*HEADER    PROTEIN BINDING                         09-MAY-14   2MP2              
*TITLE     SOLUTION STRUCTURE OF SUMO DIMER IN COMPLEX WITH SIM2-3 FROM RNF4     
*COMPND    MOL_ID: 1;                                                            
*COMPND   2 MOLECULE: SMALL UBIQUITIN-RELATED MODIFIER 3;                        
*COMPND   3 CHAIN: A;                                                            
*COMPND   4 FRAGMENT: UNP RESIDUES 12-92;                                        
*COMPND   5 SYNONYM: SUMO-3, SMT3 HOMOLOG 1, SUMO-2, UBIQUITIN-LIKE PROTEIN      
*COMPND   6 SMT3B, SMT3B;                                                        
*COMPND   7 ENGINEERED: YES;                                                     
*COMPND   8 MOL_ID: 2;                                                           
*COMPND   9 MOLECULE: SMALL UBIQUITIN-RELATED MODIFIER 3;                        
*COMPND  10 CHAIN: B;                                                            
*COMPND  11 FRAGMENT: UNP RESIDUES 2-90;                                         
*COMPND  12 SYNONYM: SUMO-3, SMT3 HOMOLOG 1, SUMO-2, UBIQUITIN-LIKE PROTEIN      
*COMPND  13 SMT3B, SMT3B;                                                        
*COMPND  14 ENGINEERED: YES;                                                     
*COMPND  15 MOL_ID: 3;                                                           
*COMPND  16 MOLECULE: E3 UBIQUITIN-PROTEIN LIGASE RNF4;                          
*COMPND  17 CHAIN: C;                                                            
*COMPND  18 FRAGMENT: UNP RESIDUES 45-69;                                        
*COMPND  19 SYNONYM: RING FINGER PROTEIN 4;                                      
*COMPND  20 ENGINEERED: YES                                                      
*SOURCE    MOL_ID: 1;                                                            
*SOURCE   2 ORGANISM_SCIENTIFIC: HOMO SAPIENS;                                   
*SOURCE   3 ORGANISM_COMMON: HUMAN;                                              
*SOURCE   4 ORGANISM_TAXID: 9606;                                                
*SOURCE   5 GENE: SMT3B, SMT3H1, SUMO3;                                          
*SOURCE   6 EXPRESSION_SYSTEM: ESCHERICHIA COLI;                                 
*SOURCE   7 EXPRESSION_SYSTEM_TAXID: 469008;                                     
*SOURCE   8 EXPRESSION_SYSTEM_STRAIN: BL21(DE3);                                 
*SOURCE   9 EXPRESSION_SYSTEM_VECTOR_TYPE: PLASMID;                              
*SOURCE  10 EXPRESSION_SYSTEM_PLASMID: PHIS-TEV-30A;                             
*SOURCE  11 MOL_ID: 2;                                                           
*SOURCE  12 ORGANISM_SCIENTIFIC: HOMO SAPIENS;                                   
*SOURCE  13 ORGANISM_COMMON: HUMAN;                                              
*SOURCE  14 ORGANISM_TAXID: 9606;                                                
*SOURCE  15 GENE: SMT3B, SMT3H1, SUMO3;                                          
*SOURCE  16 EXPRESSION_SYSTEM: ESCHERICHIA COLI;                                 
*SOURCE  17 EXPRESSION_SYSTEM_TAXID: 469008;                                     
*SOURCE  18 EXPRESSION_SYSTEM_STRAIN: BL21(DE3);                                 
*SOURCE  19 EXPRESSION_SYSTEM_VECTOR_TYPE: PLASMID;                              
*SOURCE  20 EXPRESSION_SYSTEM_PLASMID: PHIS-TEV-30A;                             
*SOURCE  21 MOL_ID: 3;                                                           
*SOURCE  22 SYNTHETIC: YES;                                                      
*SOURCE  23 ORGANISM_SCIENTIFIC: MUS MUSCULUS;                                   
*SOURCE  24 ORGANISM_COMMON: MOUSE;                                              
*SOURCE  25 ORGANISM_TAXID: 10090                                                
*KEYWDS    SUMO, DIMER, SIM, RNF4, COMPLEX, PROTEIN BINDING                      
*EXPDTA    SOLUTION NMR                                                          
*NUMMDL    10                                                                    
*AUTHOR    Y.XU, A.PLECHANOVOV, P.SIMPSON, J.MARCHANT, O.LEIDECKER, K.SEBASTIAN, 
*AUTHOR   2 R.T.HAY, S.J.MATTHEWS                                                
*REVDAT   3   16-JUL-14 2MP2    1                                     
*REVDAT   2   09-JUL-14 2MP2    1       JRNL                                     
*REVDAT   1   02-JUL-14 2MP2    0                                                

# chain A
assign (segid  A  and resid   73 and name   HN) (segid  A  and resid   12 and name   HN) 3.354 1.406 1.406 weight 1.000 ! spec=sumo...oesy, no=1, id=0, vol=2.017860e+00
assign (segid  A  and resid   73 and name   HN) (segid  A  and resid   74 and name   HN) 3.636 1.653 1.653 weight 1.000 ! spec=sumo...oesy, no=2, id=1, vol=1.242430e+00
assign (segid  A  and resid   73 and name   HN) (segid  A  and resid   72 and name   HN) 3.676 1.689 1.689 weight 1.000 ! spec=sumo...oesy, no=4, id=3, vol=1.163560e+00
assign (segid  A  and resid   73 and name   HN) (segid  A  and resid   72 and name   HA) 2.285 0.653 0.653 weight 1.000 ! spec=sumo...oesy, no=5, id=4, vol=2.018852e+01
assign (segid  A  and resid   73 and name   HN) (segid  A  and resid   11 and name   HA) 2.849 1.014 1.014 weight 1.000 ! spec=sumo...oesy, no=6, id=5, vol=5.373140e+00
assign (segid  A  and resid   73 and name   HN) (segid  A  and resid   73 and name   HA) 3.275 1.341 1.341 weight 1.000 ! spec=sumo...oesy, no=7, id=6, vol=2.325890e+00
assign (segid  A  and resid   73 and name   HN) (segid  A  and resid   72 and name   HB) 3.454 1.492 1.492 weight 1.000 ! spec=sumo...oesy, no=8, id=7, vol=1.690100e+00
assign (segid  A  and resid   73 and name   HN) (segid  A  and resid   10 and name  HB1) 3.291 1.354 1.354 weight 1.000 ! spec=sumo...oesy, no=9, id=8, vol=2.261360e+00
assign (segid  A  and resid   73 and name   HN) (segid  A  and resid   73 and name   HB) 2.612 0.853 0.853 weight 1.000 ! spec=sumo...oesy, no=10, id=9, vol=9.046960e+00
assign (segid  A  and resid   73 and name   HN) (segid  A  and resid   72 and name HG21) 2.529 0.800 0.800 weight 1.000 ! spec=sumo...oesy, no=13, id=12, vol=1.097313e+01
    or (segid  A  and resid   73 and name   HN) (segid  A  and resid   72 and name HG22)
    or (segid  A  and resid   73 and name   HN) (segid  A  and resid   72 and name HG23)
assign (segid  A  and resid   73 and name   HN) (segid  A  and resid   73 and name HG22) 3.177 1.262 1.262 weight 1.000 ! spec=sumo...oesy, no=14, id=13, vol=2.790590e+00
    or (segid  A  and resid   73 and name   HN) (segid  A  and resid   73 and name HG21)
    or (segid  A  and resid   73 and name   HN) (segid  A  and resid   73 and name HG23)
assign (segid  A  and resid   73 and name   HN) (segid  A  and resid   73 and name HG12) 3.119 1.216 1.216 weight 1.000 ! spec=sumo...oesy, no=15, id=14, vol=3.119660e+00
assign (segid  A  and resid   73 and name   HN) (segid  A  and resid   73 and name HD12) 3.153 1.243 1.243 weight 1.000 ! spec=sumo...oesy, no=16, id=15, vol=2.922970e+00
    or (segid  A  and resid   73 and name   HN) (segid  A  and resid   73 and name HD11)
    or (segid  A  and resid   73 and name   HN) (segid  A  and resid   73 and name HD13)
assign (segid  A  and resid   73 and name   HN) (segid  A  and resid   11 and name HG22) 3.474 1.509 1.509 weight 1.000 ! spec=sumo...oesy, no=17, id=16, vol=1.632780e+00
    or (segid  A  and resid   73 and name   HN) (segid  A  and resid   11 and name HG21)
    or (segid  A  and resid   73 and name   HN) (segid  A  and resid   11 and name HG23)
assign (segid  A  and resid   21 and name  HD1) (segid  A  and resid   21 and name   HA) 2.582 0.833 0.833 weight 1.000 ! spec=sumo...oesy, no=18, id=1076, vol=3.937960e+00
    or (segid  A  and resid   21 and name  HD2) (segid  A  and resid   21 and name   HA)
assign (segid  A  and resid   21 and name  HD1) (segid  A  and resid   21 and name  HB1) 2.348 0.689 0.689 weight 1.000 ! spec=sumo...oesy, no=19, id=1077, vol=6.959520e+00
    or (segid  A  and resid   21 and name  HD2) (segid  A  and resid   21 and name  HB1)
assign (segid  A  and resid   21 and name  HD1) (segid  A  and resid   21 and name  HB2) 2.347 0.688 0.688 weight 1.000 ! spec=sumo...oesy, no=20, id=1078, vol=6.982130e+00
    or (segid  A  and resid   21 and name  HD2) (segid  A  and resid   21 and name  HB2)
assign (segid  A  and resid   19 and name   HN) (segid  A  and resid   18 and name HG22) 2.504 0.784 0.784 weight 1.000 ! spec=sumo...oesy, no=21, id=20, vol=1.165804e+01
    or (segid  A  and resid   19 and name   HN) (segid  A  and resid   18 and name HG21)
    or (segid  A  and resid   19 and name   HN) (segid  A  and resid   18 and name HG23)
assign (segid  A  and resid   19 and name   HN) (segid  A  and resid   11 and name HG22) 3.466 1.502 1.502 weight 1.000 ! spec=sumo...oesy, no=22, id=21, vol=1.655140e+00
    or (segid  A  and resid   19 and name   HN) (segid  A  and resid   11 and name HG21)
    or (segid  A  and resid   19 and name   HN) (segid  A  and resid   11 and name HG23)
assign (segid  A  and resid   36 and name  HD1) (segid  A  and resid   36 and name  HE1) 2.086 0.544 0.544 weight 1.000 ! spec=sumo...oesy, no=25, id=1083, vol=1.415115e+01
    or (segid  A  and resid   36 and name  HD1) (segid  A  and resid   36 and name  HE2)
    or (segid  A  and resid   36 and name  HD2) (segid  A  and resid   36 and name  HE1)
    or (segid  A  and resid   36 and name  HD2) (segid  A  and resid   36 and name  HE2)
assign (segid  A  and resid   19 and name   HN) (segid  A  and resid   36 and name  HE1) 3.417 1.460 1.460 weight 1.000 ! spec=sumo...oesy, no=26, id=24, vol=1.802870e+00
    or (segid  A  and resid   19 and name   HN) (segid  A  and resid   36 and name  HE2)
assign (segid  A  and resid   19 and name   HN) (segid  A  and resid   18 and name   HA) 2.132 0.568 0.568 weight 1.000 ! spec=sumo...oesy, no=27, id=25, vol=3.053950e+01
assign (segid  A  and resid   36 and name  HD1) (segid  A  and resid   36 and name  HB1) 2.353 0.692 0.692 weight 1.000 ! spec=sumo...oesy, no=28, id=1086, vol=6.876210e+00
    or (segid  A  and resid   36 and name  HD2) (segid  A  and resid   36 and name  HB1)
assign (segid  A  and resid   19 and name   HN) (segid  A  and resid   19 and name   HB) 2.542 0.808 0.808 weight 1.000 ! spec=sumo...oesy, no=29, id=27, vol=1.063644e+01
assign (segid  A  and resid   19 and name   HN) (segid  A  and resid   18 and name   HB) 3.087 1.192 1.192 weight 1.000 ! spec=sumo...oesy, no=30, id=28, vol=3.315790e+00
assign (segid  A  and resid   19 and name   HN) (segid  A  and resid   10 and name  HB2) 3.668 1.682 1.682 weight 1.000 ! spec=sumo...oesy, no=31, id=29, vol=1.179580e+00
assign (segid  A  and resid   19 and name   HN) (segid  A  and resid   12 and name  HB2) 3.330 1.386 1.386 weight 1.000 ! spec=sumo...oesy, no=32, id=30, vol=2.107050e+00
    or (segid  A  and resid   19 and name   HN) (segid  A  and resid   12 and name  HB1)
    or (segid  A  and resid   19 and name   HN) (segid  A  and resid   12 and name  HB3)
assign (segid  A  and resid   19 and name   HN) (segid  A  and resid   19 and name HG22) 2.572 0.827 0.827 weight 1.000 ! spec=sumo...oesy, no=33, id=31, vol=9.920740e+00
    or (segid  A  and resid   19 and name   HN) (segid  A  and resid   19 and name HG21)
    or (segid  A  and resid   19 and name   HN) (segid  A  and resid   19 and name HG23)
assign (segid  A  and resid   74 and name   HN) (segid  A  and resid   50 and name   HN) 2.903 1.053 1.053 weight 1.000 ! spec=sumo...oesy, no=35, id=32, vol=4.799240e+00
assign (segid  A  and resid   74 and name   HN) (segid  A  and resid   75 and name   HN) 3.188 1.270 1.270 weight 1.000 ! spec=sumo...oesy, no=37, id=33, vol=2.735180e+00
assign (segid  A  and resid   74 and name   HN) (segid  A  and resid   73 and name   HA) 2.261 0.639 0.639 weight 1.000 ! spec=sumo...oesy, no=39, id=35, vol=2.150884e+01
assign (segid  A  and resid   74 and name   HN) (segid  A  and resid   73 and name HG11) 3.285 1.349 1.349 weight 1.000 ! spec=sumo...oesy, no=42, id=38, vol=2.286770e+00
assign (segid  A  and resid   49 and name  HD1) (segid  A  and resid   75 and name   HA) 2.989 1.117 1.117 weight 1.000 ! spec=sumo...oesy, no=43, id=1100, vol=1.635340e+00
    or (segid  A  and resid   49 and name  HD2) (segid  A  and resid   75 and name   HA)
assign (segid  A  and resid   49 and name  HD1) (segid  A  and resid   48 and name   HA) 2.959 1.094 1.094 weight 1.000 ! spec=sumo...oesy, no=44, id=1101, vol=1.739180e+00
    or (segid  A  and resid   49 and name  HD2) (segid  A  and resid   48 and name   HA)
assign (segid  A  and resid   49 and name  HD1) (segid  A  and resid   49 and name  HB1) 2.457 0.755 0.755 weight 1.000 ! spec=sumo...oesy, no=45, id=1102, vol=5.301130e+00
    or (segid  A  and resid   49 and name  HD2) (segid  A  and resid   49 and name  HB1)
assign (segid  A  and resid   49 and name  HD1) (segid  A  and resid   49 and name  HB2) 2.464 0.759 0.759 weight 1.000 ! spec=sumo...oesy, no=46, id=1103, vol=5.211980e+00
    or (segid  A  and resid   49 and name  HD2) (segid  A  and resid   49 and name  HB2)
assign (segid  A  and resid   74 and name   HN) (segid  A  and resid   72 and name HG21) 3.504 1.535 1.535 weight 1.000 ! spec=sumo...oesy, no=49, id=44, vol=1.550610e+00
    or (segid  A  and resid   74 and name   HN) (segid  A  and resid   72 and name HG22)
    or (segid  A  and resid   74 and name   HN) (segid  A  and resid   72 and name HG23)
assign (segid  A  and resid   44 and name   HN) (segid  A  and resid   43 and name   HN) 3.748 1.756 1.756 weight 1.000 ! spec=sumo...oesy, no=54, id=48, vol=1.035880e+00
assign (segid  A  and resid   44 and name   HN) (segid  A  and resid   44 and name   HA) 2.845 1.012 1.012 weight 1.000 ! spec=sumo...oesy, no=55, id=49, vol=5.416050e+00
assign (segid  A  and resid   44 and name   HN) (segid  A  and resid   43 and name  HB1) 3.057 1.168 1.168 weight 1.000 ! spec=sumo...oesy, no=56, id=50, vol=3.518470e+00
assign (segid  A  and resid   44 and name   HN) (segid  A  and resid   43 and name  HB2) 3.208 1.286 1.286 weight 1.000 ! spec=sumo...oesy, no=57, id=51, vol=2.637010e+00
assign (segid  A  and resid   44 and name   HN) (segid  A  and resid   37 and name  HB1) 3.855 1.858 1.858 weight 1.000 ! spec=sumo...oesy, no=59, id=53, vol=8.747200e-01
assign (segid  A  and resid   76 and name  HD1) (segid  A  and resid   76 and name   HA) 2.586 0.836 0.836 weight 1.000 ! spec=sumo...oesy, no=62, id=1114, vol=3.898480e+00
    or (segid  A  and resid   76 and name  HD2) (segid  A  and resid   76 and name   HA)
assign (segid  A  and resid   76 and name  HD1) (segid  A  and resid   76 and name  HB1) 2.425 0.735 0.735 weight 1.000 ! spec=sumo...oesy, no=63, id=1115, vol=5.741100e+00
    or (segid  A  and resid   76 and name  HD2) (segid  A  and resid   76 and name  HB1)
assign (segid  A  and resid   76 and name  HD1) (segid  A  and resid   76 and name  HB2) 2.315 0.670 0.670 weight 1.000 ! spec=sumo...oesy, no=64, id=1116, vol=7.586260e+00
    or (segid  A  and resid   76 and name  HD2) (segid  A  and resid   76 and name  HB2)
assign (segid  A  and resid   76 and name  HD1) (segid  A  and resid   50 and name  HB1) 2.877 1.035 1.035 weight 1.000 ! spec=sumo...oesy, no=66, id=1118, vol=2.055040e+00
    or (segid  A  and resid   76 and name  HD2) (segid  A  and resid   50 and name  HB1)
assign (segid  A  and resid   76 and name  HD1) (segid  A  and resid   50 and name  HG2) 2.881 1.037 1.037 weight 1.000 ! spec=sumo...oesy, no=67, id=1119, vol=2.039770e+00
    or (segid  A  and resid   76 and name  HD2) (segid  A  and resid   50 and name  HG2)
assign (segid  A  and resid   53 and name   HN) (segid  A  and resid   53 and name  HA1) 2.417 0.730 0.730 weight 1.000 ! spec=sumo...oesy, no=72, id=57, vol=1.441809e+01
assign (segid  A  and resid   53 and name   HN) (segid  A  and resid   52 and name   HA) 2.472 0.764 0.764 weight 1.000 ! spec=sumo...oesy, no=73, id=58, vol=1.259421e+01
assign (segid  A  and resid   53 and name   HN) (segid  A  and resid   53 and name  HA2) 2.308 0.666 0.666 weight 1.000 ! spec=sumo...oesy, no=74, id=59, vol=1.898488e+01
assign (segid  A  and resid   53 and name   HN) (segid  A  and resid   50 and name  HD2) 3.059 1.170 1.170 weight 1.000 ! spec=sumo...oesy, no=75, id=60, vol=3.505630e+00
assign (segid  A  and resid   53 and name   HN) (segid  A  and resid   50 and name  HG1) 3.816 1.821 1.821 weight 1.000 ! spec=sumo...oesy, no=79, id=64, vol=9.293900e-01
assign (segid  A  and resid   59 and name   HN) (segid  A  and resid   58 and name   HN) 2.693 0.906 0.906 weight 1.000 ! spec=sumo...oesy, no=83, id=65, vol=7.535530e+00
assign (segid  A  and resid   76 and name  HE2) (segid  A  and resid   50 and name  HD1) 2.702 0.912 0.912 weight 1.000 ! spec=sumo...oesy, no=85, id=1123, vol=2.999250e+00
assign (segid  A  and resid   59 and name   HN) (segid  A  and resid   57 and name   HA) 3.201 1.281 1.281 weight 1.000 ! spec=sumo...oesy, no=86, id=67, vol=2.668500e+00
assign (segid  A  and resid   76 and name  HE2) (segid  A  and resid   50 and name  HB1) 2.642 0.872 0.872 weight 1.000 ! spec=sumo...oesy, no=87, id=1125, vol=3.432860e+00
assign (segid  A  and resid   76 and name  HE2) (segid  A  and resid   50 and name  HB2) 2.848 1.014 1.014 weight 1.000 ! spec=sumo...oesy, no=88, id=1126, vol=2.187630e+00
assign (segid  A  and resid   76 and name  HE2) (segid  A  and resid   50 and name  HG2) 2.961 1.096 1.096 weight 1.000 ! spec=sumo...oesy, no=89, id=1127, vol=1.731970e+00
assign (segid  A  and resid   76 and name  HE2) (segid  A  and resid   50 and name  HG1) 3.239 1.311 1.311 weight 1.000 ! spec=sumo...oesy, no=90, id=1128, vol=1.010570e+00
assign (segid  A  and resid   59 and name   HN) (segid  A  and resid   57 and name  HB1) 2.632 0.866 0.866 weight 1.000 ! spec=sumo...oesy, no=91, id=72, vol=8.634980e+00
assign (segid  A  and resid   59 and name   HN) (segid  A  and resid   57 and name  HB2) 2.882 1.038 1.038 weight 1.000 ! spec=sumo...oesy, no=92, id=73, vol=5.015610e+00
assign (segid  A  and resid   49 and name  HE1) (segid  A  and resid   49 and name   HZ) 2.209 0.610 0.610 weight 1.000 ! spec=sumo...oesy, no=94, id=1129, vol=1.004090e+01
    or (segid  A  and resid   49 and name  HE2) (segid  A  and resid   49 and name   HZ)
assign (segid  A  and resid   49 and name  HD1) (segid  A  and resid   49 and name  HE1) 1.843 0.425 0.425 weight 1.000 ! spec=sumo...oesy, no=95, id=1130, vol=2.977453e+01
    or (segid  A  and resid   49 and name  HD1) (segid  A  and resid   49 and name  HE2)
    or (segid  A  and resid   49 and name  HD2) (segid  A  and resid   49 and name  HE1)
    or (segid  A  and resid   49 and name  HD2) (segid  A  and resid   49 and name  HE2)
assign (segid  A  and resid   49 and name  HE1) (segid  A  and resid   49 and name   HA) 3.281 1.345 1.345 weight 1.000 ! spec=sumo...oesy, no=97, id=1131, vol=9.355000e-01
    or (segid  A  and resid   49 and name  HE2) (segid  A  and resid   49 and name   HA)
assign (segid  A  and resid   49 and name  HE1) (segid  A  and resid   49 and name  HB2) 3.121 1.217 1.217 weight 1.000 ! spec=sumo...oesy, no=99, id=1133, vol=1.262760e+00
    or (segid  A  and resid   49 and name  HE2) (segid  A  and resid   49 and name  HB2)
assign (segid  A  and resid   20 and name   HN) (segid  A  and resid   20 and name   HA) 2.655 0.881 0.881 weight 1.000 ! spec=sumo...oesy, no=100, id=79, vol=8.193090e+00
assign (segid  A  and resid   49 and name  HE1) (segid  A  and resid   33 and name  HB2) 2.646 0.875 0.875 weight 1.000 ! spec=sumo...oesy, no=101, id=1135, vol=3.399200e+00
    or (segid  A  and resid   49 and name  HE2) (segid  A  and resid   33 and name  HB2)
assign (segid  A  and resid   20 and name   HN) (segid  A  and resid   19 and name   HA) 1.950 0.475 0.475 weight 1.000 ! spec=sumo...oesy, no=102, id=81, vol=5.221318e+01
assign (segid  A  and resid   49 and name  HE1) (segid  A  and resid   47 and name HG22) 2.886 1.041 1.041 weight 1.000 ! spec=sumo...oesy, no=103, id=1137, vol=2.018280e+00
    or (segid  A  and resid   49 and name  HE1) (segid  A  and resid   47 and name HG21)
    or (segid  A  and resid   49 and name  HE1) (segid  A  and resid   47 and name HG23)
    or (segid  A  and resid   49 and name  HE2) (segid  A  and resid   47 and name HG22)
    or (segid  A  and resid   49 and name  HE2) (segid  A  and resid   47 and name HG21)
    or (segid  A  and resid   49 and name  HE2) (segid  A  and resid   47 and name HG23)
assign (segid  A  and resid   49 and name  HE1) (segid  A  and resid   75 and name HG12) 2.907 1.057 1.057 weight 1.000 ! spec=sumo...oesy, no=105, id=1139, vol=1.931360e+00
    or (segid  A  and resid   49 and name  HE1) (segid  A  and resid   75 and name HG11)
