ILE  61          2HG1      ILE  61   3.888   5.110  -0.865
  480   HG13  ILE  61          1HG1      ILE  61   5.388   4.300  -0.430
  481   HG21  ILE  61          1HG2      ILE  61   1.614   4.024  -0.062
  482   HG22  ILE  61          2HG2      ILE  61   1.681   2.604   0.979
  483   HG23  ILE  61          3HG2      ILE  61   2.124   2.466  -0.722
  484   HD11  ILE  61          3HD1      ILE  61   4.848   3.927  -2.753
  485   HD12  ILE  61          1HD1      ILE  61   3.280   3.248  -2.317
  486   HD13  ILE  61          2HD1      ILE  61   4.765   2.405  -1.866
  487    H    SER  62           H        SER  62   2.107   5.343   3.528
  488    HA   SER  62           HA       SER  62   1.988   3.072   5.341
  489    HB2  SER  62           2HB      SER  62   2.047   5.471   6.163
  490    HB3  SER  62           1HB      SER  62   0.426   5.691   5.505
  491    HG   SER  62           HG       SER  62  -0.315   4.092   6.944
  492    H    VAL  63           H        VAL  63   1.024   1.476   4.102
  493    HA   VAL  63           HA       VAL  63  -1.482   1.851   2.708
  494    HB   VAL  63           HB       VAL  63  -0.085  -0.783   3.422
  495   HG11  VAL  63          1HG1      VAL  63  -1.403  -1.770   1.571
  496   HG12  VAL  63          2HG1      VAL  63  -2.229  -0.228   1.331
  497   HG13  VAL  63          3HG1      VAL  63  -2.443  -1.119   2.840
  498   HG21  VAL  63          3HG2      VAL  63   0.169   0.820   0.841
  499   HG22  VAL  63          1HG2      VAL  63   0.884  -0.767   1.151
  500   HG23  VAL  63          2HG2      VAL  63   1.420   0.639   2.072
  501    H    ASP  64           H        ASP  64  -3.426   1.682   3.586
  502    HA   ASP  64           HA       ASP  64  -3.830   0.390   6.220
  503    HB2  ASP  64           2HB      ASP  64  -4.044   2.746   6.597
  504    HB3  ASP  64           1HB      ASP  64  -4.970   2.997   5.137
  505    H    LYS  65           H        LYS  65  -5.769  -0.673   6.545
  506    HA   LYS  65           HA       LYS  65  -7.549  -1.236   4.298
  507    HB2  LYS  65           2HB      LYS  65  -7.393  -3.658   4.665
  508    HB3  LYS  65           1HB      LYS  65  -5.817  -3.011   4.228
  509    HG2  LYS  65           2HG      LYS  65  -4.971  -3.259   6.435
  510    HG3  LYS  65           1HG      LYS  65  -6.578  -3.496   7.122
  511    HD2  LYS  65           2HD      LYS  65  -6.733  -5.637   5.780
  512    HD3  LYS  65           1HD      LYS  65  -5.035  -5.418   5.345
  513    HE2  LYS  65           2HE      LYS  65  -5.285  -6.971   7.240
  514    HE3  LYS  65           1HE      LYS  65  -4.407  -5.520   7.726
  515    HZ1  LYS  65           3HZ      LYS  65  -6.024  -6.121   9.390
  516    HZ2  LYS  65           1HZ      LYS  65  -7.282  -6.090   8.257
  517    HZ3  LYS  65           2HZ      LYS  65  -6.482  -4.662   8.675
  518    H    GLU  66           H        GLU  66  -9.327  -2.804   5.226
  519    HA   GLU  66           HA       GLU  66 -10.481  -1.620   7.588
  520    HB2  GLU  66           2HB      GLU  66 -11.376  -3.415   5.420
  521    HB3  GLU  66           1HB      GLU  66 -12.020  -3.900   6.977
  522    HG2  GLU  66           2HG      GLU  66 -12.329  -1.160   5.715
  523    HG3  GLU  66           1HG      GLU  66 -13.561  -2.419   5.782
  524    H    ASN  67           H        ASN  67 -11.381  -3.058   9.314
  525    HA   ASN  67           HA       ASN  67  -9.270  -4.292  10.752
  526    HB2  ASN  67           2HB      ASN  67 -12.278  -4.450  11.269