    or (segid  A  and resid   49 and name  HE1) (segid  A  and resid   75 and name HG13)
    or (segid  A  and resid   49 and name  HE2) (segid  A  and resid   75 and name HG12)
    or (segid  A  and resid   49 and name  HE2) (segid  A  and resid   75 and name HG11)
    or (segid  A  and resid   49 and name  HE2) (segid  A  and resid   75 and name HG13)
assign (segid  A  and resid   20 and name   HN) (segid  A  and resid   19 and name HG12) 2.286 0.653 0.653 weight 1.000 ! spec=sumo...oesy, no=107, id=86, vol=2.013492e+01
    or (segid  A  and resid   20 and name   HN) (segid  A  and resid   19 and name HG11)
    or (segid  A  and resid   20 and name   HN) (segid  A  and resid   19 and name HG13)
assign (segid  A  and resid   20 and name   HN) (segid  A  and resid   19 and name   HN) 3.687 1.700 1.700 weight 1.000 ! spec=sumo...oesy, no=108, id=87, vol=1.142550e+00
assign (segid  A  and resid   49 and name  HE1) (segid  A  and resid   36 and name  HB2) 3.259 1.328 1.328 weight 1.000 ! spec=sumo...oesy, no=109, id=1143, vol=9.733600e-01
    or (segid  A  and resid   49 and name  HE2) (segid  A  and resid   36 and name  HB2)
assign (segid  A  and resid   49 and name  HE1) (segid  A  and resid   49 and name  HB1) 3.186 1.269 1.269 weight 1.000 ! spec=sumo...oesy, no=110, id=1144, vol=1.114660e+00
    or (segid  A  and resid   49 and name  HE2) (segid  A  and resid   49 and name  HB1)
assign (segid  A  and resid   49 and name  HE1) (segid  A  and resid   33 and name  HG1) 3.214 1.291 1.291 weight 1.000 ! spec=sumo...oesy, no=111, id=1145, vol=1.057680e+00
    or (segid  A  and resid   49 and name  HE2) (segid  A  and resid   33 and name  HG1)
assign (segid  A  and resid   76 and name   HN) (segid  A  and resid   48 and name   HN) 2.710 0.918 0.918 weight 1.000 ! spec=sumo...oesy, no=115, id=92, vol=7.251580e+00
assign (segid  A  and resid   76 and name   HN) (segid  A  and resid   76 and name  HD1) 2.807 0.985 0.985 weight 1.000 ! spec=sumo...oesy, no=116, id=93, vol=5.872820e+00
    or (segid  A  and resid   76 and name   HN) (segid  A  and resid   76 and name  HD2)
assign (segid  A  and resid   76 and name   HN) (segid  A  and resid   49 and name   HA) 2.932 1.074 1.074 weight 1.000 ! spec=sumo...oesy, no=117, id=94, vol=4.524950e+00
assign (segid  A  and resid   76 and name   HN) (segid  A  and resid   47 and name   HA) 3.506 1.537 1.537 weight 1.000 ! spec=sumo...oesy, no=118, id=95, vol=1.544970e+00
assign (segid  A  and resid   76 and name   HN) (segid  A  and resid   76 and name  HB1) 2.837 1.006 1.006 weight 1.000 ! spec=sumo...oesy, no=119, id=96, vol=5.510640e+00
assign (segid  A  and resid   76 and name   HN) (segid  A  and resid   76 and name  HB2) 2.716 0.922 0.922 weight 1.000 ! spec=sumo...oesy, no=120, id=97, vol=7.146890e+00
assign (segid  A  and resid   76 and name   HN) (segid  A  and resid   48 and name  HB2) 3.468 1.503 1.503 weight 1.000 ! spec=sumo...oesy, no=122, id=99, vol=1.650810e+00
assign (segid  A  and resid   76 and name   HN) (segid  A  and resid   75 and name HG12) 2.610 0.852 0.852 weight 1.000 ! spec=sumo...oesy, no=124, id=101, vol=9.080310e+00
    or (segid  A  and resid   76 and name   HN) (segid  A  and resid   75 and name HG11)
    or (segid  A  and resid   76 and name   HN) (segid  A  and resid   75 and name HG13)
assign (segid  A  and resid   76 and name   HN) (segid  A  and resid   75 and name HG22) 2.752 0.946 0.946 weight 1.000 ! spec=sumo...oesy, no=125, id=102, vol=6.617400e+00
    or (segid  A  and resid   76 and name   HN) (segid  A  and resid   75 and name HG21)
    or (segid  A  and resid   76 and name   HN) (segid  A  and resid   75 and name HG23)
assign (segid  A  and resid   57 and name   HN) (segid  A  and resid   57 and name HD22) 3.466 1.502 1.502 weight 1.000 ! spec=sumo...oesy, no=131, id=104, vol=1.656910e+00
assign (segid  A  and resid   57 and name   HN) (segid  A  and resid   57 and name   HA) 2.671 0.892 0.892 weight 1.000 ! spec=sumo...oesy, no=132, id=105, vol=7.906080e+00
assign (segid  A  and resid   57 and name   HN) (segid  A  and resid   56 and name   HA) 2.169 0.588 0.588 weight 1.000 ! spec=sumo...oesy, no=133, id=106, vol=2.755036e+01
assign (segid  A  and resid   57 and name   HN) (segid  A  and resid   57 and name  HB2) 2.554 0.815 0.815 weight 1.000 ! spec=sumo...oesy, no=134, id=107, vol=1.034632e+01
assign (segid  A  and resid   57 and name   HN) (segid  A  and resid   60 and name  HB2) 3.179 1.263 1.263 weight 1.000 ! spec=sumo...oesy, no=135, id=108, vol=2.780830e+00
assign (segid  A  and resid   57 and name   HN) (segid  A  and resid   56 and name HG22) 2.493 0.777 0.777 weight 1.000 ! spec=sumo...oesy, no=138, id=111, vol=1.195458e+01
    or (segid  A  and resid   57 and name   HN) (segid  A  and resid   56 and name HG21)
    or (segid  A  and resid   57 and name   HN) (segid  A  and resid   56 and name HG23)
assign (segid  A  and resid   57 and name   HN) (segid  A  and resid   56 and name HD12) 3.522 1.551 1.551 weight 1.000 ! spec=sumo...oesy, no=139, id=112, vol=1.504740e+00
    or (segid  A  and resid   57 and name   HN) (segid  A  and resid   56 and name HD11)
    or (segid  A  and resid   57 and name   HN) (segid  A  and resid   56 and name HD13)
assign (segid  A  and resid   57 and name   HN) (segid  A  and resid   57 and name HD21) 3.155 1.245 1.245 weight 1.000 ! spec=sumo...oesy, no=140, id=113, vol=2.909450e+00
assign (segid  A  and resid   57 and name   HN) (segid  A  and resid   59 and name   HN) 3.828 1.831 1.831 weight 1.000 ! spec=sumo...oesy, no=141, id=114, vol=9.133000e-01
assign (segid  A  and resid   57 and name   HN) (segid  A  and resid   57 and name  HB1) 2.766 0.957 0.957 weight 1.000 ! spec=sumo...oesy, no=142, id=115, vol=6.407370e+00
assign (segid  A  and resid   57 and name   HN) (segid  A  and resid   29 and name HD12) 3.473 1.508 1.508 weight 1.000 ! spec=sumo...oesy, no=143, id=116, vol=1.635680e+00
    or (segid  A  and resid   57 and name   HN) (segid  A  and resid   29 and name HD11)
    or (segid  A  and resid   57 and name   HN) (segid  A  and resid   29 and name HD13)
assign (segid  A  and resid    9 and name   HN) (segid  A  and resid    8 and name   HA) 2.189 0.599 0.599 weight 1.000 ! spec=sumo...oesy, no=145, id=117, vol=2.609939e+01
assign (segid  A  and resid    9 and name   HN) (segid  A  and resid   22 and name   HA) 2.983 1.112 1.112 weight 1.000 ! spec=sumo...oesy, no=146, id=118, vol=4.076640e+00
assign (segid  A  and resid    9 and name   HN) (segid  A  and resid   20 and name   HA) 3.750 1.758 1.758 weight 1.000 ! spec=sumo...oesy, no=147, id=119, vol=1.032320e+00
assign (segid  A  and resid    9 and name   HN) (segid  A  and resid   21 and name  HB1) 3.654 1.669 1.669 weight 1.000 ! spec=sumo...oesy, no=148, id=120, vol=1.206620e+00
assign (segid  A  and resid    9 and name   HN) (segid  A  and resid    9 and name  HB2) 2.907 1.056 1.056 weight 1.000 ! spec=sumo...oesy, no=150, id=122, vol=4.758320e+00
assign (segid  A  and resid    9 and name   HN) (segid  A  and resid   10 and name   HN) 3.699 1.710 1.710 weight 1.000 ! spec=sumo...oesy, no=152, id=124, vol=1.121450e+00
assign (segid  A  and resid    6 and name  HD2) (segid  A  and resid    6 and name  HB1) 3.000 1.125 1.125 weight 1.000 ! spec=sumo...oesy, no=153, id=1152, vol=1.601330e+00
assign (segid  A  and resid    9 and name   HN) (segid  A  and resid    9 and name   HA) 2.983 1.112 1.112 weight 1.000 ! spec=sumo...oesy, no=154, id=126, vol=4.076390e+00
assign (segid  A  and resid    6 and name  HD2) (segid  A  and resid   22 and name  HB2) 3.156 1.245 1.245 weight 1.000 ! spec=sumo...oesy, no=155, id=1154, vol=1.180410e+00
assign (segid  A  and resid    9 and name   HN) (segid  A  and resid    9 and name  HB1) 2.534 0.803 0.803 weight 1.000 ! spec=sumo...oesy, no=157, id=129, vol=1.083910e+01
assign (segid  A  and resid    9 and name   HN) (segid  A  and resid   32 and name   HG) 3.641 1.657 1.657 weight 1.000 ! spec=sumo...oesy, no=159, id=131, vol=1.232330e+00
assign (segid  A  and resid   26 and name  HD2) (segid  A  and resid   26 and name  HB2) 2.864 1.025 1.025 weight 1.000 ! spec=sumo...oesy, no=163, id=1159, vol=2.115270e+00
assign (segid  A  and resid   26 and name  HD2) (segid  A  and resid    4 and name  HB2) 3.171 1.257 1.257 weight 1.000 ! spec=sumo...oesy, no=164, id=1160, vol=1.147220e+00
assign (segid  A  and resid   26 and name  HD2) (segid  A  and resid   25 and name  HB2) 3.022 1.142 1.142 weight 1.000 ! spec=sumo...oesy, no=165, id=1161, vol=1.530190e+00
assign (segid  A  and resid   26 and name  HD2) (segid  A  and resid   63 and name  HB2) 2.908 1.057 1.057 weight 1.000 ! spec=sumo...oesy, no=166, id=1162, vol=1.929030e+00
    or (segid  A  and resid   26 and name  HD2) (segid  A  and resid   63 and name  HB1)
    or (segid  A  and resid   26 and name  HD2) (segid  A  and resid   63 and name  HB3)
assign (segid  A  and resid   26 and name  HD2) (segid  A  and resid    4 and name   HA) 2.955 1.091 1.091 weight 1.000 ! spec=sumo...oesy, no=167, id=1163, vol=1.752170e+00
assign (segid  A  and resid   26 and name  HD2) (segid  A  and resid   26 and name  HB1) 3.057 1.168 1.168 weight 1.000 ! spec=sumo...oesy, no=168, id=1164, vol=1.428440e+00
assign (segid  A  and resid   78 and name   HN) (segid  A  and resid   78 and name  HB2) 2.338 0.683 0.683 weight 1.000 ! spec=sumo...oesy, no=172, id=141, vol=1.758769e+01
assign (segid  A  and resid   24 and name   HN) (segid  A  and resid   23 and name   HA) 2.401 0.721 0.721 weight 1.000 ! spec=sumo...oesy, no=179, id=147, vol=1.498264e+01
assign (segid  A  and resid   24 and name   HN) (segid  A  and resid   24 and name   HA) 2.940 1.080 1.080 weight 1.000 ! spec=sumo...oesy, no=180, id=148, vol=4.450000e+00
assign (segid  A  and resid   24 and name   HN) (segid  A  and resid   27 and name   HB) 3.114 1.212 1.212 weight 1.000 ! spec=sumo...oesy, no=181, id=149, vol=3.149220e+00
assign (segid  A  and resid   24 and name   HN) (segid  A  and resid   24 and name  HB2) 2.331 0.679 0.679 weight 1.000 ! spec=sumo...oesy, no=183, id=151, vol=1.790918e+01
assign (segid  A  and resid   24 and name   HN) (segid  A  and resid   23 and name HG12) 2.745 0.942 0.942 weight 1.000 ! spec=sumo...oesy, no=184, id=152, vol=6.707860e+00
assign (segid  A  and resid   57 and name   HN) (segid  A  and resid   60 and name   HN) 3.139 1.232 1.232 weight 1.000 ! spec=sumo...oesy, no=188, id=156, vol=3.002770e+00
assign (segid  A  and resid   60 and name   HN) (segid  A  and resid   58 and name   HN) 3.021 1.141 1.141 weight 1.000 ! spec=sumo...oesy, no=189, id=157, vol=3.776470e+00
assign (segid  A  and resid   59 and name   HN) (segid  A  and resid   60 and name   HN) 2.292 0.657 0.657 weight 1.000 ! spec=sumo...oesy, no=192, id=158, vol=1.980344e+01
assign (segid  A  and resid   60 and name   HN) (segid  A  and resid   57 and name   HA) 3.563 1.587 1.587 weight 1.000 ! spec=sumo...oesy, no=193, id=159, vol=1.402770e+00
assign (segid  A  and resid   60 and name   HN) (segid  A  and resid   59 and name   HB) 3.516 1.545 1.545 weight 1.000 ! spec=sumo...oesy, no=194, id=160, vol=1.520890e+00
assign (segid  A  and resid   60 and name   HN) (segid  A  and resid   59 and name   HA) 2.882 1.038 1.038 weight 1.000 ! spec=sumo...oesy, no=196, id=162, vol=5.015340e+00
assign (segid  A  and resid   60 and name   HN) (segid  A  and resid   58 and name   HA) 3.110 1.209 1.209 weight 1.000 ! spec=sumo...oesy, no=198, id=164, vol=3.174450e+00
assign (segid  A  and resid   60 and name   HN) (segid  A  and resid   57 and name  HB2) 2.876 1.034 1.034 weight 1.000 ! spec=sumo...oesy, no=200, id=166, vol=5.070870e+00
assign (segid  A  and resid   60 and name   HN) (segid  A  and resid   60 and name  HB2) 2.559 0.818 0.818 weight 1.000 ! spec=sumo...oesy, no=201, id=167, vol=1.023020e+01
assign (segid  A  and resid   60 and name   HN) (segid  A  and resid   59 and name HG21) 3.057 1.168 1.168 weight 1.000 ! spec=sumo...oesy, no=205, id=171, vol=3.519310e+00
    or (segid  A  and resid   60 and name   HN) (segid  A  and resid   59 and name HG22)
    or (segid  A  and resid   60 and name   HN) (segid  A  and resid   59 and name HG23)
assign (segid  A  and resid   60 and name   HN) (segid  A  and resid   56 and name HG22) 3.068 1.177 1.177 weight 1.000 ! spec=sumo...oesy, no=207, id=173, vol=3.441800e+00
    or (segid  A  and resid   60 and name   HN) (segid  A  and resid   56 and name HG21)
    or (segid  A  and resid   60 and name   HN) (segid  A  and resid   56 and name HG23)
assign (segid  A  and resid   60 and name   HN) (segid  A  and resid   29 and name HD12) 3.048 1.162 1.162 weight 1.000 ! spec=sumo...oesy, no=208, id=174, vol=3.578150e+00
    or (segid  A  and resid   60 and name   HN) (segid  A  and resid   29 and name HD11)
    or (segid  A  and resid   60 and name   HN) (segid  A  and resid   29 and name HD13)
assign (segid  A  and resid    8 and name   HN) (segid  A  and resid   70 and name   HN) 3.103 1.204 1.204 weight 1.000 ! spec=sumo...oesy, no=209, id=175, vol=3.216070e+00
assign (segid  A  and resid   27 and name   HB) (segid  A  and resid   24 and name  HB2) 2.482 0.770 0.770 weight 1.000 ! spec=sumo...oesy, no=212, id=1167, vol=4.983740e+00
assign (segid  A  and resid    8 and name   HN) (segid  A  and resid   70 and name   HA) 3.710 1.721 1.721 weight 1.000 ! spec=sumo...oesy, no=213, id=177, vol=1.101140e+00
assign (segid  A  and resid   27 and name   HB) (segid  A  and resid   23 and name HG11) 2.628 0.863 0.863 weight 1.000 ! spec=sumo...oesy, no=214, id=1169, vol=3.538220e+00
assign (segid  A  and resid   27 and name   HB) (segid  A  and resid   23 and name HD12) 2.339 0.684 0.684 weight 1.000 ! spec=sumo...oesy, no=215, id=1170, vol=7.121380e+00
    or (segid  A  and resid   27 and name   HB) (segid  A  and resid   23 and name HD11)
    or (segid  A  and resid   27 and name   HB) (segid  A  and resid   23 and name HD13)
assign (segid  A  and resid   80 and name   HB) (segid  A  and resid   80 and name HG21) 1.875 0.439 0.439 weight 1.000 ! spec=sumo...oesy, no=216, id=1171, vol=2.684847e+01
    or (segid  A  and resid   80 and name   HB) (segid  A  and resid   80 and name HG22)
    or (segid  A  and resid   80 and name   HB) (segid  A  and resid   80 and name HG23)
assign (segid  A  and resid    8 and name   HN) (segid  A  and resid    7 and name HG11) 3.016 1.137 1.137 weight 1.000 ! spec=sumo...oesy, no=217, id=181, vol=3.813970e+00
assign (segid  A  and resid    8 and name   HN) (segid  A  and resid    7 and name HG22) 2.960 1.095 1.095 weight 1.000 ! spec=sumo...oesy, no=219, id=183, vol=4.271550e+00
    or (segid  A  and resid    8 and name   HN) (segid  A  and resid    7 and name HG21)
    or (segid  A  and resid    8 and name   HN) (segid  A  and resid    7 and name HG23)
assign (segid  A  and resid    8 and name   HN) (segid  A  and resid    7 and name HD12) 3.352 1.405 1.405 weight 1.000 ! spec=sumo...oesy, no=220, id=184, vol=2.023940e+00
    or (segid  A  and resid    8 and name   HN) (segid  A  and resid    7 and name HD11)
    or (segid  A  and resid    8 and name   HN) (segid  A  and resid    7 and name HD13)
assign (segid  A  and resid    8 and name   HN) (segid  A  and resid    8 and name   HA) 2.948 1.086 1.086 weight 1.000 ! spec=sumo...oesy, no=221, id=185, vol=4.379190e+00
assign (segid  A  and resid   59 and name   HB) (segid  A  and resid   28 and name  HB1) 2.988 1.116 1.116 weight 1.000 ! spec=sumo...oesy, no=223, id=1172, vol=1.638800e+00
assign (segid  A  and resid    3 and name   HN) (segid  A  and resid    3 and name   HA) 3.009 1.132 1.132 weight 1.000 ! spec=sumo...oesy, no=224, id=187, vol=3.868460e+00
assign (segid  A  and resid    3 and name   HN) (segid  A  and resid    3 and name  HB1) 3.487 1.520 1.520 weight 1.000 ! spec=sumo...oesy, no=226, id=189, vol=1.596440e+00
assign (segid  A  and resid    3 and name   HN) (segid  A  and resid    3 and name  HB2) 3.157 1.245 1.245 weight 1.000 ! spec=sumo...oesy, no=227, id=190, vol=2.903100e+00
assign (segid  A  and resid   22 and name   HN) (segid  A  and resid   21 and name   HN) 3.192 1.274 1.274 weight 1.000 ! spec=sumo...oesy, no=228, id=191, vol=2.713810e+00
assign (segid  A  and resid   61 and name   HB) (segid  A  and resid   61 and name   HA) 2.311 0.668 0.668 weight 1.000 ! spec=sumo...oesy, no=229, id=1178, vol=7.647810e+00
assign (segid  A  and resid   61 and name   HB) (segid  A  and resid   26 and name   HA) 2.513 0.790 0.790 weight 1.000 ! spec=sumo...oesy, no=230, id=1179, vol=4.627540e+00
assign (segid  A  and resid   61 and name   HB) (segid  A  and resid   61 and name HG21) 2.128 0.566 0.566 weight 1.000 ! spec=sumo...oesy, no=231, id=1180, vol=1.254271e+01
    or (segid  A  and resid   61 and name   HB) (segid  A  and resid   61 and name HG22)
    or (segid  A  and resid   61 and name   HB) (segid  A  and resid   61 and name HG23)
assign (segid  A  and resid   22 and name   HN) (segid  A  and resid   22 and name   HA) 2.744 0.941 0.941 weight 1.000 ! spec=sumo...oesy, no=232, id=194, vol=6.721270e+00
assign (segid  A  and resid   22 and name   HN) (segid  A  and resid   21 and name  HB1) 2.583 0.834 0.834 weight 1.000 ! spec=sumo...oesy, no=233, id=195, vol=9.658830e+00
assign (segid  A  and resid   62 and name   HA) (segid  A  and resid   65 and name  HB1) 2.610 0.852 0.852 weight 1.000 ! spec=sumo...oesy, no=236, id=1184, vol=3.685630e+00
assign (segid  A  and resid   62 and name   HA) (segid  A  and resid   67 and name  HE2) 2.767 0.957 0.957 weight 1.000 ! spec=sumo...oesy, no=237, id=1185, vol=2.597250e+00
    or (segid  A  and resid   62 and name   HA) (segid  A  and resid   67 and name  HE1)
    or (segid  A  and resid   62 and name   HA) (segid  A  and resid   67 and name  HE3)
assign (segid  A  and resid   78 and name   HN) (segid  A  and resid   79 and name   HN) 3.647 1.662 1.662 weight 1.000 ! spec=sumo...oesy, no=242, id=203, vol=1.221030e+00
assign (segid  A  and resid   55 and name   HA) (segid  A  and resid   55 and name  HG1) 3.381 1.429 1.429 weight 1.000 ! spec=sumo...oesy, no=243, id=1191, vol=7.811500e-01
assign (segid  A  and resid   79 and name   HN) (segid  A  and resid   78 and name   HA) 2.360 0.696 0.696 weight 1.000 ! spec=sumo...oesy, no=244, id=205, vol=1.662128e+01
assign (segid  A  and resid   79 and name   HN) (segid  A  and resid   79 and name  HB1) 3.101 1.202 1.202 weight 1.000 ! spec=sumo...oesy, no=246, id=207, vol=3.227000e+00
assign (segid  A  and resid   28 and name   HA) (segid  A  and resid   61 and name   HA) 2.523 0.796 0.796 weight 1.000 ! spec=sumo...oesy, no=248, id=1196, vol=4.518050e+00
assign (segid  A  and resid   29 and name   HN) (segid  A  and resid   60 and name   HN) 3.812 1.816 1.816 weight 1.000 ! spec=sumo...oesy, no=250, id=210, vol=9.364600e-01
assign (segid  A  and resid   29 and name   HN) (segid  A  and resid   61 and name   HN) 3.797 1.802 1.802 weight 1.000 ! spec=sumo...oesy, no=251, id=211, vol=9.586900e-01
assign (segid  A  and resid   28 and name   HA) (segid  A  and resid   28 and name  HB1) 2.180 0.594 0.594 weight 1.000 ! spec=sumo...oesy, no=252, id=1199, vol=1.085357e+01
assign (segid  A  and resid   28 and name   HA) (segid  A  and resid   28 and name  HB2) 2.254 0.635 0.635 weight 1.000 ! spec=sumo...oesy, no=253, id=1200, vol=8.882470e+00
assign (segid  A  and resid   28 and name   HA) (segid  A  and resid   28 and name  HG1) 2.659 0.884 0.884 weight 1.000 ! spec=sumo...oesy, no=254, id=1201, vol=3.299830e+00
assign (segid  A  and resid   28 and name   HA) (segid  A  and resid   27 and name HG21) 3.181 1.265 1.265 weight 1.000 ! spec=sumo...oesy, no=255, id=1202, vol=1.126210e+00
    or (segid  A  and resid   28 and name   HA) (segid  A  and resid   27 and name HG22)
    or (segid  A  and resid   28 and name   HA) (segid  A  and resid   27 and name HG23)
assign (segid  A  and resid   29 and name   HN) (segid  A  and resid   28 and name  HB1) 2.882 1.038 1.038 weight 1.000 ! spec=sumo...oesy, no=256, id=215, vol=5.011690e+00
assign (segid  A  and resid   29 and name   HN) (segid  A  and resid   28 and name  HG1) 3.651 1.666 1.666 weight 1.000 ! spec=sumo...oesy, no=257, id=216, vol=1.213260e+00
assign (segid  A  and resid   28 and name   HA) (segid  A  and resid   29 and name   HG) 3.307 1.367 1.367 weight 1.000 ! spec=sumo...oesy, no=258, id=1204, vol=8.908900e-01
assign (segid  A  and resid   29 and name   HN) (segid  A  and resid   29 and name   HG) 2.646 0.875 0.875 weight 1.000 ! spec=sumo...oesy, no=259, id=218, vol=8.364220e+00
assign (segid  A  and resid   36 and name  HD1) (segid  A  and resid   36 and name   HA) 2.066 0.534 0.534 weight 1.000 ! spec=sumo...oesy, no=261, id=1207, vol=1.497505e+01
    or (segid  A  and resid   36 and name  HD2) (segid  A  and resid   36 and name   HA)
assign (segid  A  and resid   36 and name   HA) (segid  A  and resid   36 and name  HE1) 3.033 1.150 1.150 weight 1.000 ! spec=sumo...oesy, no=262, id=1208, vol=1.498470e+00
    or (segid  A  and resid   36 and name   HA) (segid  A  and resid   36 and name  HE2)
assign (segid  A  and resid   36 and name   HA) (segid  A  and resid   36 and name  HB1) 2.463 0.759 0.759 weight 1.000 ! spec=sumo...oesy, no=263, id=1209, vol=5.219040e+00
assign (segid  A  and resid   36 and name   HA) (segid  A  and resid   36 and name  HB2) 2.387 0.712 0.712 weight 1.000 ! spec=sumo...oesy, no=264, id=1210, vol=6.309640e+00
assign (segid  A  and resid   36 and name   HA) (segid  A  and resid   39 and name  HB1) 2.631 0.866 0.866 weight 1.000 ! spec=sumo...oesy, no=265, id=1211, vol=3.512040e+00
assign (segid  A  and resid   36 and name   HA) (segid  A  and resid   39 and name  HB2) 2.733 0.933 0.933 weight 1.000 ! spec=sumo...oesy, no=266, id=1212, vol=2.800940e+00
assign (segid  A  and resid   36 and name   HA) (segid  A  and resid   39 and name  HG1) 2.866 1.027 1.027 weight 1.000 ! spec=sumo...oesy, no=267, id=1213, vol=2.102790e+00
assign (segid  A  and resid   36 and name   HA) (segid  A  and resid   35 and name  HB2) 2.972 1.104 1.104 weight 1.000 ! spec=sumo...oesy, no=268, id=1214, vol=1.692060e+00
    or (segid  A  and resid   36 and name   HA) (segid  A  and resid   35 and name  HB1)
    or (segid  A  and resid   36 and name   HA) (segid  A  and resid   35 and name  HB3)
assign (segid  A  and resid   23 and name   HN) (segid  A  and resid    8 and name   HA) 3.241 1.313 1.313 weight 1.000 ! spec=sumo...oesy, no=269, id=224, vol=2.478240e+00
assign (segid  A  and resid   23 and name   HN) (segid  A  and resid   23 and name   HB) 3.160 1.248 1.248 weight 1.000 ! spec=sumo...oesy, no=271, id=226, vol=2.882800e+00
assign (segid  A  and resid   23 and name   HN) (segid  A  and resid   22 and name   HN) 3.532 1.559 1.559 weight 1.000 ! spec=sumo...oesy, no=272, id=227, vol=1.479000e+00
assign (segid  A  and resid   72 and name   HA) (segid  A  and resid   72 and name   HB) 2.317 0.671 0.671 weight 1.000 ! spec=sumo...oesy, no=273, id=1217, vol=7.531620e+00
assign (segid  A  and resid   72 and name   HA) (segid  A  and resid   10 and name  HE1) 3.191 1.273 1.273 weight 1.000 ! spec=sumo...oesy, no=274, id=1218, vol=1.105370e+00
assign (segid  A  and resid   72 and name   HA) (segid  A  and resid   10 and name  HB1) 2.217 0.614 0.614 weight 1.000 ! spec=sumo...oesy, no=275, id=1219, vol=9.829900e+00
assign (segid  A  and resid   18 and name   HN) (segid  A  and resid   12 and name   HA) 3.587 1.608 1.608 weight 1.000 ! spec=sumo...oesy, no=277, id=231, vol=1.348200e+00
assign (segid  A  and resid   18 and name   HN) (segid  A  and resid   18 and name   HA) 2.653 0.880 0.880 weight 1.000 ! spec=sumo...oesy, no=278, id=232, vol=8.231820e+00
assign (segid  A  and resid   18 and name   HN) (segid  A  and resid   17 and name   HA) 1.949 0.475 0.475 weight 1.000 ! spec=sumo...oesy, no=279, id=233, vol=5.233404e+01
assign (segid  A  and resid   18 and name   HN) (segid  A  and resid   19 and name HG22) 3.498 1.529 1.529 weight 1.000 ! spec=sumo...oesy, no=282, id=236, vol=1.568390e+00
    or (segid  A  and resid   18 and name   HN) (segid  A  and resid   19 and name HG21)
    or (segid  A  and resid   18 and name   HN) (segid  A  and resid   19 and name HG23)
assign (segid  A  and resid   18 and name   HA) (segid  A  and resid   11 and name HG22) 3.312 1.371 1.371 weight 1.000 ! spec=sumo...oesy, no=283, id=1227, vol=8.831600e-01
    or (segid  A  and resid   18 and name   HA) (segid  A  and resid   11 and name HG21)
    or (segid  A  and resid   18 and name   HA) (segid  A  and resid   11 and name HG23)
assign (segid  A  and resid   18 and name   HN) (segid  A  and resid   18 and name HG22) 2.895 1.048 1.048 weight 1.000 ! spec=sumo...oesy, no=284, id=238, vol=4.876340e+00
    or (segid  A  and resid   18 and name   HN) (segid  A  and resid   18 and name HG21)
    or (segid  A  and resid   18 and name   HN) (segid  A  and resid   18 and name HG23)
assign (segid  A  and resid   18 and name   HN) (segid  A  and resid   12 and name  HB2) 3.794 1.799 1.799 weight 1.000 ! spec=sumo...oesy, no=285, id=239, vol=9.631400e-01
    or (segid  A  and resid   18 and name   HN) (segid  A  and resid   12 and name  HB1)
    or (segid  A  and resid   18 and name   HN) (segid  A  and resid   12 and name  HB3)
assign (segid  A  and resid   30 and name   HA) (segid  A  and resid   33 and name  HG1) 3.329 1.385 1.385 weight 1.000 ! spec=sumo...oesy, no=288, id=1229, vol=8.571000e-01
assign (segid  A  and resid   18 and name   HA) (segid  A  and resid   18 and name   HB) 2.264 0.641 0.641 weight 1.000 ! spec=sumo...oesy, no=289, id=1230, vol=8.657350e+00
assign (segid  A  and resid   18 and name   HA) (segid  A  and resid   18 and name HG22) 2.029 0.514 0.514 weight 1.000 ! spec=sumo...oesy, no=293, id=1234, vol=1.673537e+01
    or (segid  A  and resid   18 and name   HA) (segid  A  and resid   18 and name HG21)
    or (segid  A  and resid   18 and name   HA) (segid  A  and resid   18 and name HG23)
assign (segid  A  and resid   80 and name   HA) (segid  A  and resid   80 and name HG21) 1.948 0.474 0.474 weight 1.000 ! spec=sumo...oesy, no=298, id=1236, vol=2.135474e+01
    or (segid  A  and resid   80 and name   HA) (segid  A  and resid   80 and name HG22)
    or (segid  A  and resid   80 and name   HA) (segid  A  and resid   80 and name HG23)
assign (segid  A  and resid   11 and name   HA) (segid  A  and resid   11 and name   HB) 2.564 0.822 0.822 weight 1.000 ! spec=sumo...oesy, no=300, id=1238, vol=4.103570e+00
assign (segid  A  and resid   11 and name   HA) (segid  A  and resid   73 and name   HB) 2.452 0.752 0.752 weight 1.000 ! spec=sumo...oesy, no=301, id=1239, vol=5.366550e+00
assign (segid  A  and resid   11 and name   HA) (segid  A  and resid   73 and name HD12) 3.129 1.224 1.224 weight 1.000 ! spec=sumo...oesy, no=304, id=1241, vol=1.241450e+00
    or (segid  A  and resid   11 and name   HA) (segid  A  and resid   73 and name HD11)
    or (segid  A  and resid   11 and name   HA) (segid  A  and resid   73 and name HD13)
assign (segid  A  and resid   23 and name   HN) (segid  A  and resid   22 and name   HA) 2.257 0.637 0.637 weight 1.000 ! spec=sumo...oesy, no=306, id=244, vol=2.169874e+01
assign (segid  A  and resid   11 and name   HA) (segid  A  and resid   12 and name  HB2) 2.855 1.019 1.019 weight 1.000 ! spec=sumo...oesy, no=307, id=1243, vol=2.155310e+00
    or (segid  A  and resid   11 and name   HA) (segid  A  and resid   12 and name  HB1)
    or (segid  A  and resid   11 and name   HA) (segid  A  and resid   12 and name  HB3)
assign (segid  A  and resid   11 and name   HA) (segid  A  and resid   75 and name HG22) 3.095 1.197 1.197 weight 1.000 ! spec=sumo...oesy, no=309, id=1245, vol=1.327680e+00
    or (segid  A  and resid   11 and name   HA) (segid  A  and resid   75 and name HG21)
    or (segid  A  and resid   11 and name   HA) (segid  A  and resid   75 and name HG23)
assign (segid  A  and resid   23 and name   HN) (segid  A  and resid   22 and name  HG2) 3.272 1.338 1.338 weight 1.000 ! spec=sumo...oesy, no=312, id=250, vol=2.339420e+00
assign (segid  A  and resid   23 and name   HN) (segid  A  and resid   23 and name HG22) 2.552 0.814 0.814 weight 1.000 ! spec=sumo...oesy, no=313, id=251, vol=1.040396e+01
    or (segid  A  and resid   23 and name   HN) (segid  A  and resid   23 and name HG21)
    or (segid  A  and resid   23 and name   HN) (segid  A  and resid   23 and name HG23)
assign (segid  A  and resid   76 and name   HN) (segid  A  and resid   50 and name   HN) 3.478 1.512 1.512 weight 1.000 ! spec=sumo...oesy, no=318, id=253, vol=1.621190e+00
assign (segid  A  and resid   59 and name   HA) (segid  A  and resid   28 and name  HB1) 2.239 0.627 0.627 weight 1.000 ! spec=sumo...oesy, no=319, id=1250, vol=9.257330e+00
assign (segid  A  and resid   50 and name   HN) (segid  A  and resid   49 and name   HA) 2.213 0.612 0.612 weight 1.000 ! spec=sumo...oesy, no=320, id=255, vol=2.442635e+01
assign (segid  A  and resid   59 and name   HA) (segid  A  and resid   28 and name  HG1) 2.879 1.036 1.036 weight 1.000 ! spec=sumo...oesy, no=321, id=1252, vol=2.046160e+00
assign (segid  A  and resid   59 and name   HA) (segid  A  and resid   59 and name HG21) 1.910 0.456 0.456 weight 1.000 ! spec=sumo...oesy, no=322, id=1253, vol=2.401769e+01
    or (segid  A  and resid   59 and name   HA) (segid  A  and resid   59 and name HG22)
    or (segid  A  and resid   59 and name   HA) (segid  A  and resid   59 and name HG23)
assign (segid  A  and resid   50 and name   HN) (segid  A  and resid   74 and name  HB2) 3.016 1.137 1.137 weight 1.000 ! spec=sumo...oesy, no=323, id=258, vol=3.817210e+00
assign (segid  A  and resid   51 and name  HD1) (segid  A  and resid   73 and name   HA) 2.644 0.874 0.874 weight 1.000 ! spec=sumo...oesy, no=324, id=1254, vol=3.416950e+00
    or (segid  A  and resid   51 and name  HD2) (segid  A  and resid   73 and name   HA)
assign (segid  A  and resid   73 and name   HA) (segid  A  and resid   73 and name HG11) 2.539 0.806 0.806 weight 1.000 ! spec=sumo...oesy, no=325, id=1255, vol=4.350000e+00
assign (segid  A  and resid   73 and name   HA) (segid  A  and resid   72 and name HG21) 3.051 1.163 1.163 weight 1.000 ! spec=sumo...oesy, no=326, id=1256, vol=1.446270e+00
    or (segid  A  and resid   73 and name   HA) (segid  A  and resid   72 and name HG22)
    or (segid  A  and resid   73 and name   HA) (segid  A  and resid   72 and name HG23)
assign (segid  A  and resid   73 and name   HA) (segid  A  and resid   73 and name HG22) 2.318 0.672 0.672 weight 1.000 ! spec=sumo...oesy, no=327, id=1257, vol=7.509230e+00
    or (segid  A  and resid   73 and name   HA) (segid  A  and resid   73 and name HG21)
    or (segid  A  and resid   73 and name   HA) (segid  A  and resid   73 and name HG23)
assign (segid  A  and resid   50 and name   HN) (segid  A  and resid   73 and name HG22) 2.677 0.896 0.896 weight 1.000 ! spec=sumo...oesy, no=328, id=263, vol=7.799850e+00
    or (segid  A  and resid   50 and name   HN) (segid  A  and resid   73 and name HG21)
    or (segid  A  and resid   50 and name   HN) (segid  A  and resid   73 and name HG23)
assign (segid  A  and resid   50 and name   HN) (segid  A  and resid   56 and name HD12) 3.149 1.240 1.240 weight 1.000 ! spec=sumo...oesy, no=329, id=264, vol=2.943000e+00
    or (segid  A  and resid   50 and name   HN) (segid  A  and resid   56 and name HD11)
    or (segid  A  and resid   50 and name   HN) (segid  A  and resid   56 and name HD13)
assign (segid  A  and resid   50 and name   HN) (segid  A  and resid   75 and name HG12) 3.794 1.799 1.799 weight 1.000 ! spec=sumo...oesy, no=330, id=265, vol=9.628500e-01
    or (segid  A  and resid   50 and name   HN) (segid  A  and resid   75 and name HG11)
    or (segid  A  and resid   50 and name   HN) (segid  A  and resid   75 and name HG13)
assign (segid  A  and resid   27 and name   HA) (segid  A  and resid   27 and name HG21) 2.162 0.584 0.584 weight 1.000 ! spec=sumo...oesy, no=331, id=1261, vol=1.140994e+01
    or (segid  A  and resid   27 and name   HA) (segid  A  and resid   27 and name HG22)
    or (segid  A  and resid   27 and name   HA) (segid  A  and resid   27 and name HG23)
assign (segid  A  and resid   50 and name   HN) (segid  A  and resid   56 and name   HN) 3.799 1.804 1.804 weight 1.000 ! spec=sumo...oesy, no=332, id=267, vol=9.557700e-01
assign (segid  A  and resid   19 and name   HA) (segid  A  and resid   19 and name   HB) 2.260 0.639 0.639 weight 1.000 ! spec=sumo...oesy, no=334, id=1264, vol=8.746310e+00
assign (segid  A  and resid   19 and name   HA) (segid  A  and resid   19 and name HG22) 1.950 0.475 0.475 weight 1.000 ! spec=sumo...oesy, no=335, id=1265, vol=2.123065e+01
    or (segid  A  and resid   19 and name   HA) (segid  A  and resid   19 and name HG21)
    or (segid  A  and resid   19 and name   HA) (segid  A  and resid   19 and name HG23)
assign (segid  A  and resid   19 and name   HN) (segid  A  and resid   11 and name   HN) 2.578 0.831 0.831 weight 1.000 ! spec=sumo...oesy, no=337, id=268, vol=9.783190e+00
assign (segid  A  and resid   11 and name   HN) (segid  A  and resid   21 and name  HD1) 3.348 1.401 1.401 weight 1.000 ! spec=sumo...oesy, no=338, id=269, vol=2.040360e+00
    or (segid  A  and resid   11 and name   HN) (segid  A  and resid   21 and name  HD2)
assign (segid  A  and resid   11 and name   HN) (segid  A  and resid   36 and name  HE1) 3.738 1.747 1.747 weight 1.000 ! spec=sumo...oesy, no=340, id=271, vol=1.052490e+00
    or (segid  A  and resid   11 and name   HN) (segid  A  and resid   36 and name  HE2)
assign (segid  A  and resid   75 and name   HA) (segid  A  and resid   75 and name HG12) 3.160 1.248 1.248 weight 1.000 ! spec=sumo...oesy, no=341, id=1268, vol=1.171820e+00
    or (segid  A  and resid   75 and name   HA) (segid  A  and resid   75 and name HG11)
    or (segid  A  and resid   75 and name   HA) (segid  A  and resid   75 and name HG13)
assign (segid  A  and resid   11 and name   HN) (segid  A  and resid   10 and name   HA) 2.129 0.567 0.567 weight 1.000 ! spec=sumo...oesy, no=342, id=273, vol=3.080821e+01
assign (segid  A  and resid   11 and name   HN) (segid  A  and resid   19 and name   HA) 3.792 1.798 1.798 weight 1.000 ! spec=sumo...oesy, no=343, id=274, vol=9.651900e-01
assign (segid  A  and resid    7 and name   HA) (segid  A  and resid    6 and name  HB2) 3.347 1.400 1.400 weight 1.000 ! spec=sumo...oesy, no=344, id=1270, vol=8.300500e-01
assign (segid  A  and resid   73 and name   HA) (segid  A  and resid   51 and name  HB1) 3.280 1.345 1.345 weight 1.000 ! spec=sumo...oesy, no=345, id=1271, vol=9.360700e-01
assign (segid  A  and resid   73 and name   HA) (segid  A  and resid   73 and name   HB) 2.522 0.795 0.795 weight 1.000 ! spec=sumo...oesy, no=346, id=1272, vol=4.533970e+00
assign (segid  A  and resid   11 and name   HN) (segid  A  and resid   11 and name HG12) 2.501 0.782 0.782 weight 1.000 ! spec=sumo...oesy, no=349, id=280, vol=1.174787e+01
    or (segid  A  and resid   11 and name   HN) (segid  A  and resid   11 and name HG11)
    or (segid  A  and resid   11 and name   HN) (segid  A  and resid   11 and name HG13)
assign (segid  A  and resid   56 and name   HA) (segid  A  and resid   57 and name  HB2) 3.355 1.407 1.407 weight 1.000 ! spec=sumo...oesy, no=350, id=1274, vol=8.184500e-01
assign (segid  A  and resid   56 and name   HA) (segid  A  and resid   55 and name  HB2) 3.399 1.444 1.444 weight 1.000 ! spec=sumo...oesy, no=351, id=1275, vol=7.566100e-01
assign (segid  A  and resid   56 and name   HA) (segid  A  and resid   56 and name HD12) 2.745 0.942 0.942 weight 1.000 ! spec=sumo...oesy, no=352, id=1276, vol=2.725740e+00
    or (segid  A  and resid   56 and name   HA) (segid  A  and resid   56 and name HD11)
    or (segid  A  and resid   56 and name   HA) (segid  A  and resid   56 and name HD13)
assign (segid  A  and resid   35 and name   HN) (segid  A  and resid   34 and name   HN) 2.407 0.724 0.724 weight 1.000 ! spec=sumo...oesy, no=353, id=284, vol=1.476458e+01
assign (segid  A  and resid   56 and name   HA) (segid  A  and resid   60 and name  HB2) 3.390 1.437 1.437 weight 1.000 ! spec=sumo...oesy, no=354, id=1278, vol=7.678300e-01
assign (segid  A  and resid   56 and name   HA) (segid  A  and resid   56 and name   HB) 2.293 0.657 0.657 weight 1.000 ! spec=sumo...oesy, no=355, id=1279, vol=8.014970e+00
assign (segid  A  and resid   56 and name   HA) (segid  A  and resid   56 and name HG11) 2.599 0.844 0.844 weight 1.000 ! spec=sumo...oesy, no=356, id=1280, vol=3.784950e+00
assign (segid  A  and resid   35 and name   HN) (segid  A  and resid   32 and name   HA) 2.905 1.055 1.055 weight 1.000 ! spec=sumo...oesy, no=357, id=287, vol=4.773710e+00
assign (segid  A  and resid   35 and name   HN) (segid  A  and resid   36 and name  HB2) 3.338 1.393 1.393 weight 1.000 ! spec=sumo...oesy, no=359, id=289, vol=2.074640e+00
assign (segid  A  and resid   23 and name   HA) (segid  A  and resid   23 and name   HB) 2.090 0.546 0.546 weight 1.000 ! spec=sumo...oesy, no=362, id=1282, vol=1.399795e+01
assign (segid  A  and resid   23 and name   HA) (segid  A  and resid   23 and name HG12) 2.343 0.686 0.686 weight 1.000 ! spec=sumo...oesy, no=364, id=1284, vol=7.043970e+00
assign (segid  A  and resid   32 and name   HN) (segid  A  and resid   33 and name   HN) 2.357 0.694 0.694 weight 1.000 ! spec=sumo...oesy, no=366, id=296, vol=1.675888e+01
assign (segid  A  and resid   23 and name   HA) (segid  A  and resid    6 and name  HD2) 2.650 0.878 0.878 weight 1.000 ! spec=sumo...oesy, no=368, id=1288, vol=3.368150e+00
assign (segid  A  and resid   32 and name   HN) (segid  A  and resid   29 and name   HA) 2.902 1.053 1.053 weight 1.000 ! spec=sumo...oesy, no=371, id=300, vol=4.808090e+00
assign (segid  A  and resid   32 and name   HN) (segid  A  and resid   32 and name   HA) 2.661 0.885 0.885 weight 1.000 ! spec=sumo...oesy, no=372, id=301, vol=8.097730e+00
assign (segid  A  and resid   34 and name   HA) (segid  A  and resid   37 and name  HB2) 2.547 0.811 0.811 weight 1.000 ! spec=sumo...oesy, no=374, id=1292, vol=4.273800e+00
assign (segid  A  and resid   32 and name   HN) (segid  A  and resid   32 and name  HB2) 2.569 0.825 0.825 weight 1.000 ! spec=sumo...oesy, no=375, id=304, vol=9.992930e+00
assign (segid  A  and resid   32 and name   HN) (segid  A  and resid   23 and name HD12) 2.816 0.991 0.991 weight 1.000 ! spec=sumo...oesy, no=376, id=305, vol=5.756400e+00
    or (segid  A  and resid   32 and name   HN) (segid  A  and resid   23 and name HD11)
    or (segid  A  and resid   32 and name   HN) (segid  A  and resid   23 and name HD13)
assign (segid  A  and resid   31 and name   HA) (segid  A  and resid   31 and name  HB2) 2.033 0.516 0.516 weight 1.000 ! spec=sumo...oesy, no=379, id=1296, vol=1.654097e+01
assign (segid  A  and resid   31 and name   HA) (segid  A  and resid   31 and name  HG1) 2.278 0.649 0.649 weight 1.000 ! spec=sumo...oesy, no=380, id=1297, vol=8.340670e+00
assign (segid  A  and resid   47 and name   HA) (segid  A  and resid   77 and name  HB2) 3.021 1.141 1.141 weight 1.000 ! spec=sumo...oesy, no=381, id=1298, vol=1.534720e+00
assign (segid  A  and resid   47 and name   HA) (segid  A  and resid   47 and name   HB) 2.118 0.561 0.561 weight 1.000 ! spec=sumo...oesy, no=382, id=1299, vol=1.291503e+01
assign (segid  A  and resid   47 and name   HA) (segid  A  and resid   47 and name HG22) 2.533 0.802 0.802 weight 1.000 ! spec=sumo...oesy, no=383, id=1300, vol=4.410450e+00
    or (segid  A  and resid   47 and name   HA) (segid  A  and resid   47 and name HG21)
    or (segid  A  and resid   47 and name   HA) (segid  A  and resid   47 and name HG23)
assign (segid  A  and resid   77 and name   HN) (segid  A  and resid   76 and name  HD1) 3.115 1.213 1.213 weight 1.000 ! spec=sumo...oesy, no=384, id=312, vol=3.146310e+00
    or (segid  A  and resid   77 and name   HN) (segid  A  and resid   76 and name  HD2)
assign (segid  A  and resid   47 and name   HA) (segid  A  and resid   75 and name HG12) 3.048 1.161 1.161 weight 1.000 ! spec=sumo...oesy, no=385, id=1302, vol=1.454150e+00
    or (segid  A  and resid   47 and name   HA) (segid  A  and resid   75 and name HG11)
    or (segid  A  and resid   47 and name   HA) (segid  A  and resid   75 and name HG13)
assign (segid  A  and resid   77 and name   HN) (segid  A  and resid   76 and name  HB2) 2.701 0.912 0.912 weight 1.000 ! spec=sumo...oesy, no=386, id=314, vol=7.399130e+00
assign (segid  A  and resid   47 and name   HA) (segid  A  and resid   77 and name  HB1) 3.023 1.143 1.143 weight 1.000 ! spec=sumo...oesy, no=387, id=1304, vol=1.527160e+00
assign (segid  A  and resid   77 and name   HN) (segid  A  and resid   77 and name  HB1) 2.514 0.790 0.790 weight 1.000 ! spec=sumo...oesy, no=389, id=317, vol=1.137093e+01
assign (segid  A  and resid   77 and name   HN) (segid  A  and resid   75 and name HG12) 3.562 1.586 1.586 weight 1.000 ! spec=sumo...oesy, no=392, id=320, vol=1.406690e+00
    or (segid  A  and resid   77 and name   HN) (segid  A  and resid   75 and name HG11)
    or (segid  A  and resid   77 and name   HN) (segid  A  and resid   75 and name HG13)
assign (segid  A  and resid   35 and name   HN) (segid  A  and resid   32 and name HD22) 3.842 1.845 1.845 weight 1.000 ! spec=sumo...oesy, no=394, id=321, vol=8.925300e-01
    or (segid  A  and resid   35 and name   HN) (segid  A  and resid   32 and name HD21)
    or (segid  A  and resid   35 and name   HN) (segid  A  and resid   32 and name HD23)