  527    HB3  ASN  67           1HB      ASN  67 -11.012  -4.868  12.421
  528   HD21  ASN  67          1HD2      ASN  67 -11.843  -3.405  13.914
  529   HD22  ASN  67          2HD2      ASN  67 -11.658  -1.694  13.736
  530    H    ASP  68           H        ASP  68 -12.132  -5.533   9.065
  531    HA   ASP  68           HA       ASP  68 -11.950  -8.217   9.928
  532    HB2  ASP  68           2HB      ASP  68 -13.669  -8.699   8.246
  533    HB3  ASP  68           1HB      ASP  68 -14.055  -7.233   9.136
  534    H    ALA  69           H        ALA  69 -10.573  -6.572   7.155
  535    HA   ALA  69           HA       ALA  69  -9.790  -8.842   5.622
  536    HB1  ALA  69           3HB      ALA  69 -10.036  -6.593   4.645
  537    HB2  ALA  69           1HB      ALA  69  -8.429  -7.252   4.337
  538    HB3  ALA  69           2HB      ALA  69  -8.656  -6.022   5.584
  539    H    ASN  70           H        ASN  70  -7.527  -9.470   5.154
  540    HA   ASN  70           HA       ASN  70  -5.737  -9.358   7.532
  541    HB2  ASN  70           2HB      ASN  70  -6.098 -11.645   5.531
  542    HB3  ASN  70           1HB      ASN  70  -4.863 -11.595   6.783
  543   HD21  ASN  70          1HD2      ASN  70  -6.943 -13.587   6.393
  544   HD22  ASN  70          2HD2      ASN  70  -7.872 -13.610   7.852
  545    H    TRP  71           H        TRP  71  -3.563  -8.987   7.183
  546    HA   TRP  71           HA       TRP  71  -2.661  -7.783   4.750
  547    HB2  TRP  71           2HB      TRP  71  -1.143  -8.733   7.210
  548    HB3  TRP  71           1HB      TRP  71  -0.360  -7.930   5.853
  549    HD1  TRP  71           HD1      TRP  71  -1.628  -7.076   9.159
  550    HE1  TRP  71           HE1      TRP  71  -2.118  -4.561   9.356
  551    HE3  TRP  71           HE3      TRP  71  -1.612  -5.789   4.194
  552    HZ2  TRP  71           HZ2      TRP  71  -2.435  -2.344   7.681
  553    HZ3  TRP  71           HZ3      TRP  71  -2.028  -3.443   3.590
  554    HH2  TRP  71           HH2      TRP  71  -2.436  -1.758   5.304
  555    H    GLU  72           H        GLU  72  -2.883 -11.033   5.809
  556    HA   GLU  72           HA       GLU  72  -0.924 -12.338   4.256
  557    HB2  GLU  72           2HB      GLU  72  -3.677 -13.339   5.105
  558    HB3  GLU  72           1HB      GLU  72  -2.346 -14.357   4.568
  559    HG2  GLU  72           2HG      GLU  72  -2.302 -12.612   7.052
  560    HG3  GLU  72           1HG      GLU  72  -2.638 -14.340   7.036
  561    H    THR  73           H        THR  73  -3.984 -10.947   3.378
  562    HA   THR  73           HA       THR  73  -4.105 -12.084   0.703
  563    HB   THR  73           HB       THR  73  -5.705  -9.824   1.995
  564    HG1  THR  73           HG1      THR  73  -6.206 -12.621   1.713
  565   HG21  THR  73          3HG2      THR  73  -6.291 -11.399  -0.546
  566   HG22  THR  73          1HG2      THR  73  -5.816  -9.701  -0.473
  567   HG23  THR  73          2HG2      THR  73  -7.364 -10.214   0.203
  568    H    VAL  74           H        VAL  74  -3.256  -9.035   2.260
  569    HA   VAL  74           HA       VAL  74  -3.135  -7.469  -0.131
  570    HB   VAL  74           HB       VAL  74  -2.178  -6.795   2.685
  571   HG11  VAL  74          1HG1      VAL  74  -1.198  -5.261   1.039
  572   HG12  VAL  74          2HG1      VAL  74  -2.426  -4.422   1.988
  573   HG13  VAL  74          3HG1      VAL  74  -2.791  -4.948   0.344