assign (segid  A  and resid   38 and name   HA) (segid  A  and resid   38 and name  HG1) 2.371 0.703 0.703 weight 1.000 ! spec=sumo...oesy, no=395, id=1309, vol=6.569490e+00
assign (segid  A  and resid   38 and name   HA) (segid  A  and resid   38 and name  HG2) 2.281 0.650 0.650 weight 1.000 ! spec=sumo...oesy, no=396, id=1310, vol=8.284200e+00
assign (segid  A  and resid   21 and name   HN) (segid  A  and resid   21 and name  HD1) 2.720 0.925 0.925 weight 1.000 ! spec=sumo...oesy, no=399, id=325, vol=7.090040e+00
    or (segid  A  and resid   21 and name   HN) (segid  A  and resid   21 and name  HD2)
assign (segid  A  and resid   21 and name   HN) (segid  A  and resid    8 and name   HA) 3.333 1.389 1.389 weight 1.000 ! spec=sumo...oesy, no=400, id=326, vol=2.093440e+00
assign (segid  A  and resid   21 and name   HN) (segid  A  and resid   20 and name   HA) 2.064 0.532 0.532 weight 1.000 ! spec=sumo...oesy, no=401, id=327, vol=3.717416e+01
assign (segid  A  and resid   21 and name   HN) (segid  A  and resid   10 and name   HA) 2.833 1.003 1.003 weight 1.000 ! spec=sumo...oesy, no=402, id=328, vol=5.552610e+00
assign (segid  A  and resid   21 and name   HN) (segid  A  and resid   21 and name  HB2) 2.558 0.818 0.818 weight 1.000 ! spec=sumo...oesy, no=404, id=330, vol=1.024001e+01
assign (segid  A  and resid   21 and name   HN) (segid  A  and resid   20 and name  HG2) 3.177 1.261 1.261 weight 1.000 ! spec=sumo...oesy, no=405, id=331, vol=2.795540e+00
assign (segid  A  and resid   17 and name   HA) (segid  A  and resid   18 and name HG12) 2.586 0.836 0.836 weight 1.000 ! spec=sumo...oesy, no=406, id=1315, vol=3.899100e+00
    or (segid  A  and resid   17 and name   HA) (segid  A  and resid   18 and name HG11)
    or (segid  A  and resid   17 and name   HA) (segid  A  and resid   18 and name HG13)
assign (segid  A  and resid   21 and name   HN) (segid  A  and resid   20 and name  HB1) 2.894 1.047 1.047 weight 1.000 ! spec=sumo...oesy, no=407, id=333, vol=4.886180e+00
assign (segid  A  and resid   21 and name   HN) (segid  A  and resid    9 and name  HB1) 3.311 1.370 1.370 weight 1.000 ! spec=sumo...oesy, no=409, id=335, vol=2.179660e+00
assign (segid  A  and resid   64 and name   HA) (segid  A  and resid   63 and name  HB2) 2.784 0.969 0.969 weight 1.000 ! spec=sumo...oesy, no=412, id=1317, vol=2.503440e+00
    or (segid  A  and resid   64 and name   HA) (segid  A  and resid   63 and name  HB1)
    or (segid  A  and resid   64 and name   HA) (segid  A  and resid   63 and name  HB3)
assign (segid  A  and resid   44 and name   HA) (segid  A  and resid   49 and name  HE1) 3.318 1.376 1.376 weight 1.000 ! spec=sumo...oesy, no=414, id=1319, vol=8.734900e-01
    or (segid  A  and resid   44 and name   HA) (segid  A  and resid   49 and name  HE2)
assign (segid  A  and resid   44 and name   HA) (segid  A  and resid   44 and name  HG2) 1.955 0.478 0.478 weight 1.000 ! spec=sumo...oesy, no=415, id=1320, vol=2.090541e+01
assign (segid  A  and resid   44 and name   HA) (segid  A  and resid   47 and name HG22) 2.337 0.683 0.683 weight 1.000 ! spec=sumo...oesy, no=416, id=1321, vol=7.157490e+00
    or (segid  A  and resid   44 and name   HA) (segid  A  and resid   47 and name HG21)
    or (segid  A  and resid   44 and name   HA) (segid  A  and resid   47 and name HG23)
assign (segid  A  and resid   48 and name   HN) (segid  A  and resid   49 and name  HD1) 3.447 1.485 1.485 weight 1.000 ! spec=sumo...oesy, no=417, id=342, vol=1.712670e+00
    or (segid  A  and resid   48 and name   HN) (segid  A  and resid   49 and name  HD2)
assign (segid  A  and resid   48 and name   HN) (segid  A  and resid   47 and name   HA) 2.127 0.566 0.566 weight 1.000 ! spec=sumo...oesy, no=418, id=343, vol=3.100792e+01
assign (segid  A  and resid   14 and name   HA) (segid  A  and resid   14 and name  HB1) 2.000 0.500 0.500 weight 1.000 ! spec=sumo...oesy, no=419, id=1324, vol=1.819633e+01
assign (segid  A  and resid   48 and name   HN) (segid  A  and resid   48 and name  HD1) 3.718 1.728 1.728 weight 1.000 ! spec=sumo...oesy, no=420, id=345, vol=1.086730e+00
assign (segid  A  and resid   48 and name   HN) (segid  A  and resid   48 and name  HD2) 3.839 1.843 1.843 weight 1.000 ! spec=sumo...oesy, no=421, id=346, vol=8.964400e-01
assign (segid  A  and resid   61 and name   HA) (segid  A  and resid   62 and name  HD1) 2.233 0.624 0.624 weight 1.000 ! spec=sumo...oesy, no=422, id=1326, vol=9.394890e+00
assign (segid  A  and resid   48 and name   HN) (segid  A  and resid   76 and name  HB2) 3.337 1.392 1.392 weight 1.000 ! spec=sumo...oesy, no=423, id=348, vol=2.078850e+00
assign (segid  A  and resid   61 and name   HA) (segid  A  and resid   29 and name   HG) 2.601 0.846 0.846 weight 1.000 ! spec=sumo...oesy, no=425, id=1329, vol=3.765650e+00
assign (segid  A  and resid   48 and name   HN) (segid  A  and resid   48 and name  HG2) 2.752 0.947 0.947 weight 1.000 ! spec=sumo...oesy, no=426, id=351, vol=6.607060e+00
assign (segid  A  and resid   48 and name   HN) (segid  A  and resid   48 and name  HB2) 2.684 0.900 0.900 weight 1.000 ! spec=sumo...oesy, no=427, id=352, vol=7.689810e+00
assign (segid  A  and resid   61 and name   HA) (segid  A  and resid   64 and name  HB1) 3.258 1.327 1.327 weight 1.000 ! spec=sumo...oesy, no=428, id=1332, vol=9.755100e-01
assign (segid  A  and resid   48 and name   HN) (segid  A  and resid   47 and name HG12) 2.532 0.801 0.801 weight 1.000 ! spec=sumo...oesy, no=429, id=354, vol=1.090097e+01
assign (segid  A  and resid   48 and name   HN) (segid  A  and resid   75 and name HG12) 3.110 1.209 1.209 weight 1.000 ! spec=sumo...oesy, no=430, id=355, vol=3.174010e+00
    or (segid  A  and resid   48 and name   HN) (segid  A  and resid   75 and name HG11)
    or (segid  A  and resid   48 and name   HN) (segid  A  and resid   75 and name HG13)
assign (segid  A  and resid   48 and name   HN) (segid  A  and resid   75 and name HG22) 3.340 1.394 1.394 weight 1.000 ! spec=sumo...oesy, no=431, id=356, vol=2.070030e+00
    or (segid  A  and resid   48 and name   HN) (segid  A  and resid   75 and name HG21)
    or (segid  A  and resid   48 and name   HN) (segid  A  and resid   75 and name HG23)
assign (segid  A  and resid   27 and name   HN) (segid  A  and resid   25 and name   HN) 3.268 1.335 1.335 weight 1.000 ! spec=sumo...oesy, no=433, id=357, vol=2.356500e+00
assign (segid  A  and resid   27 and name   HN) (segid  A  and resid   26 and name   HN) 2.384 0.710 0.710 weight 1.000 ! spec=sumo...oesy, no=434, id=358, vol=1.566216e+01
assign (segid  A  and resid   69 and name   HA) (segid  A  and resid   70 and name   HA) 3.141 1.233 1.233 weight 1.000 ! spec=sumo...oesy, no=436, id=1337, vol=1.214910e+00
assign (segid  A  and resid   27 and name   HN) (segid  A  and resid   26 and name   HA) 2.871 1.030 1.030 weight 1.000 ! spec=sumo...oesy, no=437, id=360, vol=5.127240e+00
assign (segid  A  and resid   27 and name   HN) (segid  A  and resid   27 and name   HA) 2.655 0.881 0.881 weight 1.000 ! spec=sumo...oesy, no=438, id=361, vol=8.197450e+00
assign (segid  A  and resid   27 and name   HN) (segid  A  and resid   61 and name   HB) 3.319 1.377 1.377 weight 1.000 ! spec=sumo...oesy, no=439, id=362, vol=2.149990e+00
assign (segid  A  and resid   27 and name   HN) (segid  A  and resid   27 and name   HB) 2.229 0.621 0.621 weight 1.000 ! spec=sumo...oesy, no=440, id=363, vol=2.342861e+01
assign (segid  A  and resid   45 and name   HA) (segid  A  and resid   45 and name  HB2) 2.112 0.557 0.557 weight 1.000 ! spec=sumo...oesy, no=441, id=1342, vol=1.315000e+01
assign (segid  A  and resid   45 and name   HA) (segid  A  and resid   45 and name  HG2) 2.103 0.553 0.553 weight 1.000 ! spec=sumo...oesy, no=442, id=1343, vol=1.346333e+01
    or (segid  A  and resid   45 and name   HA) (segid  A  and resid   45 and name  HG1)
assign (segid  A  and resid   27 and name   HN) (segid  A  and resid   25 and name   HA) 3.439 1.479 1.479 weight 1.000 ! spec=sumo...oesy, no=443, id=366, vol=1.734940e+00
assign (segid  A  and resid   27 and name   HN) (segid  A  and resid   26 and name  HB1) 3.359 1.410 1.410 weight 1.000 ! spec=sumo...oesy, no=444, id=367, vol=1.999210e+00
assign (segid  A  and resid   27 and name   HN) (segid  A  and resid   26 and name  HB2) 3.224 1.299 1.299 weight 1.000 ! spec=sumo...oesy, no=445, id=368, vol=2.557270e+00
assign (segid  A  and resid    6 and name   HA) (segid  A  and resid   24 and name  HG2) 2.700 0.911 0.911 weight 1.000 ! spec=sumo...oesy, no=447, id=1346, vol=3.012540e+00
assign (segid  A  and resid   27 and name   HN) (segid  A  and resid   61 and name HG21) 3.061 1.171 1.171 weight 1.000 ! spec=sumo...oesy, no=451, id=374, vol=3.492640e+00
    or (segid  A  and resid   27 and name   HN) (segid  A  and resid   61 and name HG22)
    or (segid  A  and resid   27 and name   HN) (segid  A  and resid   61 and name HG23)
assign (segid  A  and resid   27 and name   HN) (segid  A  and resid   23 and name HD12) 3.289 1.352 1.352 weight 1.000 ! spec=sumo...oesy, no=453, id=376, vol=2.269800e+00
    or (segid  A  and resid   27 and name   HN) (segid  A  and resid   23 and name HD11)
    or (segid  A  and resid   27 and name   HN) (segid  A  and resid   23 and name HD13)
assign (segid  A  and resid   69 and name   HA) (segid  A  and resid    7 and name   HB) 2.326 0.676 0.676 weight 1.000 ! spec=sumo...oesy, no=457, id=1350, vol=7.372110e+00
assign (segid  A  and resid   69 and name   HA) (segid  A  and resid    7 and name HG11) 2.622 0.859 0.859 weight 1.000 ! spec=sumo...oesy, no=458, id=1351, vol=3.591950e+00
assign (segid  A  and resid   54 and name   HN) (segid  A  and resid   55 and name  HD1) 3.318 1.376 1.376 weight 1.000 ! spec=sumo...oesy, no=459, id=377, vol=2.151040e+00
assign (segid  A  and resid   69 and name   HA) (segid  A  and resid    7 and name HD12) 2.611 0.852 0.852 weight 1.000 ! spec=sumo...oesy, no=460, id=1353, vol=3.680690e+00
    or (segid  A  and resid   69 and name   HA) (segid  A  and resid    7 and name HD11)
    or (segid  A  and resid   69 and name   HA) (segid  A  and resid    7 and name HD13)
assign (segid  A  and resid   14 and name   HN) (segid  A  and resid   13 and name   HN) 3.240 1.312 1.312 weight 1.000 ! spec=sumo...oesy, no=461, id=378, vol=2.481340e+00
assign (segid  A  and resid   24 and name   HA) (segid  A  and resid   24 and name  HG1) 2.614 0.854 0.854 weight 1.000 ! spec=sumo...oesy, no=462, id=1355, vol=3.659470e+00
assign (segid  A  and resid   24 and name   HA) (segid  A  and resid   24 and name  HG2) 2.454 0.753 0.753 weight 1.000 ! spec=sumo...oesy, no=463, id=1356, vol=5.338420e+00
assign (segid  A  and resid   14 and name   HN) (segid  A  and resid   14 and name   HA) 2.771 0.960 0.960 weight 1.000 ! spec=sumo...oesy, no=464, id=381, vol=6.337020e+00
assign (segid  A  and resid   67 and name   HA) (segid  A  and resid   67 and name  HB1) 2.383 0.710 0.710 weight 1.000 ! spec=sumo...oesy, no=465, id=1358, vol=6.364320e+00
assign (segid  A  and resid   14 and name   HN) (segid  A  and resid   14 and name  HB1) 2.752 0.947 0.947 weight 1.000 ! spec=sumo...oesy, no=466, id=383, vol=6.612070e+00
assign (segid  A  and resid   14 and name   HN) (segid  A  and resid   14 and name  HB2) 2.529 0.800 0.800 weight 1.000 ! spec=sumo...oesy, no=467, id=384, vol=1.097125e+01
assign (segid  A  and resid   14 and name   HN) (segid  A  and resid   75 and name HG12) 3.600 1.620 1.620 weight 1.000 ! spec=sumo...oesy, no=468, id=385, vol=1.319370e+00
    or (segid  A  and resid   14 and name   HN) (segid  A  and resid   75 and name HG11)
    or (segid  A  and resid   14 and name   HN) (segid  A  and resid   75 and name HG13)
assign (segid  A  and resid   71 and name   HN) (segid  A  and resid   70 and name   HN) 2.465 0.760 0.760 weight 1.000 ! spec=sumo...oesy, no=469, id=386, vol=1.279243e+01
assign (segid  A  and resid   49 and name  HD1) (segid  A  and resid   49 and name   HA) 2.466 0.760 0.760 weight 1.000 ! spec=sumo...oesy, no=470, id=1363, vol=5.188470e+00
    or (segid  A  and resid   49 and name  HD2) (segid  A  and resid   49 and name   HA)
assign (segid  A  and resid   49 and name   HA) (segid  A  and resid   49 and name  HB1) 2.372 0.703 0.703 weight 1.000 ! spec=sumo...oesy, no=471, id=1364, vol=6.547260e+00
assign (segid  A  and resid   49 and name   HA) (segid  A  and resid   49 and name  HB2) 2.355 0.693 0.693 weight 1.000 ! spec=sumo...oesy, no=472, id=1365, vol=6.838980e+00
assign (segid  A  and resid   49 and name   HA) (segid  A  and resid   75 and name HG12) 2.829 1.000 1.000 weight 1.000 ! spec=sumo...oesy, no=474, id=1367, vol=2.276200e+00
    or (segid  A  and resid   49 and name   HA) (segid  A  and resid   75 and name HG11)
    or (segid  A  and resid   49 and name   HA) (segid  A  and resid   75 and name HG13)
assign (segid  A  and resid   71 and name   HN) (segid  A  and resid   71 and name   HA) 2.534 0.803 0.803 weight 1.000 ! spec=sumo...oesy, no=475, id=391, vol=1.084341e+01
assign (segid  A  and resid   71 and name   HN) (segid  A  and resid   69 and name   HA) 2.825 0.998 0.998 weight 1.000 ! spec=sumo...oesy, no=476, id=392, vol=5.645820e+00
assign (segid  A  and resid   71 and name   HN) (segid  A  and resid   70 and name   HA) 2.663 0.887 0.887 weight 1.000 ! spec=sumo...oesy, no=477, id=393, vol=8.049390e+00
assign (segid  A  and resid   71 and name   HN) (segid  A  and resid   71 and name  HB1) 2.375 0.705 0.705 weight 1.000 ! spec=sumo...oesy, no=478, id=394, vol=1.598976e+01
assign (segid  A  and resid   71 and name   HA) (segid  A  and resid    9 and name HD12) 2.813 0.989 0.989 weight 1.000 ! spec=sumo...oesy, no=479, id=1369, vol=2.352600e+00
    or (segid  A  and resid   71 and name   HA) (segid  A  and resid    9 and name HD11)
    or (segid  A  and resid   71 and name   HA) (segid  A  and resid    9 and name HD13)
assign (segid  A  and resid   71 and name   HN) (segid  A  and resid   70 and name  HB1) 3.503 1.534 1.534 weight 1.000 ! spec=sumo...oesy, no=480, id=396, vol=1.555330e+00
assign (segid  A  and resid   43 and name   HA) (segid  A  and resid   43 and name  HB1) 2.420 0.732 0.732 weight 1.000 ! spec=sumo...oesy, no=483, id=1371, vol=5.800800e+00
assign (segid  A  and resid   43 and name   HA) (segid  A  and resid   43 and name  HB2) 2.492 0.776 0.776 weight 1.000 ! spec=sumo...oesy, no=484, id=1372, vol=4.870080e+00
assign (segid  A  and resid   71 and name   HN) (segid  A  and resid    9 and name HD12) 2.483 0.770 0.770 weight 1.000 ! spec=sumo...oesy, no=487, id=403, vol=1.226741e+01
    or (segid  A  and resid   71 and name   HN) (segid  A  and resid    9 and name HD11)
    or (segid  A  and resid   71 and name   HN) (segid  A  and resid    9 and name HD13)
assign (segid  A  and resid   71 and name   HN) (segid  A  and resid    7 and name HD12) 3.479 1.513 1.513 weight 1.000 ! spec=sumo...oesy, no=489, id=405, vol=1.620880e+00
    or (segid  A  and resid   71 and name   HN) (segid  A  and resid    7 and name HD11)
    or (segid  A  and resid   71 and name   HN) (segid  A  and resid    7 and name HD13)
assign (segid  A  and resid   54 and name   HN) (segid  A  and resid   52 and name   HN) 3.413 1.456 1.456 weight 1.000 ! spec=sumo...oesy, no=490, id=406, vol=1.816770e+00
assign (segid  A  and resid   54 and name   HN) (segid  A  and resid   51 and name   HN) 2.568 0.825 0.825 weight 1.000 ! spec=sumo...oesy, no=491, id=407, vol=1.000225e+01
assign (segid  A  and resid   53 and name   HN) (segid  A  and resid   54 and name   HN) 2.585 0.836 0.836 weight 1.000 ! spec=sumo...oesy, no=492, id=408, vol=9.616430e+00
assign (segid  A  and resid   51 and name  HD1) (segid  A  and resid   51 and name   HA) 2.143 0.574 0.574 weight 1.000 ! spec=sumo...oesy, no=493, id=1377, vol=1.205169e+01
    or (segid  A  and resid   51 and name  HD2) (segid  A  and resid   51 and name   HA)
assign (segid  A  and resid   51 and name   HA) (segid  A  and resid   51 and name  HB1) 2.325 0.676 0.676 weight 1.000 ! spec=sumo...oesy, no=494, id=1378, vol=7.389150e+00
assign (segid  A  and resid   51 and name   HA) (segid  A  and resid   51 and name  HB2) 2.400 0.720 0.720 weight 1.000 ! spec=sumo...oesy, no=495, id=1379, vol=6.108450e+00
assign (segid  A  and resid   54 and name   HN) (segid  A  and resid   53 and name  HA1) 2.873 1.032 1.032 weight 1.000 ! spec=sumo...oesy, no=496, id=411, vol=5.110620e+00
assign (segid  A  and resid   54 and name   HN) (segid  A  and resid   55 and name  HD2) 3.370 1.419 1.419 weight 1.000 ! spec=sumo...oesy, no=497, id=412, vol=1.962280e+00
assign (segid  A  and resid   54 and name   HN) (segid  A  and resid   53 and name  HA2) 2.868 1.028 1.028 weight 1.000 ! spec=sumo...oesy, no=498, id=413, vol=5.164580e+00
assign (segid  A  and resid   54 and name   HN) (segid  A  and resid   51 and name  HB1) 3.689 1.701 1.701 weight 1.000 ! spec=sumo...oesy, no=499, id=414, vol=1.138810e+00
assign (segid  A  and resid   54 and name   HN) (segid  A  and resid   54 and name  HB1) 2.587 0.837 0.837 weight 1.000 ! spec=sumo...oesy, no=501, id=416, vol=9.574740e+00
assign (segid  A  and resid   54 and name   HN) (segid  A  and resid   50 and name  HB2) 3.183 1.266 1.266 weight 1.000 ! spec=sumo...oesy, no=503, id=418, vol=2.762540e+00
assign (segid  A  and resid   54 and name   HN) (segid  A  and resid   50 and name  HG2) 3.300 1.361 1.361 weight 1.000 ! spec=sumo...oesy, no=504, id=419, vol=2.223900e+00
assign (segid  A  and resid   54 and name   HN) (segid  A  and resid   50 and name  HG1) 3.659 1.673 1.673 weight 1.000 ! spec=sumo...oesy, no=505, id=420, vol=1.197400e+00
assign (segid  A  and resid   71 and name   HA) (segid  A  and resid   71 and name  HB1) 2.551 0.813 0.813 weight 1.000 ! spec=sumo...oesy, no=506, id=1382, vol=4.235990e+00
assign (segid  A  and resid   71 and name   HA) (segid  A  and resid   71 and name  HB2) 2.407 0.724 0.724 weight 1.000 ! spec=sumo...oesy, no=507, id=1383, vol=5.998240e+00
assign (segid  A  and resid   54 and name   HN) (segid  A  and resid   50 and name  HD2) 3.121 1.218 1.218 weight 1.000 ! spec=sumo...oesy, no=508, id=422, vol=3.104670e+00
assign (segid  A  and resid   60 and name   HA) (segid  A  and resid   65 and name HD12) 3.111 1.210 1.210 weight 1.000 ! spec=sumo...oesy, no=510, id=1384, vol=1.285920e+00
    or (segid  A  and resid   60 and name   HA) (segid  A  and resid   65 and name HD11)
    or (segid  A  and resid   60 and name   HA) (segid  A  and resid   65 and name HD13)
assign (segid  A  and resid   51 and name   HN) (segid  A  and resid   50 and name   HA) 2.303 0.663 0.663 weight 1.000 ! spec=sumo...oesy, no=511, id=425, vol=1.925852e+01
assign (segid  A  and resid   14 and name   HN) (segid  A  and resid   14 and name  HG1) 2.662 0.886 0.886 weight 1.000 ! spec=sumo...oesy, no=512, id=426, vol=8.066650e+00
assign (segid  A  and resid   14 and name   HN) (segid  A  and resid   75 and name   HB) 3.529 1.557 1.557 weight 1.000 ! spec=sumo...oesy, no=513, id=427, vol=1.485860e+00
assign (segid  A  and resid   14 and name   HN) (segid  A  and resid   75 and name HG22) 3.695 1.707 1.707 weight 1.000 ! spec=sumo...oesy, no=514, id=428, vol=1.128270e+00
    or (segid  A  and resid   14 and name   HN) (segid  A  and resid   75 and name HG21)
    or (segid  A  and resid   14 and name   HN) (segid  A  and resid   75 and name HG23)
assign (segid  A  and resid   79 and name   HA) (segid  A  and resid   79 and name  HB1) 2.075 0.538 0.538 weight 1.000 ! spec=sumo...oesy, no=515, id=1385, vol=1.462209e+01
assign (segid  A  and resid   51 and name   HN) (segid  A  and resid   54 and name  HB1) 3.617 1.636 1.636 weight 1.000 ! spec=sumo...oesy, no=518, id=431, vol=1.281600e+00
assign (segid  A  and resid   51 and name   HN) (segid  A  and resid   56 and name HG12) 2.719 0.924 0.924 weight 1.000 ! spec=sumo...oesy, no=519, id=432, vol=7.112930e+00
assign (segid  A  and resid   51 and name   HN) (segid  A  and resid   56 and name HD12) 2.929 1.072 1.072 weight 1.000 ! spec=sumo...oesy, no=520, id=433, vol=4.550590e+00
    or (segid  A  and resid   51 and name   HN) (segid  A  and resid   56 and name HD11)
    or (segid  A  and resid   51 and name   HN) (segid  A  and resid   56 and name HD13)
assign (segid  A  and resid   51 and name   HN) (segid  A  and resid   51 and name  HD1) 3.159 1.248 1.248 weight 1.000 ! spec=sumo...oesy, no=523, id=436, vol=2.888540e+00
    or (segid  A  and resid   51 and name   HN) (segid  A  and resid   51 and name  HD2)
assign (segid  A  and resid   22 and name   HA) (segid  A  and resid    6 and name  HD2) 3.241 1.313 1.313 weight 1.000 ! spec=sumo...oesy, no=524, id=1390, vol=1.007100e+00
assign (segid  A  and resid   22 and name   HA) (segid  A  and resid    8 and name   HA) 2.199 0.605 0.605 weight 1.000 ! spec=sumo...oesy, no=525, id=1391, vol=1.030873e+01
assign (segid  A  and resid   22 and name   HA) (segid  A  and resid   22 and name  HG1) 2.406 0.723 0.723 weight 1.000 ! spec=sumo...oesy, no=527, id=1393, vol=6.016730e+00
assign (segid  A  and resid   22 and name   HA) (segid  A  and resid   22 and name  HG2) 2.478 0.767 0.767 weight 1.000 ! spec=sumo...oesy, no=528, id=1394, vol=5.040380e+00
assign (segid  A  and resid   21 and name  HD1) (segid  A  and resid   20 and name   HA) 2.866 1.027 1.027 weight 1.000 ! spec=sumo...oesy, no=529, id=1395, vol=2.105800e+00
    or (segid  A  and resid   21 and name  HD2) (segid  A  and resid   20 and name   HA)
assign (segid  A  and resid   10 and name   HN) (segid  A  and resid   10 and name  HB1) 2.666 0.888 0.888 weight 1.000 ! spec=sumo...oesy, no=530, id=442, vol=8.004120e+00
assign (segid  A  and resid   20 and name   HA) (segid  A  and resid   10 and name   HA) 2.053 0.527 0.527 weight 1.000 ! spec=sumo...oesy, no=531, id=1396, vol=1.558963e+01
assign (segid  A  and resid   20 and name   HA) (segid  A  and resid   20 and name  HB1) 2.240 0.627 0.627 weight 1.000 ! spec=sumo...oesy, no=533, id=1397, vol=9.221880e+00
assign (segid  A  and resid   10 and name   HN) (segid  A  and resid   72 and name   HA) 2.695 0.908 0.908 weight 1.000 ! spec=sumo...oesy, no=534, id=446, vol=7.492180e+00
assign (segid  A  and resid   21 and name  HD1) (segid  A  and resid   10 and name   HA) 3.357 1.408 1.408 weight 1.000 ! spec=sumo...oesy, no=535, id=1398, vol=8.151800e-01
    or (segid  A  and resid   21 and name  HD2) (segid  A  and resid   10 and name   HA)
assign (segid  A  and resid   10 and name   HN) (segid  A  and resid   72 and name HG21) 3.232 1.306 1.306 weight 1.000 ! spec=sumo...oesy, no=539, id=451, vol=2.519830e+00
    or (segid  A  and resid   10 and name   HN) (segid  A  and resid   72 and name HG22)
    or (segid  A  and resid   10 and name   HN) (segid  A  and resid   72 and name HG23)
assign (segid  A  and resid   10 and name   HA) (segid  A  and resid   10 and name  HB2) 2.299 0.661 0.661 weight 1.000 ! spec=sumo...oesy, no=540, id=1400, vol=7.903850e+00
assign (segid  A  and resid   10 and name   HA) (segid  A  and resid   18 and name HG22) 2.647 0.876 0.876 weight 1.000 ! spec=sumo...oesy, no=542, id=1402, vol=3.388570e+00
    or (segid  A  and resid   10 and name   HA) (segid  A  and resid   18 and name HG21)
    or (segid  A  and resid   10 and name   HA) (segid  A  and resid   18 and name HG23)
assign (segid  A  and resid   58 and name   HN) (segid  A  and resid   59 and name HG21) 3.479 1.513 1.513 weight 1.000 ! spec=sumo...oesy, no=544, id=455, vol=1.618870e+00
    or (segid  A  and resid   58 and name   HN) (segid  A  and resid   59 and name HG22)
    or (segid  A  and resid   58 and name   HN) (segid  A  and resid   59 and name HG23)
assign (segid  A  and resid   26 and name   HA) (segid  A  and resid   26 and name  HB1) 2.343 0.686 0.686 weight 1.000 ! spec=sumo...oesy, no=545, id=1404, vol=7.054510e+00
assign (segid  A  and resid   26 and name   HA) (segid  A  and resid   26 and name  HB2) 2.519 0.793 0.793 weight 1.000 ! spec=sumo...oesy, no=546, id=1405, vol=4.563670e+00
assign (segid  A  and resid   49 and name   HN) (segid  A  and resid   49 and name  HE1) 3.433 1.473 1.473 weight 1.000 ! spec=sumo...oesy, no=547, id=458, vol=1.753520e+00
    or (segid  A  and resid   49 and name   HN) (segid  A  and resid   49 and name  HE2)
assign (segid  A  and resid   49 and name   HN) (segid  A  and resid   48 and name  HD1) 3.154 1.244 1.244 weight 1.000 ! spec=sumo...oesy, no=548, id=459, vol=2.916450e+00
assign (segid  A  and resid   49 and name   HN) (segid  A  and resid   48 and name  HD2) 3.575 1.598 1.598 weight 1.000 ! spec=sumo...oesy, no=549, id=460, vol=1.374660e+00
assign (segid  A  and resid   60 and name   HA) (segid  A  and resid   29 and name HD12) 3.065 1.174 1.174 weight 1.000 ! spec=sumo...oesy, no=550, id=1407, vol=1.407340e+00
    or (segid  A  and resid   60 and name   HA) (segid  A  and resid   29 and name HD11)
    or (segid  A  and resid   60 and name   HA) (segid  A  and resid   29 and name HD13)
assign (segid  A  and resid   60 and name   HA) (segid  A  and resid   60 and name  HB1) 2.403 0.722 0.722 weight 1.000 ! spec=sumo...oesy, no=551, id=1408, vol=6.056810e+00
assign (segid  A  and resid   49 and name   HN) (segid  A  and resid   48 and name  HB1) 2.607 0.850 0.850 weight 1.000 ! spec=sumo...oesy, no=552, id=463, vol=9.142300e+00
assign (segid  A  and resid   49 and name   HN) (segid  A  and resid   33 and name  HE2) 2.747 0.943 0.943 weight 1.000 ! spec=sumo...oesy, no=553, id=464, vol=6.688370e+00
    or (segid  A  and resid   49 and name   HN) (segid  A  and resid   33 and name  HE1)
    or (segid  A  and resid   49 and name   HN) (segid  A  and resid   33 and name  HE3)
assign (segid  A  and resid   51 and name   HN) (segid  A  and resid   50 and name  HG1) 2.816 0.991 0.991 weight 1.000 ! spec=sumo...oesy, no=554, id=465, vol=5.761750e+00
assign (segid  A  and resid   11 and name   HN) (segid  A  and resid   10 and name   HN) 3.473 1.508 1.508 weight 1.000 ! spec=sumo...oesy, no=556, id=467, vol=1.636980e+00
assign (segid  A  and resid   73 and name   HN) (segid  A  and resid   10 and name   HN) 3.075 1.182 1.182 weight 1.000 ! spec=sumo...oesy, no=557, id=468, vol=3.398210e+00
assign (segid  A  and resid    5 and name   HA) (segid  A  and resid   24 and name  HG2) 2.989 1.116 1.116 weight 1.000 ! spec=sumo...oesy, no=559, id=1412, vol=1.636830e+00
assign (segid  A  and resid    5 and name   HN) (segid  A  and resid    4 and name   HA) 3.111 1.210 1.210 weight 1.000 ! spec=sumo...oesy, no=560, id=470, vol=3.168590e+00
assign (segid  A  and resid   78 and name   HA) (segid  A  and resid   80 and name HG21) 3.302 1.363 1.363 weight 1.000 ! spec=sumo...oesy, no=562, id=1413, vol=8.994800e-01
    or (segid  A  and resid   78 and name   HA) (segid  A  and resid   80 and name HG22)
    or (segid  A  and resid   78 and name   HA) (segid  A  and resid   80 and name HG23)
assign (segid  A  and resid   35 and name   HA) (segid  A  and resid   38 and name  HG1) 2.926 1.070 1.070 weight 1.000 ! spec=sumo...oesy, no=565, id=1415, vol=1.858310e+00
assign (segid  A  and resid   35 and name   HA) (segid  A  and resid   38 and name  HB1) 2.359 0.696 0.696 weight 1.000 ! spec=sumo...oesy, no=566, id=1416, vol=6.768640e+00
assign (segid  A  and resid   58 and name   HN) (segid  A  and resid   57 and name   HA) 2.302 0.663 0.663 weight 1.000 ! spec=sumo...oesy, no=567, id=474, vol=1.927956e+01
assign (segid  A  and resid   58 and name   HN) (segid  A  and resid   58 and name   HA) 2.722 0.926 0.926 weight 1.000 ! spec=sumo...oesy, no=569, id=476, vol=7.058970e+00
assign (segid  A  and resid   58 and name   HN) (segid  A  and resid   57 and name  HB1) 2.762 0.954 0.954 weight 1.000 ! spec=sumo...oesy, no=570, id=477, vol=6.466660e+00
assign (segid  A  and resid   50 and name   HA) (segid  A  and resid   55 and name   HA) 2.340 0.684 0.684 weight 1.000 ! spec=sumo...oesy, no=571, id=1420, vol=7.110090e+00
assign (segid  A  and resid   58 and name   HN) (segid  A  and resid   58 and name  HG1) 2.676 0.895 0.895 weight 1.000 ! spec=sumo...oesy, no=572, id=479, vol=7.819940e+00
assign (segid  A  and resid   58 and name   HN) (segid  A  and resid   58 and name  HB1) 2.573 0.828 0.828 weight 1.000 ! spec=sumo...oesy, no=573, id=480, vol=9.888990e+00
assign (segid  A  and resid   50 and name   HA) (segid  A  and resid   50 and name  HB2) 2.349 0.690 0.690 weight 1.000 ! spec=sumo...oesy, no=574, id=1423, vol=6.944580e+00
assign (segid  A  and resid   50 and name   HA) (segid  A  and resid   50 and name  HG1) 2.391 0.715 0.715 weight 1.000 ! spec=sumo...oesy, no=576, id=1425, vol=6.239540e+00
assign (segid  A  and resid   50 and name   HA) (segid  A  and resid   56 and name HG12) 2.486 0.772 0.772 weight 1.000 ! spec=sumo...oesy, no=577, id=1426, vol=4.945630e+00
assign (segid  A  and resid   50 and name   HA) (segid  A  and resid   56 and name HD12) 2.806 0.984 0.984 weight 1.000 ! spec=sumo...oesy, no=578, id=1427, vol=2.390430e+00
    or (segid  A  and resid   50 and name   HA) (segid  A  and resid   56 and name HD11)
    or (segid  A  and resid   50 and name   HA) (segid  A  and resid   56 and name HD13)
assign (segid  A  and resid   64 and name   HN) (segid  A  and resid   66 and name   HN) 3.439 1.479 1.479 weight 1.000 ! spec=sumo...oesy, no=579, id=483, vol=1.734590e+00
assign (segid  A  and resid   65 and name   HA) (segid  A  and resid   51 and name  HD1) 3.228 1.302 1.302 weight 1.000 ! spec=sumo...oesy, no=580, id=1429, vol=1.030880e+00
    or (segid  A  and resid   65 and name   HA) (segid  A  and resid   51 and name  HD2)
assign (segid  A  and resid   63 and name   HA) (segid  A  and resid   66 and name   HA) 2.935 1.077 1.077 weight 1.000 ! spec=sumo...oesy, no=581, id=1430, vol=1.825410e+00
assign (segid  A  and resid   52 and name   HA) (segid  A  and resid   51 and name  HD1) 3.285 1.349 1.349 weight 1.000 ! spec=sumo...oesy, no=582, id=1431, vol=9.280300e-01
    or (segid  A  and resid   52 and name   HA) (segid  A  and resid   51 and name  HD2)
assign (segid  A  and resid   64 and name   HN) (segid  A  and resid   62 and name   HA) 3.665 1.679 1.679 weight 1.000 ! spec=sumo...oesy, no=583, id=487, vol=1.184320e+00
assign (segid  A  and resid   64 and name   HN) (segid  A  and resid   64 and name   HA) 2.468 0.761 0.761 weight 1.000 ! spec=sumo...oesy, no=584, id=488, vol=1.272301e+01
assign (segid  A  and resid   74 and name   HA) (segid  A  and resid   12 and name  HB2) 2.202 0.606 0.606 weight 1.000 ! spec=sumo...oesy, no=585, id=1433, vol=1.023772e+01
    or (segid  A  and resid   74 and name   HA) (segid  A  and resid   12 and name  HB1)
    or (segid  A  and resid   74 and name   HA) (segid  A  and resid   12 and name  HB3)
assign (segid  A  and resid   74 and name   HA) (segid  A  and resid   72 and name HG21) 2.679 0.897 0.897 weight 1.000 ! spec=sumo...oesy, no=586, id=1434, vol=3.155810e+00
    or (segid  A  and resid   74 and name   HA) (segid  A  and resid   72 and name HG22)
    or (segid  A  and resid   74 and name   HA) (segid  A  and resid   72 and name HG23)
assign (segid  A  and resid   64 and name   HN) (segid  A  and resid   64 and name  HB1) 2.409 0.726 0.726 weight 1.000 ! spec=sumo...oesy, no=587, id=491, vol=1.467998e+01
assign (segid  A  and resid   74 and name   HA) (segid  A  and resid   11 and name HG22) 3.226 1.301 1.301 weight 1.000 ! spec=sumo...oesy, no=588, id=1436, vol=1.034920e+00
    or (segid  A  and resid   74 and name   HA) (segid  A  and resid   11 and name HG21)
    or (segid  A  and resid   74 and name   HA) (segid  A  and resid   11 and name HG23)
assign (segid  A  and resid   64 and name   HN) (segid  A  and resid   63 and name  HB2) 2.394 0.716 0.716 weight 1.000 ! spec=sumo...oesy, no=591, id=495, vol=1.526831e+01
    or (segid  A  and resid   64 and name   HN) (segid  A  and resid   63 and name  HB1)
    or (segid  A  and resid   64 and name   HN) (segid  A  and resid   63 and name  HB3)
assign (segid  A  and resid   48 and name   HA) (segid  A  and resid   48 and name  HB2) 2.567 0.823 0.823 weight 1.000 ! spec=sumo...oesy, no=592, id=1440, vol=4.080260e+00
assign (segid  A  and resid   65 and name   HA) (segid  A  and resid   54 and name  HG2) 3.108 1.207 1.207 weight 1.000 ! spec=sumo...oesy, no=593, id=1441, vol=1.293990e+00
assign (segid  A  and resid   74 and name   HA) (segid  A  and resid   73 and name HG22) 3.128 1.223 1.223 weight 1.000 ! spec=sumo...oesy, no=595, id=1443, vol=1.244650e+00
    or (segid  A  and resid   74 and name   HA) (segid  A  and resid   73 and name HG21)
    or (segid  A  and resid   74 and name   HA) (segid  A  and resid   73 and name HG23)
assign (segid  A  and resid    4 and name   HA) (segid  A  and resid   25 and name  HG1) 3.327 1.383 1.383 weight 1.000 ! spec=sumo...oesy, no=597, id=1445, vol=8.606600e-01
assign (segid  A  and resid   36 and name   HN) (segid  A  and resid   36 and name   HA) 2.627 0.863 0.863 weight 1.000 ! spec=sumo...oesy, no=598, id=501, vol=8.736830e+00
assign (segid  A  and resid   36 and name   HN) (segid  A  and resid   32 and name   HA) 3.413 1.456 1.456 weight 1.000 ! spec=sumo...oesy, no=599, id=502, vol=1.818340e+00
assign (segid  A  and resid   36 and name   HN) (segid  A  and resid   36 and name  HB1) 2.408 0.725 0.725 weight 1.000 ! spec=sumo...oesy, no=600, id=503, vol=1.474531e+01
assign (segid  A  and resid   68 and name   HA) (segid  A  and resid   68 and name  HG1) 2.499 0.781 0.781 weight 1.000 ! spec=sumo...oesy, no=601, id=1448, vol=4.784660e+00
assign (segid  A  and resid   68 and name   HA) (segid  A  and resid   68 and name  HG2) 2.288 0.654 0.654 weight 1.000 ! spec=sumo...oesy, no=602, id=1449, vol=8.138050e+00
assign (segid  A  and resid   68 and name   HA) (segid  A  and resid   68 and name  HB1) 2.201 0.606 0.606 weight 1.000 ! spec=sumo...oesy, no=603, id=1450, vol=1.025368e+01
assign (segid  A  and resid   68 and name   HA) (segid  A  and resid   68 and name  HB2) 2.304 0.663 0.663 weight 1.000 ! spec=sumo...oesy, no=604, id=1451, vol=7.798240e+00
assign (segid  A  and resid   68 and name   HA) (segid  A  and resid    7 and name HG22) 2.871 1.030 1.030 weight 1.000 ! spec=sumo...oesy, no=605, id=1452, vol=2.083610e+00
    or (segid  A  and resid   68 and name   HA) (segid  A  and resid    7 and name HG21)
    or (segid  A  and resid   68 and name   HA) (segid  A  and resid    7 and name HG23)
assign (segid  A  and resid   68 and name   HA) (segid  A  and resid    7 and name HD12) 2.521 0.794 0.794 weight 1.000 ! spec=sumo...oesy, no=606, id=1453, vol=4.547700e+00
    or (segid  A  and resid   68 and name   HA) (segid  A  and resid    7 and name HD11)
    or (segid  A  and resid   68 and name   HA) (segid  A  and resid    7 and name HD13)
assign (segid  A  and resid   36 and name   HN) (segid  A  and resid   32 and name HD22) 3.441 1.480 1.480 weight 1.000 ! spec=sumo...oesy, no=607, id=510, vol=1.729540e+00
    or (segid  A  and resid   36 and name   HN) (segid  A  and resid   32 and name HD21)
    or (segid  A  and resid   36 and name   HN) (segid  A  and resid   32 and name HD23)
assign (segid  A  and resid   36 and name   HN) (segid  A  and resid   37 and name   HA) 3.714 1.724 1.724 weight 1.000 ! spec=sumo...oesy, no=609, id=512, vol=1.094130e+00
assign (segid  A  and resid    9 and name   HA) (segid  A  and resid    9 and name  HB2) 2.310 0.667 0.667 weight 1.000 ! spec=sumo...oesy, no=611, id=1458, vol=7.667560e+00
assign (segid  A  and resid    4 and name   HN) (segid  A  and resid    4 and name   HA) 3.410 1.453 1.453 weight 1.000 ! spec=sumo...oesy, no=613, id=513, vol=1.826790e+00
assign (segid  A  and resid    9 and name   HA) (segid  A  and resid    7 and name HD12) 3.342 1.396 1.396 weight 1.000 ! spec=sumo...oesy, no=614, id=1461, vol=8.373500e-01
    or (segid  A  and resid    9 and name   HA) (segid  A  and resid    7 and name HD11)
    or (segid  A  and resid    9 and name   HA) (segid  A  and resid    7 and name HD13)
assign (segid  A  and resid    4 and name   HN) (segid  A  and resid    4 and name  HB1) 3.397 1.443 1.443 weight 1.000 ! spec=sumo...oesy, no=615, id=515, vol=1.868430e+00
assign (segid  A  and resid    4 and name   HA) (segid  A  and resid   25 and name  HB1) 2.933 1.075 1.075 weight 1.000 ! spec=sumo...oesy, no=616, id=1463, vol=1.831580e+00
assign (segid  A  and resid   39 and name   HN) (segid  A  and resid   36 and name  HD1) 3.706 1.717 1.717 weight 1.000 ! spec=sumo...oesy, no=622, id=521, vol=1.109030e+00
    or (segid  A  and resid   39 and name   HN) (segid  A  and resid   36 and name  HD2)
assign (segid  A  and resid    8 and name   HA) (segid  A  and resid   22 and name  HG1) 2.829 1.001 1.001 weight 1.000 ! spec=sumo...oesy, no=623, id=1470, vol=2.272770e+00
assign (segid  A  and resid    8 and name   HA) (segid  A  and resid   22 and name  HG2) 2.954 1.090 1.090 weight 1.000 ! spec=sumo...oesy, no=624, id=1471, vol=1.756600e+00
assign (segid  A  and resid   56 and name   HN) (segid  A  and resid   50 and name   HA) 2.709 0.917 0.917 weight 1.000 ! spec=sumo...oesy, no=626, id=524, vol=7.271020e+00
assign (segid  A  and resid   54 and name   HA) (segid  A  and resid   55 and name  HD1) 2.191 0.600 0.600 weight 1.000 ! spec=sumo...oesy, no=627, id=1474, vol=1.053559e+01
assign (segid  A  and resid   54 and name   HA) (segid  A  and resid   55 and name  HD2) 2.265 0.641 0.641 weight 1.000 ! spec=sumo...oesy, no=628, id=1475, vol=8.631360e+00
assign (segid  A  and resid   54 and name   HA) (segid  A  and resid   54 and name  HG1) 2.532 0.801 0.801 weight 1.000 ! spec=sumo...oesy, no=629, id=1476, vol=4.424800e+00
assign (segid  A  and resid   54 and name   HA) (segid  A  and resid   54 and name  HB1) 2.315 0.670 0.670 weight 1.000 ! spec=sumo...oesy, no=630, id=1477, vol=7.585790e+00
assign (segid  A  and resid   54 and name   HA) (segid  A  and resid   54 and name  HB2) 2.502 0.783 0.783 weight 1.000 ! spec=sumo...oesy, no=631, id=1478, vol=4.749180e+00
assign (segid  A  and resid   54 and name   HA) (segid  A  and resid   55 and name  HG2) 2.777 0.964 0.964 weight 1.000 ! spec=sumo...oesy, no=632, id=1479, vol=2.540270e+00
assign (segid  A  and resid   56 and name   HN) (segid  A  and resid   50 and name  HG1) 3.307 1.367 1.367 weight 1.000 ! spec=sumo...oesy, no=633, id=531, vol=2.194030e+00
assign (segid  A  and resid   57 and name   HA) (segid  A  and resid   58 and name  HG1) 3.399 1.445 1.445 weight 1.000 ! spec=sumo...oesy, no=634, id=1480, vol=7.556500e-01
assign (segid  A  and resid   57 and name   HA) (segid  A  and resid   57 and name  HB1) 2.114 0.559 0.559 weight 1.000 ! spec=sumo...oesy, no=635, id=1481, vol=1.305600e+01
assign (segid  A  and resid   57 and name   HA) (segid  A  and resid   57 and name  HB2) 2.239 0.627 0.627 weight 1.000 ! spec=sumo...oesy, no=636, id=1482, vol=9.257980e+00
assign (segid  A  and resid   57 and name   HA) (segid  A  and resid   33 and name  HE2) 2.659 0.884 0.884 weight 1.000 ! spec=sumo...oesy, no=637, id=1483, vol=3.299830e+00
    or (segid  A  and resid   57 and name   HA) (segid  A  and resid   33 and name  HE1)
    or (segid  A  and resid   57 and name   HA) (segid  A  and resid   33 and name  HE3)
assign (segid  A  and resid   57 and name   HA) (segid  A  and resid   56 and name HG22) 2.956 1.092 1.092 weight 1.000 ! spec=sumo...oesy, no=638, id=1484, vol=1.749510e+00
    or (segid  A  and resid   57 and name   HA) (segid  A  and resid   56 and name HG21)
    or (segid  A  and resid   57 and name   HA) (segid  A  and resid   56 and name HG23)
assign (segid  A  and resid   31 and name   HN) (segid  A  and resid   33 and name   HN) 3.155 1.244 1.244 weight 1.000 ! spec=sumo...oesy, no=640, id=538, vol=2.913060e+00
assign (segid  A  and resid   28 and name  HD1) (segid  A  and resid   27 and name   HA) 2.223 0.618 0.618 weight 1.000 ! spec=sumo...oesy, no=642, id=1485, vol=9.667970e+00
assign (segid  A  and resid   28 and name  HD1) (segid  A  and resid   27 and name HG21) 2.475 0.766 0.766 weight 1.000 ! spec=sumo...oesy, no=644, id=1487, vol=5.071810e+00
    or (segid  A  and resid   28 and name  HD1) (segid  A  and resid   27 and name HG22)
    or (segid  A  and resid   28 and name  HD1) (segid  A  and resid   27 and name HG23)
assign (segid  A  and resid   31 and name   HN) (segid  A  and resid   31 and name  HB1) 2.290 0.656 0.656 weight 1.000 ! spec=sumo...oesy, no=646, id=543, vol=1.990234e+01
assign (segid  A  and resid   12 and name   HA) (segid  A  and resid   18 and name   HA) 2.008 0.504 0.504 weight 1.000 ! spec=sumo...oesy, no=647, id=1490, vol=1.779578e+01
assign (segid  A  and resid   12 and name   HA) (segid  A  and resid   18 and name   HB) 2.870 1.030 1.030 weight 1.000 ! spec=sumo...oesy, no=648, id=1491, vol=2.084860e+00
assign (segid  A  and resid   31 and name   HN) (segid  A  and resid   29 and name   HN) 3.838 1.841 1.841 weight 1.000 ! spec=sumo...oesy, no=650, id=547, vol=8.984500e-01
assign (segid  A  and resid   31 and name   HN) (segid  A  and resid   31 and name  HE1) 3.761 1.768 1.768 weight 1.000 ! spec=sumo...oesy, no=651, id=548, vol=1.014600e+00
assign (segid  A  and resid   12 and name   HA) (segid  A  and resid   18 and name HG22) 2.516 0.791 0.791 weight 1.000 ! spec=sumo...oesy, no=652, id=1495, vol=4.602710e+00
    or (segid  A  and resid   12 and name   HA) (segid  A  and resid   18 and name HG21)
    or (segid  A  and resid   12 and name   HA) (segid  A  and resid   18 and name HG23)
assign (segid  A  and resid   12 and name   HA) (segid  A  and resid   11 and name HG22) 3.186 1.269 1.269 weight 1.000 ! spec=sumo...oesy, no=653, id=1496, vol=1.114200e+00