  574   HG21  VAL  74          3HG2      VAL  74  -4.563  -7.416   2.654
  575   HG22  VAL  74          1HG2      VAL  74  -4.868  -6.237   1.374
  576   HG23  VAL  74          2HG2      VAL  74  -4.367  -5.692   2.977
  577    H    LEU  75           H        LEU  75  -0.592  -8.398   2.223
  578    HA   LEU  75           HA       LEU  75   1.568  -7.136   1.093
  579    HB2  LEU  75           2HB      LEU  75   1.277  -9.330   3.085
  580    HB3  LEU  75           1HB      LEU  75   2.860  -9.233   2.337
  581    HG   LEU  75           HG       LEU  75   2.723  -8.000   4.509
  582   HD11  LEU  75          1HD1      LEU  75   3.259  -6.192   2.132
  583   HD12  LEU  75          2HD1      LEU  75   4.397  -7.338   2.842
  584   HD13  LEU  75          3HD1      LEU  75   3.847  -5.955   3.782
  585   HD21  LEU  75          3HD2      LEU  75   0.384  -7.248   4.336
  586   HD22  LEU  75          1HD2      LEU  75   0.837  -6.119   3.058
  587   HD23  LEU  75          2HD2      LEU  75   1.480  -5.917   4.690
  588    HA   PRO  76           HA       PRO  76   2.951 -11.238  -1.389
  589    HB2  PRO  76           2HB      PRO  76   0.167 -12.137  -2.164
  590    HB3  PRO  76           1HB      PRO  76   1.629 -13.111  -1.873
  591    HG2  PRO  76           2HG      PRO  76  -0.276 -13.049  -0.057
  592    HG3  PRO  76           1HG      PRO  76   1.429 -12.967   0.449
  593    HD2  PRO  76           2HD      PRO  76  -0.593 -10.734   0.264
  594    HD3  PRO  76           1HD      PRO  76   0.631 -11.044   1.515
  595    H    LYS  77           H        LYS  77   0.062  -9.359  -2.165
  596    HA   LYS  77           HA       LYS  77   0.547  -9.235  -5.034
  597    HB2  LYS  77           2HB      LYS  77  -1.428  -7.707  -3.278
  598    HB3  LYS  77           1HB      LYS  77  -1.458  -7.776  -5.040
  599    HG2  LYS  77           2HG      LYS  77  -1.942 -10.170  -4.984
  600    HG3  LYS  77           1HG      LYS  77  -1.808 -10.182  -3.222
  601    HD2  LYS  77           2HD      LYS  77  -3.767  -8.706  -3.036
  602    HD3  LYS  77           1HD      LYS  77  -3.877  -8.592  -4.795
  603    HE2  LYS  77           2HE      LYS  77  -5.540 -10.150  -3.885
  604    HE3  LYS  77           1HE      LYS  77  -4.393 -10.996  -4.926
  605    HZ1  LYS  77           3HZ      LYS  77  -4.425 -10.963  -1.962
  606    HZ2  LYS  77           1HZ      LYS  77  -3.204 -11.676  -2.888
  607    HZ3  LYS  77           2HZ      LYS  77  -4.780 -12.268  -2.970
  608    H    VAL  78           H        VAL  78   0.865  -7.138  -2.231
  609    HA   VAL  78           HA       VAL  78   1.537  -4.734  -3.658
  610    HB   VAL  78           HB       VAL  78   1.658  -5.403  -0.682
  611   HG11  VAL  78          1HG1      VAL  78   1.688  -2.960  -0.274
  612   HG12  VAL  78          2HG1      VAL  78   1.839  -2.671  -2.010
  613   HG13  VAL  78          3HG1      VAL  78   3.131  -3.493  -1.135
  614   HG21  VAL  78          3HG2      VAL  78  -0.452  -3.930  -2.305
  615   HG22  VAL  78          1HG2      VAL  78  -0.480  -4.177  -0.557
  616   HG23  VAL  78          2HG2      VAL  78  -0.600  -5.561  -1.644
  617    H    GLU  79           H        GLU  79   3.365  -7.291  -2.121
  618    HA   GLU  79           HA       GLU  79   5.935  -6.187  -1.979
  619    HB2  GLU  79           2HB      GLU  79   5.294  -8.366  -0.984
  620    HB3  GLU  79           1HB      GLU  79   5.086  -9.053  -2.590
  621    HG2  GLU  79           2HG      GLU  79   7.517  -8.722  -3.014