    or (segid  A  and resid   12 and name   HA) (segid  A  and resid   11 and name HG21)
    or (segid  A  and resid   12 and name   HA) (segid  A  and resid   11 and name HG23)
assign (segid  A  and resid   28 and name  HD1) (segid  A  and resid   28 and name  HB1) 2.917 1.063 1.063 weight 1.000 ! spec=sumo...oesy, no=655, id=1497, vol=1.893730e+00
assign (segid  A  and resid   39 and name   HN) (segid  A  and resid   39 and name  HB1) 2.269 0.644 0.644 weight 1.000 ! spec=sumo...oesy, no=658, id=554, vol=2.104077e+01
assign (segid  A  and resid   39 and name   HN) (segid  A  and resid   38 and name  HG1) 3.332 1.387 1.387 weight 1.000 ! spec=sumo...oesy, no=661, id=557, vol=2.100050e+00
assign (segid  A  and resid   33 and name   HN) (segid  A  and resid   29 and name   HA) 3.642 1.658 1.658 weight 1.000 ! spec=sumo...oesy, no=662, id=558, vol=1.231550e+00
assign (segid  A  and resid   13 and name  HA1) (segid  A  and resid   13 and name  HA2) 2.185 0.597 0.597 weight 1.000 ! spec=sumo...oesy, no=663, id=1498, vol=1.072434e+01
assign (segid  A  and resid   35 and name   HN) (segid  A  and resid   33 and name   HN) 3.869 1.872 1.872 weight 1.000 ! spec=sumo...oesy, no=665, id=560, vol=8.556500e-01
assign (segid  A  and resid   33 and name   HN) (segid  A  and resid   32 and name   HA) 3.233 1.307 1.307 weight 1.000 ! spec=sumo...oesy, no=668, id=563, vol=2.512630e+00
assign (segid  A  and resid   33 and name   HN) (segid  A  and resid   33 and name   HA) 2.822 0.996 0.996 weight 1.000 ! spec=sumo...oesy, no=669, id=564, vol=5.680370e+00
assign (segid  A  and resid   33 and name   HN) (segid  A  and resid   44 and name  HE2) 3.536 1.563 1.563 weight 1.000 ! spec=sumo...oesy, no=670, id=565, vol=1.468850e+00
    or (segid  A  and resid   33 and name   HN) (segid  A  and resid   44 and name  HE1)
    or (segid  A  and resid   33 and name   HN) (segid  A  and resid   44 and name  HE3)
assign (segid  A  and resid   33 and name   HN) (segid  A  and resid   33 and name  HG1) 2.606 0.849 0.849 weight 1.000 ! spec=sumo...oesy, no=671, id=566, vol=9.169940e+00
assign (segid  A  and resid   33 and name   HN) (segid  A  and resid   33 and name  HB1) 2.492 0.776 0.776 weight 1.000 ! spec=sumo...oesy, no=672, id=567, vol=1.198580e+01
assign (segid  A  and resid   33 and name   HN) (segid  A  and resid   32 and name  HB1) 2.790 0.973 0.973 weight 1.000 ! spec=sumo...oesy, no=673, id=568, vol=6.088460e+00
assign (segid  A  and resid   33 and name   HN) (segid  A  and resid   32 and name  HB2) 3.181 1.265 1.265 weight 1.000 ! spec=sumo...oesy, no=674, id=569, vol=2.772000e+00
assign (segid  A  and resid   33 and name   HN) (segid  A  and resid   33 and name  HG2) 2.772 0.960 0.960 weight 1.000 ! spec=sumo...oesy, no=677, id=572, vol=6.334440e+00
assign (segid  A  and resid   33 and name   HN) (segid  A  and resid   32 and name HD22) 3.019 1.139 1.139 weight 1.000 ! spec=sumo...oesy, no=678, id=573, vol=3.793530e+00
    or (segid  A  and resid   33 and name   HN) (segid  A  and resid   32 and name HD21)
    or (segid  A  and resid   33 and name   HN) (segid  A  and resid   32 and name HD23)
assign (segid  A  and resid   38 and name   HN) (segid  A  and resid   36 and name   HN) 3.351 1.404 1.404 weight 1.000 ! spec=sumo...oesy, no=679, id=574, vol=2.027730e+00
assign (segid  A  and resid   39 and name   HN) (segid  A  and resid   38 and name   HN) 2.442 0.745 0.745 weight 1.000 ! spec=sumo...oesy, no=681, id=575, vol=1.355362e+01
assign (segid  A  and resid   38 and name   HN) (segid  A  and resid   35 and name   HN) 3.695 1.707 1.707 weight 1.000 ! spec=sumo...oesy, no=683, id=577, vol=1.128140e+00
assign (segid  A  and resid   38 and name   HN) (segid  A  and resid   36 and name  HD1) 3.871 1.873 1.873 weight 1.000 ! spec=sumo...oesy, no=684, id=578, vol=8.539700e-01
    or (segid  A  and resid   38 and name   HN) (segid  A  and resid   36 and name  HD2)
assign (segid  A  and resid   38 and name   HN) (segid  A  and resid   35 and name   HA) 2.731 0.932 0.932 weight 1.000 ! spec=sumo...oesy, no=685, id=579, vol=6.920690e+00
assign (segid  A  and resid   38 and name   HN) (segid  A  and resid   38 and name   HA) 2.352 0.692 0.692 weight 1.000 ! spec=sumo...oesy, no=686, id=580, vol=1.695709e+01
assign (segid  A  and resid   28 and name  HD1) (segid  A  and resid   28 and name  HD2) 2.317 0.671 0.671 weight 1.000 ! spec=sumo...oesy, no=687, id=1502, vol=7.543930e+00
assign (segid  A  and resid   65 and name   HA) (segid  A  and resid   65 and name  HB2) 2.563 0.821 0.821 weight 1.000 ! spec=sumo...oesy, no=688, id=1503, vol=4.118760e+00
assign (segid  A  and resid   38 and name   HN) (segid  A  and resid   37 and name  HB2) 2.678 0.897 0.897 weight 1.000 ! spec=sumo...oesy, no=689, id=583, vol=7.781450e+00
assign (segid  A  and resid   40 and name   HA) (segid  A  and resid   40 and name  HB2) 2.366 0.700 0.700 weight 1.000 ! spec=sumo...oesy, no=690, id=1505, vol=6.640300e+00
assign (segid  A  and resid   52 and name   HA) (segid  A  and resid   52 and name  HB2) 2.058 0.529 0.529 weight 1.000 ! spec=sumo...oesy, no=691, id=1506, vol=1.535582e+01
assign (segid  A  and resid   38 and name   HN) (segid  A  and resid   38 and name  HB1) 2.280 0.650 0.650 weight 1.000 ! spec=sumo...oesy, no=692, id=586, vol=2.045460e+01
assign (segid  A  and resid   40 and name   HA) (segid  A  and resid   40 and name  HB1) 2.290 0.655 0.655 weight 1.000 ! spec=sumo...oesy, no=694, id=1509, vol=8.096630e+00
assign (segid  A  and resid   42 and name   HN) (segid  A  and resid   43 and name   HN) 3.252 1.322 1.322 weight 1.000 ! spec=sumo...oesy, no=696, id=590, vol=2.430170e+00
assign (segid  A  and resid   42 and name   HN) (segid  A  and resid   41 and name  HA2) 2.552 0.814 0.814 weight 1.000 ! spec=sumo...oesy, no=699, id=592, vol=1.038672e+01
assign (segid  A  and resid   42 and name   HN) (segid  A  and resid   37 and name   HA) 2.711 0.919 0.919 weight 1.000 ! spec=sumo...oesy, no=700, id=593, vol=7.232230e+00
assign (segid  A  and resid   42 and name   HN) (segid  A  and resid   37 and name  HB2) 3.681 1.694 1.694 weight 1.000 ! spec=sumo...oesy, no=701, id=594, vol=1.153840e+00
assign (segid  A  and resid   75 and name   HN) (segid  A  and resid   12 and name   HN) 3.076 1.182 1.182 weight 1.000 ! spec=sumo...oesy, no=707, id=598, vol=3.392920e+00
assign (segid  A  and resid   52 and name  HB1) (segid  A  and resid   51 and name  HD1) 3.085 1.190 1.190 weight 1.000 ! spec=sumo...oesy, no=709, id=1511, vol=1.352200e+00
    or (segid  A  and resid   52 and name  HB1) (segid  A  and resid   51 and name  HD2)
assign (segid  A  and resid   52 and name  HB1) (segid  A  and resid   52 and name   HA) 2.305 0.664 0.664 weight 1.000 ! spec=sumo...oesy, no=710, id=1512, vol=7.769990e+00
assign (segid  A  and resid    4 and name  HB1) (segid  A  and resid    4 and name   HA) 2.476 0.766 0.766 weight 1.000 ! spec=sumo...oesy, no=716, id=1514, vol=5.063550e+00
assign (segid  A  and resid    4 and name  HB2) (segid  A  and resid    4 and name   HA) 2.485 0.772 0.772 weight 1.000 ! spec=sumo...oesy, no=718, id=1515, vol=4.949590e+00
assign (segid  A  and resid   36 and name  HB1) (segid  A  and resid   36 and name  HE1) 3.368 1.418 1.418 weight 1.000 ! spec=sumo...oesy, no=721, id=1516, vol=7.989800e-01
    or (segid  A  and resid   36 and name  HB1) (segid  A  and resid   36 and name  HE2)
assign (segid  A  and resid   49 and name  HE1) (segid  A  and resid   36 and name  HB1) 3.419 1.461 1.461 weight 1.000 ! spec=sumo...oesy, no=722, id=1517, vol=7.304900e-01
    or (segid  A  and resid   49 and name  HE2) (segid  A  and resid   36 and name  HB1)
assign (segid  A  and resid   49 and name   HZ) (segid  A  and resid   36 and name  HB1) 2.965 1.099 1.099 weight 1.000 ! spec=sumo...oesy, no=724, id=1519, vol=1.715530e+00
assign (segid  A  and resid   75 and name   HN) (segid  A  and resid   13 and name  HA2) 3.521 1.549 1.549 weight 1.000 ! spec=sumo...oesy, no=725, id=612, vol=1.508260e+00
assign (segid  A  and resid   75 and name   HN) (segid  A  and resid   75 and name   HB) 2.490 0.775 0.775 weight 1.000 ! spec=sumo...oesy, no=727, id=614, vol=1.203653e+01
assign (segid  A  and resid   75 and name   HN) (segid  A  and resid   72 and name HG21) 3.515 1.545 1.545 weight 1.000 ! spec=sumo...oesy, no=728, id=615, vol=1.521430e+00
    or (segid  A  and resid   75 and name   HN) (segid  A  and resid   72 and name HG22)
    or (segid  A  and resid   75 and name   HN) (segid  A  and resid   72 and name HG23)
assign (segid  A  and resid   75 and name   HN) (segid  A  and resid   73 and name HG22) 3.707 1.717 1.717 weight 1.000 ! spec=sumo...oesy, no=729, id=616, vol=1.107400e+00
    or (segid  A  and resid   75 and name   HN) (segid  A  and resid   73 and name HG21)
    or (segid  A  and resid   75 and name   HN) (segid  A  and resid   73 and name HG23)
assign (segid  A  and resid   75 and name   HN) (segid  A  and resid   75 and name HG12) 2.729 0.931 0.931 weight 1.000 ! spec=sumo...oesy, no=730, id=617, vol=6.950810e+00
    or (segid  A  and resid   75 and name   HN) (segid  A  and resid   75 and name HG11)
    or (segid  A  and resid   75 and name   HN) (segid  A  and resid   75 and name HG13)
assign (segid  A  and resid   36 and name  HB2) (segid  A  and resid   32 and name HD22) 3.442 1.481 1.481 weight 1.000 ! spec=sumo...oesy, no=731, id=1524, vol=7.014900e-01
    or (segid  A  and resid   36 and name  HB2) (segid  A  and resid   32 and name HD21)
    or (segid  A  and resid   36 and name  HB2) (segid  A  and resid   32 and name HD23)
assign (segid  A  and resid   36 and name  HB2) (segid  A  and resid   11 and name HG22) 3.341 1.395 1.395 weight 1.000 ! spec=sumo...oesy, no=732, id=1525, vol=8.388400e-01
    or (segid  A  and resid   36 and name  HB2) (segid  A  and resid   11 and name HG21)
    or (segid  A  and resid   36 and name  HB2) (segid  A  and resid   11 and name HG23)
assign (segid  A  and resid   36 and name  HB2) (segid  A  and resid   49 and name   HZ) 2.920 1.066 1.066 weight 1.000 ! spec=sumo...oesy, no=733, id=1526, vol=1.880660e+00
assign (segid  A  and resid   36 and name  HD1) (segid  A  and resid   36 and name  HB2) 2.388 0.713 0.713 weight 1.000 ! spec=sumo...oesy, no=734, id=1527, vol=6.283890e+00
    or (segid  A  and resid   36 and name  HD2) (segid  A  and resid   36 and name  HB2)
assign (segid  A  and resid   36 and name  HB2) (segid  A  and resid   36 and name  HE1) 3.306 1.366 1.366 weight 1.000 ! spec=sumo...oesy, no=735, id=1528, vol=8.929000e-01
    or (segid  A  and resid   36 and name  HB2) (segid  A  and resid   36 and name  HE2)
assign (segid  A  and resid   36 and name  HB2) (segid  A  and resid   36 and name  HB1) 2.307 0.665 0.665 weight 1.000 ! spec=sumo...oesy, no=737, id=1530, vol=7.735880e+00
assign (segid  A  and resid   69 and name   HN) (segid  A  and resid   69 and name  HB1) 2.060 0.531 0.531 weight 1.000 ! spec=sumo...oesy, no=739, id=625, vol=3.753870e+01
assign (segid  A  and resid   69 and name   HN) (segid  A  and resid   68 and name  HG1) 3.087 1.191 1.191 weight 1.000 ! spec=sumo...oesy, no=740, id=626, vol=3.321040e+00
assign (segid  A  and resid   69 and name   HN) (segid  A  and resid   68 and name  HB1) 2.380 0.708 0.708 weight 1.000 ! spec=sumo...oesy, no=742, id=628, vol=1.580233e+01
assign (segid  A  and resid   69 and name   HN) (segid  A  and resid   68 and name  HB2) 2.553 0.815 0.815 weight 1.000 ! spec=sumo...oesy, no=743, id=629, vol=1.036798e+01
assign (segid  A  and resid   69 and name   HN) (segid  A  and resid    7 and name   HB) 3.225 1.300 1.300 weight 1.000 ! spec=sumo...oesy, no=744, id=630, vol=2.552860e+00
assign (segid  A  and resid   69 and name   HN) (segid  A  and resid    7 and name HG11) 3.490 1.522 1.522 weight 1.000 ! spec=sumo...oesy, no=745, id=631, vol=1.589450e+00
assign (segid  A  and resid   69 and name   HN) (segid  A  and resid    7 and name HG22) 2.890 1.044 1.044 weight 1.000 ! spec=sumo...oesy, no=747, id=633, vol=4.934150e+00
    or (segid  A  and resid   69 and name   HN) (segid  A  and resid    7 and name HG21)
    or (segid  A  and resid   69 and name   HN) (segid  A  and resid    7 and name HG23)
assign (segid  A  and resid   69 and name   HN) (segid  A  and resid    7 and name HD12) 3.021 1.140 1.140 weight 1.000 ! spec=sumo...oesy, no=748, id=634, vol=3.781540e+00
    or (segid  A  and resid   69 and name   HN) (segid  A  and resid    7 and name HD11)
    or (segid  A  and resid   69 and name   HN) (segid  A  and resid    7 and name HD13)
assign (segid  A  and resid   25 and name   HN) (segid  A  and resid   26 and name   HN) 2.865 1.026 1.026 weight 1.000 ! spec=sumo...oesy, no=753, id=637, vol=5.189330e+00
assign (segid  A  and resid   25 and name   HN) (segid  A  and resid    6 and name   HA) 2.995 1.121 1.121 weight 1.000 ! spec=sumo...oesy, no=754, id=638, vol=3.980390e+00
assign (segid  A  and resid   25 and name   HN) (segid  A  and resid   24 and name   HA) 2.451 0.751 0.751 weight 1.000 ! spec=sumo...oesy, no=755, id=639, vol=1.323278e+01
assign (segid  A  and resid   25 and name   HN) (segid  A  and resid   25 and name   HA) 2.873 1.032 1.032 weight 1.000 ! spec=sumo...oesy, no=756, id=640, vol=5.105880e+00
assign (segid  A  and resid    6 and name  HB1) (segid  A  and resid    6 and name  HD1) 3.121 1.217 1.217 weight 1.000 ! spec=sumo...oesy, no=757, id=1543, vol=1.262190e+00
assign (segid  A  and resid    6 and name  HB1) (segid  A  and resid    6 and name   HA) 2.732 0.933 0.933 weight 1.000 ! spec=sumo...oesy, no=758, id=1544, vol=2.802470e+00
assign (segid  A  and resid   25 and name   HN) (segid  A  and resid   24 and name  HB1) 2.804 0.983 0.983 weight 1.000 ! spec=sumo...oesy, no=760, id=644, vol=5.910170e+00
assign (segid  A  and resid   25 and name   HN) (segid  A  and resid   25 and name  HB1) 2.635 0.868 0.868 weight 1.000 ! spec=sumo...oesy, no=761, id=645, vol=8.578780e+00
assign (segid  A  and resid    6 and name  HB2) (segid  A  and resid   24 and name   HA) 3.364 1.415 1.415 weight 1.000 ! spec=sumo...oesy, no=763, id=1549, vol=8.046300e-01
assign (segid  A  and resid    6 and name  HB2) (segid  A  and resid   22 and name  HG1) 2.977 1.108 1.108 weight 1.000 ! spec=sumo...oesy, no=764, id=1550, vol=1.673850e+00
assign (segid  A  and resid    6 and name  HD2) (segid  A  and resid    6 and name  HB2) 2.928 1.072 1.072 weight 1.000 ! spec=sumo...oesy, no=765, id=1551, vol=1.849340e+00
assign (segid  A  and resid    6 and name  HB2) (segid  A  and resid    6 and name   HA) 2.663 0.887 0.887 weight 1.000 ! spec=sumo...oesy, no=766, id=1552, vol=3.266730e+00
assign (segid  A  and resid    7 and name   HN) (segid  A  and resid    6 and name  HD2) 3.721 1.731 1.731 weight 1.000 ! spec=sumo...oesy, no=768, id=650, vol=1.081400e+00
assign (segid  A  and resid    7 and name   HN) (segid  A  and resid   22 and name   HA) 3.467 1.502 1.502 weight 1.000 ! spec=sumo...oesy, no=769, id=651, vol=1.654160e+00
assign (segid  A  and resid    6 and name  HB1) (segid  A  and resid   22 and name  HB1) 3.285 1.349 1.349 weight 1.000 ! spec=sumo...oesy, no=771, id=1556, vol=9.281600e-01
assign (segid  A  and resid    7 and name   HN) (segid  A  and resid    8 and name   HA) 3.859 1.862 1.862 weight 1.000 ! spec=sumo...oesy, no=775, id=655, vol=8.692700e-01
assign (segid  A  and resid   25 and name   HN) (segid  A  and resid    7 and name   HN) 3.398 1.444 1.444 weight 1.000 ! spec=sumo...oesy, no=779, id=658, vol=1.864400e+00
assign (segid  A  and resid    7 and name   HN) (segid  A  and resid    6 and name   HA) 2.341 0.685 0.685 weight 1.000 ! spec=sumo...oesy, no=780, id=659, vol=1.746221e+01
assign (segid  A  and resid    7 and name   HN) (segid  A  and resid   24 and name   HA) 2.905 1.055 1.055 weight 1.000 ! spec=sumo...oesy, no=781, id=660, vol=4.775840e+00
assign (segid  A  and resid    7 and name   HN) (segid  A  and resid    6 and name  HB2) 2.784 0.969 0.969 weight 1.000 ! spec=sumo...oesy, no=782, id=661, vol=6.169460e+00
assign (segid  A  and resid    7 and name   HN) (segid  A  and resid    7 and name HG11) 2.929 1.073 1.073 weight 1.000 ! spec=sumo...oesy, no=784, id=663, vol=4.544960e+00
assign (segid  A  and resid    7 and name   HN) (segid  A  and resid    7 and name HG12) 2.816 0.991 0.991 weight 1.000 ! spec=sumo...oesy, no=785, id=664, vol=5.765130e+00
assign (segid  A  and resid    7 and name   HN) (segid  A  and resid    7 and name HG22) 2.665 0.888 0.888 weight 1.000 ! spec=sumo...oesy, no=786, id=665, vol=8.016980e+00
    or (segid  A  and resid    7 and name   HN) (segid  A  and resid    7 and name HG21)
    or (segid  A  and resid    7 and name   HN) (segid  A  and resid    7 and name HG23)
assign (segid  A  and resid   37 and name  HB1) (segid  A  and resid   34 and name   HA) 2.810 0.987 0.987 weight 1.000 ! spec=sumo...oesy, no=787, id=1557, vol=2.369450e+00
assign (segid  A  and resid   37 and name  HB1) (segid  A  and resid   37 and name   HA) 2.528 0.799 0.799 weight 1.000 ! spec=sumo...oesy, no=788, id=1558, vol=4.467980e+00
assign (segid  A  and resid   37 and name  HB1) (segid  A  and resid   37 and name  HB2) 2.119 0.562 0.562 weight 1.000 ! spec=sumo...oesy, no=790, id=1559, vol=1.286434e+01
assign (segid  A  and resid   37 and name  HB1) (segid  A  and resid   42 and name  HB2) 3.124 1.220 1.220 weight 1.000 ! spec=sumo...oesy, no=791, id=1560, vol=1.253670e+00
assign (segid  A  and resid   37 and name  HB2) (segid  A  and resid   37 and name   HA) 2.635 0.868 0.868 weight 1.000 ! spec=sumo...oesy, no=793, id=1561, vol=3.482590e+00
assign (segid  A  and resid    7 and name   HN) (segid  A  and resid    6 and name   HN) 3.363 1.414 1.414 weight 1.000 ! spec=sumo...oesy, no=795, id=670, vol=1.983590e+00
assign (segid  A  and resid   49 and name   HZ) (segid  A  and resid   33 and name   HA) 2.658 0.883 0.883 weight 1.000 ! spec=sumo...oesy, no=798, id=1564, vol=3.309620e+00
assign (segid  A  and resid    6 and name   HN) (segid  A  and resid    6 and name  HB1) 2.596 0.843 0.843 weight 1.000 ! spec=sumo...oesy, no=799, id=673, vol=9.378810e+00
assign (segid  A  and resid   49 and name  HE1) (segid  A  and resid   33 and name   HA) 2.781 0.967 0.967 weight 1.000 ! spec=sumo...oesy, no=800, id=1566, vol=2.519470e+00
    or (segid  A  and resid   49 and name  HE2) (segid  A  and resid   33 and name   HA)
assign (segid  A  and resid    6 and name   HN) (segid  A  and resid    5 and name  HB1) 2.720 0.925 0.925 weight 1.000 ! spec=sumo...oesy, no=801, id=675, vol=7.089190e+00
assign (segid  A  and resid   36 and name  HB2) (segid  A  and resid   33 and name   HA) 3.070 1.178 1.178 weight 1.000 ! spec=sumo...oesy, no=803, id=1568, vol=1.393700e+00
assign (segid  A  and resid   33 and name   HA) (segid  A  and resid   44 and name  HE2) 3.340 1.394 1.394 weight 1.000 ! spec=sumo...oesy, no=804, id=1569, vol=8.401900e-01
    or (segid  A  and resid   33 and name   HA) (segid  A  and resid   44 and name  HE1)
    or (segid  A  and resid   33 and name   HA) (segid  A  and resid   44 and name  HE3)
assign (segid  A  and resid   33 and name   HA) (segid  A  and resid   33 and name  HG1) 2.517 0.792 0.792 weight 1.000 ! spec=sumo...oesy, no=805, id=1570, vol=4.589720e+00
assign (segid  A  and resid   37 and name   HN) (segid  A  and resid   49 and name   HZ) 3.347 1.400 1.400 weight 1.000 ! spec=sumo...oesy, no=807, id=680, vol=2.043340e+00
assign (segid  A  and resid   37 and name   HN) (segid  A  and resid   37 and name   HA) 2.653 0.880 0.880 weight 1.000 ! spec=sumo...oesy, no=808, id=681, vol=8.238290e+00
assign (segid  A  and resid   33 and name   HA) (segid  A  and resid   33 and name  HG2) 2.512 0.789 0.789 weight 1.000 ! spec=sumo...oesy, no=809, id=1574, vol=4.640830e+00
assign (segid  A  and resid   37 and name   HN) (segid  A  and resid   37 and name  HB2) 2.500 0.781 0.781 weight 1.000 ! spec=sumo...oesy, no=810, id=683, vol=1.175304e+01
assign (segid  A  and resid   21 and name  HB1) (segid  A  and resid    9 and name  HB2) 3.450 1.488 1.488 weight 1.000 ! spec=sumo...oesy, no=813, id=1577, vol=6.916800e-01
assign (segid  A  and resid   37 and name   HN) (segid  A  and resid   35 and name  HB2) 3.246 1.317 1.317 weight 1.000 ! spec=sumo...oesy, no=815, id=688, vol=2.452990e+00
    or (segid  A  and resid   37 and name   HN) (segid  A  and resid   35 and name  HB1)
    or (segid  A  and resid   37 and name   HN) (segid  A  and resid   35 and name  HB3)
assign (segid  A  and resid   21 and name  HB1) (segid  A  and resid   21 and name   HA) 2.451 0.751 0.751 weight 1.000 ! spec=sumo...oesy, no=816, id=1580, vol=5.385490e+00
assign (segid  A  and resid   21 and name  HB1) (segid  A  and resid   21 and name  HB2) 2.012 0.506 0.506 weight 1.000 ! spec=sumo...oesy, no=817, id=1581, vol=1.758653e+01
assign (segid  A  and resid   39 and name   HN) (segid  A  and resid   37 and name   HN) 3.559 1.584 1.584 weight 1.000 ! spec=sumo...oesy, no=818, id=691, vol=1.412630e+00
assign (segid  A  and resid   37 and name   HN) (segid  A  and resid   35 and name   HA) 3.537 1.564 1.564 weight 1.000 ! spec=sumo...oesy, no=819, id=692, vol=1.465730e+00
assign (segid  A  and resid   21 and name   HA) (segid  A  and resid   21 and name  HB2) 2.585 0.835 0.835 weight 1.000 ! spec=sumo...oesy, no=820, id=1584, vol=3.910840e+00
assign (segid  A  and resid   21 and name  HB2) (segid  A  and resid   32 and name HD12) 2.800 0.980 0.980 weight 1.000 ! spec=sumo...oesy, no=821, id=1585, vol=2.418050e+00
    or (segid  A  and resid   21 and name  HB2) (segid  A  and resid   32 and name HD11)
    or (segid  A  and resid   21 and name  HB2) (segid  A  and resid   32 and name HD13)
assign (segid  A  and resid   74 and name   HA) (segid  A  and resid   74 and name  HB1) 2.173 0.590 0.590 weight 1.000 ! spec=sumo...oesy, no=824, id=1588, vol=1.107026e+01
assign (segid  A  and resid   74 and name  HB2) (segid  A  and resid   50 and name  HB1) 2.718 0.923 0.923 weight 1.000 ! spec=sumo...oesy, no=826, id=1590, vol=2.892870e+00
assign (segid  A  and resid   74 and name  HB2) (segid  A  and resid   50 and name  HB2) 2.900 1.051 1.051 weight 1.000 ! spec=sumo...oesy, no=827, id=1591, vol=1.962240e+00
assign (segid  A  and resid   65 and name   HN) (segid  A  and resid   64 and name  HB1) 2.830 1.001 1.001 weight 1.000 ! spec=sumo...oesy, no=828, id=699, vol=5.587460e+00
assign (segid  A  and resid   39 and name  HD1) (segid  A  and resid   36 and name  HD1) 2.819 0.993 0.993 weight 1.000 ! spec=sumo...oesy, no=829, id=1592, vol=2.323640e+00
    or (segid  A  and resid   39 and name  HD1) (segid  A  and resid   36 and name  HD2)
assign (segid  A  and resid   65 and name   HN) (segid  A  and resid   63 and name  HB2) 3.288 1.351 1.351 weight 1.000 ! spec=sumo...oesy, no=831, id=702, vol=2.274410e+00
    or (segid  A  and resid   65 and name   HN) (segid  A  and resid   63 and name  HB1)
    or (segid  A  and resid   65 and name   HN) (segid  A  and resid   63 and name  HB3)
assign (segid  A  and resid   65 and name   HN) (segid  A  and resid   65 and name HD22) 2.679 0.897 0.897 weight 1.000 ! spec=sumo...oesy, no=832, id=703, vol=7.765430e+00
    or (segid  A  and resid   65 and name   HN) (segid  A  and resid   65 and name HD21)
    or (segid  A  and resid   65 and name   HN) (segid  A  and resid   65 and name HD23)
assign (segid  A  and resid   65 and name   HN) (segid  A  and resid   66 and name   HN) 2.399 0.719 0.719 weight 1.000 ! spec=sumo...oesy, no=835, id=706, vol=1.506915e+01
assign (segid  A  and resid   65 and name   HN) (segid  A  and resid   62 and name   HA) 3.215 1.292 1.292 weight 1.000 ! spec=sumo...oesy, no=837, id=707, vol=2.601160e+00
assign (segid  A  and resid   50 and name  HD2) (segid  A  and resid   53 and name  HA1) 3.139 1.232 1.232 weight 1.000 ! spec=sumo...oesy, no=838, id=1601, vol=1.219560e+00
assign (segid  A  and resid   48 and name   HA) (segid  A  and resid   48 and name  HD1) 2.517 0.792 0.792 weight 1.000 ! spec=sumo...oesy, no=842, id=1604, vol=4.591560e+00
assign (segid  A  and resid   48 and name  HD1) (segid  A  and resid   48 and name  HB2) 2.793 0.975 0.975 weight 1.000 ! spec=sumo...oesy, no=844, id=1606, vol=2.458220e+00
assign (segid  A  and resid   45 and name   HA) (segid  A  and resid   45 and name  HD2) 2.422 0.733 0.733 weight 1.000 ! spec=sumo...oesy, no=845, id=1607, vol=5.783680e+00
    or (segid  A  and resid   45 and name   HA) (segid  A  and resid   45 and name  HD1)
assign (segid  A  and resid   15 and name   HN) (segid  A  and resid   13 and name   HN) 3.542 1.568 1.568 weight 1.000 ! spec=sumo...oesy, no=846, id=716, vol=1.454970e+00
assign (segid  A  and resid   45 and name  HD2) (segid  A  and resid   45 and name  HB1) 2.195 0.602 0.602 weight 1.000 ! spec=sumo...oesy, no=847, id=1608, vol=1.042814e+01
    or (segid  A  and resid   45 and name  HD1) (segid  A  and resid   45 and name  HB1)
assign (segid  A  and resid   25 and name   HE) (segid  A  and resid   25 and name  HD2) 3.099 1.201 1.201 weight 1.000 ! spec=sumo...oesy, no=848, id=1609, vol=1.315700e+00
assign (segid  A  and resid   15 and name   HN) (segid  A  and resid   15 and name   HA) 2.460 0.757 0.757 weight 1.000 ! spec=sumo...oesy, no=849, id=718, vol=1.294401e+01
assign (segid  A  and resid   15 and name   HN) (segid  A  and resid   14 and name   HA) 2.647 0.876 0.876 weight 1.000 ! spec=sumo...oesy, no=850, id=719, vol=8.354810e+00
assign (segid  A  and resid   48 and name   HA) (segid  A  and resid   48 and name  HD2) 2.601 0.846 0.846 weight 1.000 ! spec=sumo...oesy, no=852, id=1613, vol=3.766080e+00
assign (segid  A  and resid   15 and name   HN) (segid  A  and resid   15 and name  HB2) 2.580 0.832 0.832 weight 1.000 ! spec=sumo...oesy, no=853, id=722, vol=9.734800e+00
assign (segid  A  and resid   39 and name  HD2) (segid  A  and resid   39 and name  HB2) 2.522 0.795 0.795 weight 1.000 ! spec=sumo...oesy, no=854, id=1614, vol=4.532270e+00
assign (segid  A  and resid   15 and name   HN) (segid  A  and resid   14 and name  HB1) 2.993 1.119 1.119 weight 1.000 ! spec=sumo...oesy, no=855, id=724, vol=3.998570e+00
assign (segid  A  and resid   15 and name   HN) (segid  A  and resid   14 and name  HB2) 2.873 1.032 1.032 weight 1.000 ! spec=sumo...oesy, no=856, id=725, vol=5.105160e+00
assign (segid  A  and resid   39 and name  HD2) (segid  A  and resid   39 and name   HA) 2.537 0.804 0.804 weight 1.000 ! spec=sumo...oesy, no=857, id=1617, vol=4.377580e+00
assign (segid  A  and resid   64 and name   HN) (segid  A  and resid   63 and name   HN) 2.673 0.893 0.893 weight 1.000 ! spec=sumo...oesy, no=859, id=727, vol=7.864910e+00
assign (segid  A  and resid   39 and name  HD2) (segid  A  and resid   19 and name HG12) 2.420 0.732 0.732 weight 1.000 ! spec=sumo...oesy, no=860, id=1620, vol=5.812560e+00
    or (segid  A  and resid   39 and name  HD2) (segid  A  and resid   19 and name HG11)
    or (segid  A  and resid   39 and name  HD2) (segid  A  and resid   19 and name HG13)
assign (segid  A  and resid   63 and name   HN) (segid  A  and resid   61 and name   HA) 3.273 1.339 1.339 weight 1.000 ! spec=sumo...oesy, no=861, id=729, vol=2.334360e+00
assign (segid  A  and resid   63 and name   HN) (segid  A  and resid   26 and name   HA) 3.210 1.288 1.288 weight 1.000 ! spec=sumo...oesy, no=862, id=730, vol=2.625190e+00
assign (segid  A  and resid   63 and name   HN) (segid  A  and resid   61 and name   HB) 2.827 0.999 0.999 weight 1.000 ! spec=sumo...oesy, no=863, id=731, vol=5.626250e+00
assign (segid  A  and resid   63 and name   HN) (segid  A  and resid   62 and name   HA) 3.228 1.302 1.302 weight 1.000 ! spec=sumo...oesy, no=864, id=732, vol=2.539770e+00
assign (segid  A  and resid   63 and name   HN) (segid  A  and resid   63 and name   HA) 2.534 0.803 0.803 weight 1.000 ! spec=sumo...oesy, no=865, id=733, vol=1.084383e+01
assign (segid  A  and resid   48 and name  HD1) (segid  A  and resid   80 and name HG21) 2.596 0.842 0.842 weight 1.000 ! spec=sumo...oesy, no=866, id=1624, vol=3.814300e+00
    or (segid  A  and resid   48 and name  HD1) (segid  A  and resid   80 and name HG22)
    or (segid  A  and resid   48 and name  HD1) (segid  A  and resid   80 and name HG23)
assign (segid  A  and resid   63 and name   HN) (segid  A  and resid   25 and name   HA) 3.053 1.165 1.165 weight 1.000 ! spec=sumo...oesy, no=867, id=735, vol=3.546730e+00
assign (segid  A  and resid   50 and name  HD1) (segid  A  and resid   74 and name  HB2) 3.224 1.299 1.299 weight 1.000 ! spec=sumo...oesy, no=868, id=1625, vol=1.039280e+00
assign (segid  A  and resid   31 and name  HE1) (segid  A  and resid   31 and name  HB1) 3.074 1.181 1.181 weight 1.000 ! spec=sumo...oesy, no=870, id=1627, vol=1.382120e+00
assign (segid  A  and resid   63 and name   HN) (segid  A  and resid   62 and name  HB1) 2.887 1.042 1.042 weight 1.000 ! spec=sumo...oesy, no=871, id=739, vol=4.954980e+00
assign (segid  A  and resid   71 and name  HB1) (segid  A  and resid   67 and name   HA) 3.300 1.361 1.361 weight 1.000 ! spec=sumo...oesy, no=872, id=1629, vol=9.031500e-01
assign (segid  A  and resid   63 and name   HN) (segid  A  and resid   25 and name  HB2) 3.008 1.131 1.131 weight 1.000 ! spec=sumo...oesy, no=873, id=741, vol=3.879320e+00
assign (segid  A  and resid   76 and name   HA) (segid  A  and resid   76 and name  HB1) 2.398 0.719 0.719 weight 1.000 ! spec=sumo...oesy, no=875, id=1632, vol=6.137400e+00
assign (segid  A  and resid   51 and name  HD1) (segid  A  and resid   51 and name  HB1) 2.405 0.723 0.723 weight 1.000 ! spec=sumo...oesy, no=876, id=1633, vol=6.025800e+00
    or (segid  A  and resid   51 and name  HD2) (segid  A  and resid   51 and name  HB1)
assign (segid  A  and resid   17 and name   HN) (segid  A  and resid   13 and name   HN) 3.130 1.224 1.224 weight 1.000 ! spec=sumo...oesy, no=877, id=745, vol=3.056580e+00
assign (segid  A  and resid   18 and name   HN) (segid  A  and resid   17 and name   HN) 3.029 1.147 1.147 weight 1.000 ! spec=sumo...oesy, no=878, id=746, vol=3.717630e+00
assign (segid  A  and resid   15 and name   HN) (segid  A  and resid   17 and name   HN) 2.818 0.992 0.992 weight 1.000 ! spec=sumo...oesy, no=879, id=747, vol=5.737350e+00
assign (segid  A  and resid   76 and name  HB1) (segid  A  and resid   80 and name HG21) 2.737 0.936 0.936 weight 1.000 ! spec=sumo...oesy, no=880, id=1637, vol=2.776810e+00
    or (segid  A  and resid   76 and name  HB1) (segid  A  and resid   80 and name HG22)
    or (segid  A  and resid   76 and name  HB1) (segid  A  and resid   80 and name HG23)
assign (segid  A  and resid   51 and name  HB1) (segid  A  and resid   56 and name HD12) 2.536 0.804 0.804 weight 1.000 ! spec=sumo...oesy, no=881, id=1638, vol=4.380640e+00
    or (segid  A  and resid   51 and name  HB1) (segid  A  and resid   56 and name HD11)
    or (segid  A  and resid   51 and name  HB1) (segid  A  and resid   56 and name HD13)
assign (segid  A  and resid   17 and name   HN) (segid  A  and resid   12 and name   HA) 3.529 1.556 1.556 weight 1.000 ! spec=sumo...oesy, no=882, id=749, vol=1.487520e+00
assign (segid  A  and resid   17 and name   HN) (segid  A  and resid   13 and name  HA1) 3.272 1.338 1.338 weight 1.000 ! spec=sumo...oesy, no=883, id=750, vol=2.339540e+00
assign (segid  A  and resid   17 and name   HN) (segid  A  and resid   17 and name   HA) 2.361 0.697 0.697 weight 1.000 ! spec=sumo...oesy, no=884, id=751, vol=1.659605e+01
assign (segid  A  and resid   56 and name   HA) (segid  A  and resid   60 and name  HB1) 3.454 1.491 1.491 weight 1.000 ! spec=sumo...oesy, no=886, id=1641, vol=6.873700e-01
assign (segid  A  and resid   17 and name   HN) (segid  A  and resid   15 and name  HB1) 3.667 1.681 1.681 weight 1.000 ! spec=sumo...oesy, no=887, id=754, vol=1.181210e+00
assign (segid  A  and resid   17 and name   HN) (segid  A  and resid   15 and name  HB2) 3.557 1.581 1.581 weight 1.000 ! spec=sumo...oesy, no=888, id=755, vol=1.418120e+00
assign (segid  A  and resid   17 and name   HN) (segid  A  and resid   18 and name HG12) 3.420 1.462 1.462 weight 1.000 ! spec=sumo...oesy, no=889, id=756, vol=1.794500e+00
    or (segid  A  and resid   17 and name   HN) (segid  A  and resid   18 and name HG11)
    or (segid  A  and resid   17 and name   HN) (segid  A  and resid   18 and name HG13)
assign (segid  A  and resid   60 and name  HB1) (segid  A  and resid   60 and name  HB2) 2.328 0.678 0.678 weight 1.000 ! spec=sumo...oesy, no=890, id=1643, vol=7.322280e+00
assign (segid  A  and resid   51 and name  HB2) (segid  A  and resid   54 and name  HB1) 3.061 1.171 1.171 weight 1.000 ! spec=sumo...oesy, no=894, id=1646, vol=1.416860e+00
assign (segid  A  and resid   51 and name  HB2) (segid  A  and resid   56 and name HD12) 2.674 0.893 0.893 weight 1.000 ! spec=sumo...oesy, no=895, id=1647, vol=3.193370e+00
    or (segid  A  and resid   51 and name  HB2) (segid  A  and resid   56 and name HD11)
    or (segid  A  and resid   51 and name  HB2) (segid  A  and resid   56 and name HD13)
assign (segid  A  and resid   51 and name  HD1) (segid  A  and resid   51 and name  HB2) 2.453 0.752 0.752 weight 1.000 ! spec=sumo...oesy, no=896, id=1648, vol=5.358870e+00
    or (segid  A  and resid   51 and name  HD2) (segid  A  and resid   51 and name  HB2)
assign (segid  A  and resid   67 and name   HN) (segid  A  and resid   66 and name   HA) 2.538 0.805 0.805 weight 1.000 ! spec=sumo...oesy, no=897, id=761, vol=1.073837e+01
assign (segid  A  and resid   67 and name   HN) (segid  A  and resid   66 and name  HB1) 3.683 1.695 1.695 weight 1.000 ! spec=sumo...oesy, no=898, id=762, vol=1.151520e+00
assign (segid  A  and resid   76 and name   HA) (segid  A  and resid   76 and name  HB2) 2.496 0.779 0.779 weight 1.000 ! spec=sumo...oesy, no=899, id=1651, vol=4.821040e+00
assign (segid  A  and resid   67 and name   HN) (segid  A  and resid   67 and name  HB1) 2.760 0.952 0.952 weight 1.000 ! spec=sumo...oesy, no=900, id=764, vol=6.495840e+00
assign (segid  A  and resid   69 and name  HB1) (segid  A  and resid    7 and name HD12) 3.206 1.285 1.285 weight 1.000 ! spec=sumo...oesy, no=904, id=1656, vol=1.074540e+00
    or (segid  A  and resid   69 and name  HB1) (segid  A  and resid    7 and name HD11)
    or (segid  A  and resid   69 and name  HB1) (segid  A  and resid    7 and name HD13)
assign (segid  A  and resid   69 and name  HB2) (segid  A  and resid   69 and name   HA) 2.269 0.644 0.644 weight 1.000 ! spec=sumo...oesy, no=905, id=1657, vol=8.536270e+00
assign (segid  A  and resid   67 and name   HN) (segid  A  and resid   63 and name   HA) 3.359 1.410 1.410 weight 1.000 ! spec=sumo...oesy, no=908, id=768, vol=2.000050e+00
assign (segid  A  and resid   71 and name  HB1) (segid  A  and resid   67 and name  HB2) 3.403 1.447 1.447 weight 1.000 ! spec=sumo...oesy, no=909, id=1661, vol=7.513400e-01
assign (segid  A  and resid   70 and name   HN) (segid  A  and resid    9 and name   HA) 3.551 1.576 1.576 weight 1.000 ! spec=sumo...oesy, no=912, id=772, vol=1.432250e+00
assign (segid  A  and resid   70 and name   HN) (segid  A  and resid    7 and name HG11) 3.700 1.711 1.711 weight 1.000 ! spec=sumo...oesy, no=913, id=773, vol=1.119190e+00
assign (segid  A  and resid   22 and name  HE1) (segid  A  and resid    6 and name  HD2) 3.240 1.312 1.312 weight 1.000 ! spec=sumo...oesy, no=915, id=1667, vol=1.007500e+00
assign (segid  A  and resid   70 and name   HN) (segid  A  and resid   69 and name   HA) 2.478 0.767 0.767 weight 1.000 ! spec=sumo...oesy, no=917, id=776, vol=1.241530e+01
assign (segid  A  and resid   70 and name   HN) (segid  A  and resid   70 and name   HA) 2.451 0.751 0.751 weight 1.000 ! spec=sumo...oesy, no=918, id=777, vol=1.325071e+01
assign (segid  A  and resid   70 and name   HN) (segid  A  and resid   70 and name  HB1) 3.482 1.516 1.516 weight 1.000 ! spec=sumo...oesy, no=919, id=778, vol=1.610820e+00
assign (segid  A  and resid   70 and name   HN) (segid  A  and resid   70 and name  HB2) 3.208 1.286 1.286 weight 1.000 ! spec=sumo...oesy, no=920, id=779, vol=2.636970e+00
assign (segid  A  and resid   70 and name   HN) (segid  A  and resid   68 and name  HB1) 3.171 1.257 1.257 weight 1.000 ! spec=sumo...oesy, no=921, id=780, vol=2.824300e+00
assign (segid  A  and resid   70 and name   HN) (segid  A  and resid    9 and name HD12) 3.328 1.385 1.385 weight 1.000 ! spec=sumo...oesy, no=924, id=783, vol=2.112080e+00
    or (segid  A  and resid   70 and name   HN) (segid  A  and resid    9 and name HD11)
    or (segid  A  and resid   70 and name   HN) (segid  A  and resid    9 and name HD13)
assign (segid  A  and resid   57 and name HD21) (segid  A  and resid   57 and name  HB1) 3.075 1.182 1.182 weight 1.000 ! spec=sumo...oesy, no=931, id=786, vol=3.397290e+00
assign (segid  A  and resid   57 and name HD21) (segid  A  and resid   57 and name  HB2) 2.776 0.963 0.963 weight 1.000 ! spec=sumo...oesy, no=932, id=787, vol=6.279000e+00
assign (segid  A  and resid   57 and name HD21) (segid  A  and resid   57 and name   HA) 3.878 1.880 1.880 weight 1.000 ! spec=sumo...oesy, no=933, id=788, vol=8.444500e-01
assign (segid  A  and resid   15 and name  HB1) (segid  A  and resid   15 and name   HA) 2.377 0.706 0.706 weight 1.000 ! spec=sumo...oesy, no=934, id=1681, vol=6.472140e+00
assign (segid  A  and resid   57 and name HD21) (segid  A  and resid   57 and name HD22) 1.794 0.402 0.402 weight 1.000 ! spec=sumo...oesy, no=936, id=790, vol=8.615953e+01
assign (segid  A  and resid    8 and name   HA) (segid  A  and resid    8 and name  HB1) 2.406 0.724 0.724 weight 1.000 ! spec=sumo...oesy, no=938, id=1682, vol=6.006390e+00
assign (segid  A  and resid   57 and name HD22) (segid  A  and resid   57 and name  HB2) 2.861 1.023 1.023 weight 1.000 ! spec=sumo...oesy, no=939, id=792, vol=5.240080e+00
assign (segid  A  and resid   15 and name  HB2) (segid  A  and resid   15 and name   HA) 2.403 0.722 0.722 weight 1.000 ! spec=sumo...oesy, no=940, id=1684, vol=6.058510e+00
assign (segid  A  and resid   15 and name  HB2) (segid  A  and resid   15 and name  HB1) 2.141 0.573 0.573 weight 1.000 ! spec=sumo...oesy, no=941, id=1685, vol=1.212399e+01
assign (segid  A  and resid    8 and name   HA) (segid  A  and resid    8 and name  HB2) 2.334 0.681 0.681 weight 1.000 ! spec=sumo...oesy, no=942, id=1686, vol=7.207150e+00
assign (segid  A  and resid   74 and name  HB2) (segid  A  and resid   50 and name  HG1) 3.347 1.400 1.400 weight 1.000 ! spec=sumo...oesy, no=944, id=1687, vol=8.300100e-01
assign (segid  A  and resid   30 and name   HN) (segid  A  and resid   29 and name   HN) 2.624 0.861 0.861 weight 1.000 ! spec=sumo...oesy, no=945, id=796, vol=8.800400e+00
assign (segid  A  and resid   31 and name   HN) (segid  A  and resid   30 and name   HN) 2.634 0.867 0.867 weight 1.000 ! spec=sumo...oesy, no=947, id=797, vol=8.605910e+00
assign (segid  A  and resid   30 and name   HN) (segid  A  and resid   28 and name   HA) 3.035 1.151 1.151 weight 1.000 ! spec=sumo...oesy, no=948, id=798, vol=3.673690e+00
assign (segid  A  and resid   30 and name   HN) (segid  A  and resid   28 and name  HB1) 2.778 0.965 0.965 weight 1.000 ! spec=sumo...oesy, no=951, id=801, vol=6.243060e+00
assign (segid  A  and resid   30 and name   HN) (segid  A  and resid   28 and name  HB2) 2.499 0.781 0.781 weight 1.000 ! spec=sumo...oesy, no=952, id=802, vol=1.179124e+01
assign (segid  A  and resid   30 and name   HN) (segid  A  and resid   29 and name  HB2) 2.914 1.062 1.062 weight 1.000 ! spec=sumo...oesy, no=953, id=803, vol=4.686700e+00
assign (segid  A  and resid   30 and name   HN) (segid  A  and resid   29 and name  HB1) 3.400 1.445 1.445 weight 1.000 ! spec=sumo...oesy, no=955, id=805, vol=1.859670e+00
assign (segid  A  and resid   80 and name   HN) (segid  A  and resid   79 and name   HA) 2.558 0.818 0.818 weight 1.000 ! spec=sumo...oesy, no=964, id=807, vol=1.023903e+01
assign (segid  A  and resid   80 and name   HN) (segid  A  and resid   79 and name  HB2) 3.548 1.574 1.574 weight 1.000 ! spec=sumo...oesy, no=966, id=809, vol=1.438990e+00
assign (segid  A  and resid   80 and name   HN) (segid  A  and resid   80 and name   HB) 3.475 1.509 1.509 weight 1.000 ! spec=sumo...oesy, no=967, id=810, vol=1.630850e+00
assign (segid  A  and resid   80 and name   HN) (segid  A  and resid   79 and name  HB1) 3.507 1.537 1.537 weight 1.000 ! spec=sumo...oesy, no=968, id=811, vol=1.544410e+00
assign (segid  A  and resid   80 and name   HN) (segid  A  and resid   80 and name HG21) 3.376 1.424 1.424 weight 1.000 ! spec=sumo...oesy, no=969, id=812, vol=1.941410e+00
    or (segid  A  and resid   80 and name   HN) (segid  A  and resid   80 and name HG22)
    or (segid  A  and resid   80 and name   HN) (segid  A  and resid   80 and name HG23)
assign (segid  A  and resid   46 and name   HN) (segid  A  and resid   43 and name   HN) 3.403 1.448 1.448 weight 1.000 ! spec=sumo...oesy, no=970, id=813, vol=1.847650e+00
assign (segid  A  and resid   46 and name   HN) (segid  A  and resid   45 and name   HN) 2.540 0.807 0.807 weight 1.000 ! spec=sumo...oesy, no=971, id=814, vol=1.068943e+01
assign (segid  A  and resid   51 and name  HD1) (segid  A  and resid   52 and name  HB2) 2.927 1.071 1.071 weight 1.000 ! spec=sumo...oesy, no=972, id=1690, vol=1.854940e+00
    or (segid  A  and resid   51 and name  HD2) (segid  A  and resid   52 and name  HB2)
assign (segid  A  and resid   46 and name   HN) (segid  A  and resid   47 and name   HN) 2.219 0.615 0.615 weight 1.000 ! spec=sumo...oesy, no=973, id=815, vol=2.407602e+01