  622    HG3  GLU  79           1HG      GLU  79   7.697  -8.110  -1.369
  623    H    ALA  80           H        ALA  80   4.237  -7.780  -4.628
  624    HA   ALA  80           HA       ALA  80   6.268  -7.945  -6.560
  625    HB1  ALA  80           3HB      ALA  80   4.133  -9.179  -6.705
  626    HB2  ALA  80           1HB      ALA  80   4.436  -8.263  -8.181
  627    HB3  ALA  80           2HB      ALA  80   3.270  -7.667  -6.996
  628    H    VAL  81           H        VAL  81   4.191  -5.270  -5.636
  629    HA   VAL  81           HA       VAL  81   4.493  -3.582  -7.895
  630    HB   VAL  81           HB       VAL  81   3.832  -2.930  -4.981
  631   HG11  VAL  81          1HG1      VAL  81   4.655  -0.874  -6.009
  632   HG12  VAL  81          2HG1      VAL  81   2.911  -0.768  -5.777
  633   HG13  VAL  81          3HG1      VAL  81   3.568  -1.088  -7.384
  634   HG21  VAL  81          3HG2      VAL  81   2.013  -3.260  -7.401
  635   HG22  VAL  81          1HG2      VAL  81   1.492  -2.827  -5.768
  636   HG23  VAL  81          2HG2      VAL  81   2.202  -4.413  -6.076
  637    H    PHE  82           H        PHE  82   6.397  -3.829  -4.866
  638    HA   PHE  82           HA       PHE  82   8.279  -1.750  -5.721
  639    HB2  PHE  82           2HB      PHE  82   8.447  -3.506  -3.239
  640    HB3  PHE  82           1HB      PHE  82   9.215  -1.938  -3.504
  641    HD1  PHE  82           HD1      PHE  82   7.448   0.001  -4.189
  642    HD2  PHE  82           HD2      PHE  82   6.543  -3.496  -1.910
  643    HE1  PHE  82           HE1      PHE  82   5.424   1.086  -3.315
  644    HE2  PHE  82           HE2      PHE  82   4.547  -2.395  -1.034
  645    HZ   PHE  82           HZ       PHE  82   3.978  -0.136  -1.759
  646    H    GLU  83           H        GLU  83   8.208  -4.384  -7.249
  647    HA   GLU  83           HA       GLU  83  11.105  -4.908  -7.181
  648    HB2  GLU  83           2HB      GLU  83   9.051  -7.154  -6.938
  649    HB3  GLU  83           1HB      GLU  83  10.769  -7.390  -7.211
  650    HG2  GLU  83           2HG      GLU  83  11.256  -6.429  -5.006
  651    HG3  GLU  83           1HG      GLU  83   9.531  -6.190  -4.723
  652    H    LEU  84           H        LEU  84   8.071  -6.051  -8.593
  653    HA   LEU  84           HA       LEU  84   7.323  -6.592 -10.624
  654    HB2  LEU  84           2HB      LEU  84   9.369  -4.590 -11.667
  655    HB3  LEU  84           1HB      LEU  84   8.092  -5.306 -12.627
  656    HG   LEU  84           HG       LEU  84   7.223  -3.198 -12.149
  657   HD11  LEU  84          1HD1      LEU  84   5.568  -4.890 -11.587
  658   HD12  LEU  84          2HD1      LEU  84   5.351  -3.427 -10.631
  659   HD13  LEU  84          3HD1      LEU  84   6.089  -4.854  -9.902
  660   HD21  LEU  84          3HD2      LEU  84   8.952  -2.425 -10.619
  661   HD22  LEU  84          1HD2      LEU  84   8.220  -3.344  -9.301
  662   HD23  LEU  84          2HD2      LEU  84   7.346  -1.994 -10.032
  663    H    GLU  85           H        GLU  85   9.357  -8.142  -9.414
  664    HA   GLU  85           HA       GLU  85  11.244  -9.109 -11.334
  665    HB2  GLU  85           2HB      GLU  85  10.300 -10.135  -8.637
  666    HB3  GLU  85           1HB      GLU  85  11.516 -10.976  -9.587
  667    HG2  GLU  85           2HG      GLU  85  11.799  -8.101  -8.665
  668    HG3  GLU  85           1HG      GLU  85  12.407  -9.491  -7.767
  669    H    HIS  86           H        HIS  86  10.187  -9.742 -13.176
  670    HA   HIS  86           HA       HIS  86   8.371 -12.098 -13.031
  671    HB2  HIS  86           2HB      HIS  86   8.533  -9.883 -15.140
  672    HB3  HIS  86           1HB      HIS  86   7.555 -11.339 -15.309
  673    HD1  HIS  86           HD1      HIS  86   7.626  -8.012 -13.665
  674    HD2  HIS  86           HD2      HIS  86   5.223 -11.401 -13.691
  675    HE1  HIS  86           HE1      HIS  86   5.470  -7.308 -12.585
  676    HE2  HIS  86           HE2      HIS  86   4.005  -9.360 -12.659
  677    H    HIS  87           H        HIS  87   9.223 -13.937 -13.822
  678    HA   HIS  87           HA       HIS  87  10.562 -15.455 -14.840
  679    HB2  HIS  87           2HB      HIS  87  10.824 -13.300 -16.987
  680    HB3  HIS  87           1HB      HIS  87  11.330 -14.975 -17.185
  681    HD1  HIS  87           HD1      HIS  87   9.654 -16.361 -18.377
  682    HD2  HIS  87           HD2      HIS  87   7.861 -13.225 -16.327
  683    HE1  HIS  87           HE1      HIS  87   7.197 -16.544 -18.887
  684    HE2  HIS  87           HE2      HIS  87   6.166 -14.523 -17.774
  685    H    HIS  88           H        HIS  88  11.734 -13.682 -12.898
  686    HA   HIS  88           HA       HIS  88  14.339 -12.804 -13.761
  687    HB2  HIS  88           2HB      HIS  88  14.660 -12.008 -11.464
  688    HB3  HIS  88           1HB      HIS  88  13.082 -11.520 -12.054
  689    HD1  HIS  88           HD1      HIS  88  14.232 -12.036  -9.000
  690    HD2  HIS  88           HD2      HIS  88  11.373 -14.214 -11.090
  691    HE1  HIS  88           HE1      HIS  88  12.808 -13.123  -7.240
  692    HE2  HIS  88           HE2      HIS  88  11.202 -14.578  -8.529
  693    H    HIS  89           H        HIS  89  16.124 -13.980 -13.854
  694    HA   HIS  89           HA       HIS  89  16.540 -16.290 -12.036
  695    HB2  HIS  89           2HB      HIS  89  17.238 -16.070 -14.998
  696    HB3  HIS  89           1HB      HIS  89  17.992 -17.256 -13.941
  697    HD1  HIS  89           HD1      HIS  89  16.853 -19.433 -13.804
  698    HD2  HIS  89           HD2      HIS  89  14.290 -16.453 -15.122
  699    HE1  HIS  89           HE1      HIS  89  14.728 -20.612 -14.405
  700    HE2  HIS  89           HE2      HIS  89  13.275 -18.812 -15.410
  701    H    HIS  90           H        HIS  90  17.668 -15.026 -10.584
  702    HA   HIS  90           HA       HIS  90  20.130 -13.644 -11.409
  703    HB2  HIS  90           2HB      HIS  90  18.720 -13.814  -8.706
  704    HB3  HIS  90           1HB      HIS  90  20.243 -12.969  -8.969
  705    HD1  HIS  90           HD1      HIS  90  20.026 -10.554  -9.522
  706    HD2  HIS  90           HD2      HIS  90  16.530 -12.639 -10.361
  707    HE1  HIS  90           HE1      HIS  90  18.353  -8.804 -10.188
  708    HE2  HIS  90           HE2      HIS  90  16.186 -10.069 -10.439
  709    H    HIS  91           H        HIS  91  19.297 -15.855  -8.707
  710    HA   HIS  91           HA       HIS  91  21.187 -17.851  -9.462
  711    HB2  HIS  91           2HB      HIS  91  22.633 -17.697  -7.386
  712    HB3  HIS  91           1HB      HIS  91  22.882 -16.397  -8.545
  713    HD1  HIS  91           HD1      HIS  91  21.734 -17.066  -5.066
  714    HD2  HIS  91           HD2      HIS  91  22.055 -13.830  -7.643
  715    HE1  HIS  91           HE1      HIS  91  21.396 -15.039  -3.633
  716    HE2  HIS  91           HE2      HIS  91  21.817 -13.096  -5.175