assign (segid  A  and resid   52 and name  HB1) (segid  A  and resid   52 and name  HB2) 1.802 0.406 0.406 weight 1.000 ! spec=sumo...oesy, no=974, id=1692, vol=3.407515e+01
assign (segid  A  and resid   46 and name   HN) (segid  A  and resid   46 and name   HA) 2.518 0.793 0.793 weight 1.000 ! spec=sumo...oesy, no=975, id=817, vol=1.126416e+01
assign (segid  A  and resid   50 and name  HB1) (segid  A  and resid   50 and name  HG2) 2.528 0.799 0.799 weight 1.000 ! spec=sumo...oesy, no=977, id=1693, vol=4.472520e+00
assign (segid  A  and resid   46 and name   HN) (segid  A  and resid   43 and name  HB2) 3.107 1.207 1.207 weight 1.000 ! spec=sumo...oesy, no=978, id=820, vol=3.193500e+00
assign (segid  A  and resid   50 and name   HA) (segid  A  and resid   50 and name  HB1) 2.671 0.892 0.892 weight 1.000 ! spec=sumo...oesy, no=979, id=1695, vol=3.210030e+00
assign (segid  A  and resid   46 and name   HN) (segid  A  and resid   46 and name  HB1) 2.434 0.741 0.741 weight 1.000 ! spec=sumo...oesy, no=980, id=822, vol=1.380698e+01
assign (segid  A  and resid   46 and name   HN) (segid  A  and resid   45 and name  HB1) 3.073 1.180 1.180 weight 1.000 ! spec=sumo...oesy, no=981, id=823, vol=3.409770e+00
assign (segid  A  and resid   46 and name   HN) (segid  A  and resid   45 and name  HB2) 3.084 1.189 1.189 weight 1.000 ! spec=sumo...oesy, no=982, id=824, vol=3.338700e+00
assign (segid  A  and resid   46 and name   HN) (segid  A  and resid   47 and name HG22) 3.005 1.129 1.129 weight 1.000 ! spec=sumo...oesy, no=984, id=826, vol=3.900900e+00
    or (segid  A  and resid   46 and name   HN) (segid  A  and resid   47 and name HG21)
    or (segid  A  and resid   46 and name   HN) (segid  A  and resid   47 and name HG23)
assign (segid  A  and resid   46 and name   HN) (segid  A  and resid   44 and name   HN) 3.875 1.877 1.877 weight 1.000 ! spec=sumo...oesy, no=986, id=828, vol=8.486600e-01
assign (segid  A  and resid   47 and name   HN) (segid  A  and resid   45 and name   HN) 3.204 1.283 1.283 weight 1.000 ! spec=sumo...oesy, no=991, id=830, vol=2.654420e+00
assign (segid  A  and resid   10 and name  HB1) (segid  A  and resid   72 and name   HB) 3.186 1.269 1.269 weight 1.000 ! spec=sumo...oesy, no=993, id=1708, vol=1.115670e+00
assign (segid  A  and resid   10 and name  HB1) (segid  A  and resid   10 and name  HE1) 2.817 0.992 0.992 weight 1.000 ! spec=sumo...oesy, no=994, id=1709, vol=2.332660e+00
assign (segid  A  and resid   62 and name   HA) (segid  A  and resid   67 and name  HB1) 2.551 0.814 0.814 weight 1.000 ! spec=sumo...oesy, no=995, id=1710, vol=4.227660e+00
assign (segid  A  and resid   67 and name  HB1) (segid  A  and resid   67 and name  HB2) 2.273 0.646 0.646 weight 1.000 ! spec=sumo...oesy, no=996, id=1711, vol=8.446790e+00
assign (segid  A  and resid   67 and name  HB1) (segid  A  and resid    9 and name HD12) 2.771 0.960 0.960 weight 1.000 ! spec=sumo...oesy, no=997, id=1712, vol=2.578500e+00
    or (segid  A  and resid   67 and name  HB1) (segid  A  and resid    9 and name HD11)
    or (segid  A  and resid   67 and name  HB1) (segid  A  and resid    9 and name HD13)
assign (segid  A  and resid   67 and name  HB1) (segid  A  and resid    9 and name HD22) 3.310 1.369 1.369 weight 1.000 ! spec=sumo...oesy, no=998, id=1713, vol=8.868100e-01
    or (segid  A  and resid   67 and name  HB1) (segid  A  and resid    9 and name HD21)
    or (segid  A  and resid   67 and name  HB1) (segid  A  and resid    9 and name HD23)
assign (segid  A  and resid   67 and name  HB1) (segid  A  and resid    7 and name HD12) 2.727 0.930 0.930 weight 1.000 ! spec=sumo...oesy, no=999, id=1714, vol=2.836060e+00
    or (segid  A  and resid   67 and name  HB1) (segid  A  and resid    7 and name HD11)
    or (segid  A  and resid   67 and name  HB1) (segid  A  and resid    7 and name HD13)
assign (segid  A  and resid   47 and name   HN) (segid  A  and resid   46 and name  HB1) 2.801 0.981 0.981 weight 1.000 ! spec=sumo...oesy, no=1000, id=837, vol=5.945790e+00
assign (segid  A  and resid   67 and name   HA) (segid  A  and resid   67 and name  HB2) 2.665 0.888 0.888 weight 1.000 ! spec=sumo...oesy, no=1001, id=1715, vol=3.252970e+00
assign (segid  A  and resid   47 and name   HN) (segid  A  and resid   47 and name   HB) 2.462 0.757 0.757 weight 1.000 ! spec=sumo...oesy, no=1002, id=839, vol=1.290476e+01
assign (segid  A  and resid   47 and name   HN) (segid  A  and resid   47 and name HG22) 2.201 0.606 0.606 weight 1.000 ! spec=sumo...oesy, no=1003, id=840, vol=2.523114e+01
    or (segid  A  and resid   47 and name   HN) (segid  A  and resid   47 and name HG21)
    or (segid  A  and resid   47 and name   HN) (segid  A  and resid   47 and name HG23)
assign (segid  A  and resid   10 and name  HB1) (segid  A  and resid   10 and name  HB2) 2.102 0.552 0.552 weight 1.000 ! spec=sumo...oesy, no=1004, id=1718, vol=1.351785e+01
assign (segid  A  and resid   10 and name  HB1) (segid  A  and resid   72 and name HG21) 2.689 0.904 0.904 weight 1.000 ! spec=sumo...oesy, no=1005, id=1719, vol=3.088190e+00
    or (segid  A  and resid   10 and name  HB1) (segid  A  and resid   72 and name HG22)
    or (segid  A  and resid   10 and name  HB1) (segid  A  and resid   72 and name HG23)
assign (segid  A  and resid   10 and name  HB2) (segid  A  and resid   72 and name HG21) 2.971 1.103 1.103 weight 1.000 ! spec=sumo...oesy, no=1010, id=1723, vol=1.697110e+00
    or (segid  A  and resid   10 and name  HB2) (segid  A  and resid   72 and name HG22)
    or (segid  A  and resid   10 and name  HB2) (segid  A  and resid   72 and name HG23)
assign (segid  A  and resid   10 and name  HB2) (segid  A  and resid   18 and name HG22) 2.458 0.755 0.755 weight 1.000 ! spec=sumo...oesy, no=1011, id=1724, vol=5.293720e+00
    or (segid  A  and resid   10 and name  HB2) (segid  A  and resid   18 and name HG21)
    or (segid  A  and resid   10 and name  HB2) (segid  A  and resid   18 and name HG23)
assign (segid  A  and resid   75 and name   HB) (segid  A  and resid   36 and name  HE1) 3.285 1.349 1.349 weight 1.000 ! spec=sumo...oesy, no=1014, id=1727, vol=9.283300e-01
    or (segid  A  and resid   75 and name   HB) (segid  A  and resid   36 and name  HE2)
assign (segid  A  and resid   43 and name   HN) (segid  A  and resid   43 and name  HB1) 2.452 0.751 0.751 weight 1.000 ! spec=sumo...oesy, no=1015, id=845, vol=1.321799e+01
assign (segid  A  and resid   75 and name   HA) (segid  A  and resid   75 and name   HB) 2.440 0.744 0.744 weight 1.000 ! spec=sumo...oesy, no=1016, id=1729, vol=5.525870e+00
assign (segid  A  and resid   13 and name  HA1) (segid  A  and resid   75 and name   HB) 2.780 0.966 0.966 weight 1.000 ! spec=sumo...oesy, no=1017, id=1730, vol=2.525370e+00
assign (segid  A  and resid   75 and name   HB) (segid  A  and resid   13 and name  HA2) 2.944 1.084 1.084 weight 1.000 ! spec=sumo...oesy, no=1018, id=1731, vol=1.789450e+00
assign (segid  A  and resid   43 and name   HN) (segid  A  and resid   42 and name  HB1) 2.558 0.818 0.818 weight 1.000 ! spec=sumo...oesy, no=1019, id=849, vol=1.025453e+01
assign (segid  A  and resid   43 and name   HN) (segid  A  and resid   42 and name  HB2) 2.575 0.829 0.829 weight 1.000 ! spec=sumo...oesy, no=1020, id=850, vol=9.850650e+00
assign (segid  A  and resid   43 and name   HN) (segid  A  and resid   47 and name HG22) 3.593 1.614 1.614 weight 1.000 ! spec=sumo...oesy, no=1021, id=851, vol=1.335140e+00
    or (segid  A  and resid   43 and name   HN) (segid  A  and resid   47 and name HG21)
    or (segid  A  and resid   43 and name   HN) (segid  A  and resid   47 and name HG23)
assign (segid  A  and resid   67 and name  HB2) (segid  A  and resid    9 and name HD22) 3.365 1.415 1.415 weight 1.000 ! spec=sumo...oesy, no=1025, id=1737, vol=8.035400e-01
    or (segid  A  and resid   67 and name  HB2) (segid  A  and resid    9 and name HD21)
    or (segid  A  and resid   67 and name  HB2) (segid  A  and resid    9 and name HD23)
assign (segid  A  and resid    8 and name   HA) (segid  A  and resid   22 and name  HB1) 3.092 1.195 1.195 weight 1.000 ! spec=sumo...oesy, no=1027, id=1739, vol=1.333420e+00
assign (segid  A  and resid   22 and name   HA) (segid  A  and resid   22 and name  HB1) 2.397 0.718 0.718 weight 1.000 ! spec=sumo...oesy, no=1028, id=1740, vol=6.149620e+00
assign (segid  A  and resid   22 and name  HE1) (segid  A  and resid   22 and name  HB1) 2.829 1.000 1.000 weight 1.000 ! spec=sumo...oesy, no=1029, id=1741, vol=2.277280e+00
assign (segid  A  and resid   22 and name  HB1) (segid  A  and resid   22 and name  HG1) 2.458 0.755 0.755 weight 1.000 ! spec=sumo...oesy, no=1030, id=1742, vol=5.291270e+00
assign (segid  A  and resid   22 and name  HB1) (segid  A  and resid   22 and name  HG2) 2.556 0.817 0.817 weight 1.000 ! spec=sumo...oesy, no=1031, id=1743, vol=4.181020e+00
assign (segid  A  and resid    6 and name  HB2) (segid  A  and resid   22 and name  HB2) 3.266 1.334 1.334 weight 1.000 ! spec=sumo...oesy, no=1032, id=1744, vol=9.602100e-01
assign (segid  A  and resid   22 and name  HE1) (segid  A  and resid   22 and name  HB2) 2.868 1.028 1.028 weight 1.000 ! spec=sumo...oesy, no=1033, id=1745, vol=2.097690e+00
assign (segid  A  and resid   22 and name  HB2) (segid  A  and resid   22 and name  HG2) 2.507 0.786 0.786 weight 1.000 ! spec=sumo...oesy, no=1035, id=1747, vol=4.697780e+00
assign (segid  A  and resid   44 and name   HN) (segid  A  and resid   45 and name   HN) 2.814 0.990 0.990 weight 1.000 ! spec=sumo...oesy, no=1036, id=856, vol=5.785830e+00
assign (segid  A  and resid   67 and name   HA) (segid  A  and resid   67 and name  HG2) 2.490 0.775 0.775 weight 1.000 ! spec=sumo...oesy, no=1038, id=1749, vol=4.893390e+00
assign (segid  A  and resid   48 and name  HB2) (segid  A  and resid   80 and name HG21) 2.713 0.920 0.920 weight 1.000 ! spec=sumo...oesy, no=1039, id=1750, vol=2.921550e+00
    or (segid  A  and resid   48 and name  HB2) (segid  A  and resid   80 and name HG22)
    or (segid  A  and resid   48 and name  HB2) (segid  A  and resid   80 and name HG23)
assign (segid  A  and resid   45 and name   HN) (segid  A  and resid   43 and name  HB1) 3.316 1.374 1.374 weight 1.000 ! spec=sumo...oesy, no=1041, id=860, vol=2.161500e+00
assign (segid  A  and resid   45 and name   HN) (segid  A  and resid   43 and name  HB2) 3.222 1.298 1.298 weight 1.000 ! spec=sumo...oesy, no=1042, id=861, vol=2.564550e+00
assign (segid  A  and resid   45 and name   HN) (segid  A  and resid   45 and name  HD2) 3.262 1.330 1.330 weight 1.000 ! spec=sumo...oesy, no=1043, id=862, vol=2.381980e+00
    or (segid  A  and resid   45 and name   HN) (segid  A  and resid   45 and name  HD1)
assign (segid  A  and resid   68 and name  HB2) (segid  A  and resid   68 and name  HG1) 2.385 0.711 0.711 weight 1.000 ! spec=sumo...oesy, no=1044, id=1752, vol=6.338540e+00
assign (segid  A  and resid   68 and name  HB2) (segid  A  and resid   68 and name  HG2) 2.532 0.801 0.801 weight 1.000 ! spec=sumo...oesy, no=1045, id=1753, vol=4.426250e+00
assign (segid  A  and resid   68 and name  HB2) (segid  A  and resid   68 and name  HB1) 1.956 0.478 0.478 weight 1.000 ! spec=sumo...oesy, no=1046, id=1754, vol=2.084192e+01
assign (segid  A  and resid   48 and name   HA) (segid  A  and resid   48 and name  HB1) 2.554 0.815 0.815 weight 1.000 ! spec=sumo...oesy, no=1047, id=1755, vol=4.202680e+00
assign (segid  A  and resid   48 and name  HB1) (segid  A  and resid   48 and name  HD2) 2.727 0.930 0.930 weight 1.000 ! spec=sumo...oesy, no=1048, id=1756, vol=2.832730e+00
assign (segid  A  and resid   48 and name  HD1) (segid  A  and resid   48 and name  HB1) 2.594 0.841 0.841 weight 1.000 ! spec=sumo...oesy, no=1051, id=1758, vol=3.827390e+00
assign (segid  A  and resid   66 and name   HN) (segid  A  and resid   63 and name   HA) 2.844 1.011 1.011 weight 1.000 ! spec=sumo...oesy, no=1053, id=871, vol=5.429070e+00
assign (segid  A  and resid   66 and name   HN) (segid  A  and resid   66 and name   HA) 2.134 0.569 0.569 weight 1.000 ! spec=sumo...oesy, no=1054, id=872, vol=3.040433e+01
assign (segid  A  and resid   66 and name   HN) (segid  A  and resid   66 and name  HB1) 2.972 1.104 1.104 weight 1.000 ! spec=sumo...oesy, no=1055, id=873, vol=4.169500e+00
assign (segid  A  and resid   67 and name  HG2) (segid  A  and resid   51 and name  HD1) 2.914 1.061 1.061 weight 1.000 ! spec=sumo...oesy, no=1059, id=1766, vol=1.904660e+00
    or (segid  A  and resid   67 and name  HG2) (segid  A  and resid   51 and name  HD2)
assign (segid  A  and resid   66 and name   HN) (segid  A  and resid   65 and name HD22) 3.409 1.452 1.452 weight 1.000 ! spec=sumo...oesy, no=1060, id=878, vol=1.830750e+00
    or (segid  A  and resid   66 and name   HN) (segid  A  and resid   65 and name HD21)
    or (segid  A  and resid   66 and name   HN) (segid  A  and resid   65 and name HD23)
assign (segid  A  and resid   66 and name   HN) (segid  A  and resid   65 and name HD12) 3.656 1.670 1.670 weight 1.000 ! spec=sumo...oesy, no=1061, id=879, vol=1.203270e+00
    or (segid  A  and resid   66 and name   HN) (segid  A  and resid   65 and name HD11)
    or (segid  A  and resid   66 and name   HN) (segid  A  and resid   65 and name HD13)
assign (segid  A  and resid   66 and name   HN) (segid  A  and resid   65 and name  HB1) 2.999 1.124 1.124 weight 1.000 ! spec=sumo...oesy, no=1063, id=881, vol=3.950980e+00
assign (segid  A  and resid   48 and name  HD2) (segid  A  and resid   48 and name  HB2) 2.885 1.040 1.040 weight 1.000 ! spec=sumo...oesy, no=1067, id=1774, vol=2.022590e+00
assign (segid  A  and resid   48 and name  HB1) (segid  A  and resid   48 and name  HB2) 1.983 0.492 0.492 weight 1.000 ! spec=sumo...oesy, no=1068, id=1775, vol=1.916428e+01
assign (segid  A  and resid   11 and name   HB) (segid  A  and resid   21 and name  HD1) 2.760 0.952 0.952 weight 1.000 ! spec=sumo...oesy, no=1070, id=1777, vol=2.640040e+00
    or (segid  A  and resid   11 and name   HB) (segid  A  and resid   21 and name  HD2)
assign (segid  A  and resid   49 and name  HD1) (segid  A  and resid   11 and name   HB) 2.782 0.968 0.968 weight 1.000 ! spec=sumo...oesy, no=1071, id=1778, vol=2.514090e+00
    or (segid  A  and resid   49 and name  HD2) (segid  A  and resid   11 and name   HB)
assign (segid  A  and resid   14 and name HE22) (segid  A  and resid   79 and name HE21) 3.741 1.749 1.749 weight 1.000 ! spec=sumo...oesy, no=1072, id=882, vol=1.047790e+00
assign (segid  A  and resid   14 and name HE22) (segid  A  and resid   76 and name  HD1) 3.535 1.562 1.562 weight 1.000 ! spec=sumo...oesy, no=1073, id=883, vol=1.471670e+00
    or (segid  A  and resid   14 and name HE22) (segid  A  and resid   76 and name  HD2)
assign (segid  A  and resid   14 and name HE21) (segid  A  and resid   14 and name HE22) 1.683 0.354 0.354 weight 1.000 ! spec=sumo...oesy, no=1080, id=886, vol=1.261523e+02
assign (segid  A  and resid   55 and name   HA) (segid  A  and resid   55 and name  HB2) 2.478 0.767 0.767 weight 1.000 ! spec=sumo...oesy, no=1085, id=1791, vol=5.038730e+00
assign (segid  A  and resid   72 and name   HN) (segid  A  and resid   51 and name  HD1) 2.961 1.096 1.096 weight 1.000 ! spec=sumo...oesy, no=1086, id=890, vol=4.258490e+00
    or (segid  A  and resid   72 and name   HN) (segid  A  and resid   51 and name  HD2)
assign (segid  A  and resid   55 and name  HB2) (segid  A  and resid   55 and name  HB1) 1.985 0.493 0.493 weight 1.000 ! spec=sumo...oesy, no=1087, id=1792, vol=1.906718e+01
assign (segid  A  and resid   55 and name  HB2) (segid  A  and resid   55 and name  HG1) 2.353 0.692 0.692 weight 1.000 ! spec=sumo...oesy, no=1088, id=1793, vol=6.877100e+00
assign (segid  A  and resid   71 and name   HN) (segid  A  and resid   72 and name   HN) 3.185 1.268 1.268 weight 1.000 ! spec=sumo...oesy, no=1089, id=892, vol=2.749540e+00
assign (segid  A  and resid   55 and name  HB2) (segid  A  and resid   50 and name  HG1) 3.332 1.388 1.388 weight 1.000 ! spec=sumo...oesy, no=1090, id=1794, vol=8.525400e-01
assign (segid  A  and resid   72 and name   HN) (segid  A  and resid   71 and name   HA) 2.159 0.583 0.583 weight 1.000 ! spec=sumo...oesy, no=1091, id=894, vol=2.836313e+01
assign (segid  A  and resid   72 and name   HN) (segid  A  and resid   72 and name   HB) 2.374 0.705 0.705 weight 1.000 ! spec=sumo...oesy, no=1092, id=895, vol=1.603719e+01
assign (segid  A  and resid   72 and name   HN) (segid  A  and resid   71 and name  HB1) 2.895 1.047 1.047 weight 1.000 ! spec=sumo...oesy, no=1093, id=896, vol=4.880930e+00
assign (segid  A  and resid   72 and name   HN) (segid  A  and resid   71 and name  HB2) 2.699 0.911 0.911 weight 1.000 ! spec=sumo...oesy, no=1094, id=897, vol=7.430920e+00
assign (segid  A  and resid   72 and name   HN) (segid  A  and resid   72 and name HG21) 2.882 1.038 1.038 weight 1.000 ! spec=sumo...oesy, no=1095, id=898, vol=5.016650e+00
    or (segid  A  and resid   72 and name   HN) (segid  A  and resid   72 and name HG22)
    or (segid  A  and resid   72 and name   HN) (segid  A  and resid   72 and name HG23)
assign (segid  A  and resid   14 and name HE21) (segid  A  and resid   14 and name  HB2) 3.763 1.770 1.770 weight 1.000 ! spec=sumo...oesy, no=1098, id=900, vol=1.011950e+00
assign (segid  A  and resid   14 and name HE21) (segid  A  and resid   14 and name   HA) 3.825 1.829 1.829 weight 1.000 ! spec=sumo...oesy, no=1099, id=901, vol=9.166300e-01
assign (segid  A  and resid   24 and name  HB2) (segid  A  and resid   24 and name  HE1) 3.039 1.154 1.154 weight 1.000 ! spec=sumo...oesy, no=1100, id=1797, vol=1.481680e+00
assign (segid  A  and resid   31 and name  HB2) (segid  A  and resid   31 and name  HE1) 3.027 1.145 1.145 weight 1.000 ! spec=sumo...oesy, no=1103, id=1798, vol=1.516280e+00
assign (segid  A  and resid   39 and name   HN) (segid  A  and resid   40 and name   HN) 2.415 0.729 0.729 weight 1.000 ! spec=sumo...oesy, no=1112, id=904, vol=1.449104e+01
assign (segid  A  and resid   49 and name  HD1) (segid  A  and resid   33 and name  HG2) 3.257 1.326 1.326 weight 1.000 ! spec=sumo...oesy, no=1114, id=1801, vol=9.765900e-01
    or (segid  A  and resid   49 and name  HD2) (segid  A  and resid   33 and name  HG2)
assign (segid  A  and resid   33 and name  HG1) (segid  A  and resid   33 and name  HG2) 2.338 0.683 0.683 weight 1.000 ! spec=sumo...oesy, no=1115, id=1802, vol=7.137350e+00
assign (segid  A  and resid   40 and name   HN) (segid  A  and resid   40 and name   HA) 2.598 0.844 0.844 weight 1.000 ! spec=sumo...oesy, no=1116, id=907, vol=9.341890e+00
assign (segid  A  and resid   49 and name  HE1) (segid  A  and resid   33 and name  HG2) 3.315 1.373 1.373 weight 1.000 ! spec=sumo...oesy, no=1117, id=1804, vol=8.793200e-01
    or (segid  A  and resid   49 and name  HE2) (segid  A  and resid   33 and name  HG2)
assign (segid  A  and resid   33 and name  HG2) (segid  A  and resid   30 and name   HA) 3.262 1.330 1.330 weight 1.000 ! spec=sumo...oesy, no=1118, id=1805, vol=9.682000e-01
assign (segid  A  and resid   40 and name   HN) (segid  A  and resid   37 and name   HA) 3.256 1.325 1.325 weight 1.000 ! spec=sumo...oesy, no=1119, id=910, vol=2.412270e+00
assign (segid  A  and resid   40 and name   HN) (segid  A  and resid   39 and name  HB1) 2.437 0.742 0.742 weight 1.000 ! spec=sumo...oesy, no=1121, id=912, vol=1.372449e+01
assign (segid  A  and resid   20 and name  HB1) (segid  A  and resid   20 and name  HB2) 1.808 0.409 0.409 weight 1.000 ! spec=sumo...oesy, no=1123, id=1810, vol=3.334503e+01
assign (segid  A  and resid   40 and name   HN) (segid  A  and resid   40 and name  HB2) 2.462 0.758 0.758 weight 1.000 ! spec=sumo...oesy, no=1124, id=915, vol=1.288631e+01
assign (segid  A  and resid    4 and name HD21) (segid  A  and resid    4 and name HD22) 1.869 0.437 0.437 weight 1.000 ! spec=sumo...oesy, no=1127, id=917, vol=6.735262e+01
assign (segid  A  and resid    4 and name HD21) (segid  A  and resid    4 and name  HB1) 3.072 1.180 1.180 weight 1.000 ! spec=sumo...oesy, no=1128, id=918, vol=3.418190e+00
assign (segid  A  and resid    4 and name HD21) (segid  A  and resid    4 and name  HB2) 3.080 1.186 1.186 weight 1.000 ! spec=sumo...oesy, no=1129, id=919, vol=3.361490e+00
assign (segid  A  and resid   25 and name  HB1) (segid  A  and resid   63 and name  HB2) 2.902 1.053 1.053 weight 1.000 ! spec=sumo...oesy, no=1131, id=1813, vol=1.952770e+00
    or (segid  A  and resid   25 and name  HB1) (segid  A  and resid   63 and name  HB1)
    or (segid  A  and resid   25 and name  HB1) (segid  A  and resid   63 and name  HB3)
assign (segid  A  and resid   40 and name  HB2) (segid  A  and resid   37 and name   HA) 3.232 1.306 1.306 weight 1.000 ! spec=sumo...oesy, no=1134, id=1816, vol=1.023110e+00
assign (segid  A  and resid   40 and name  HB2) (segid  A  and resid   40 and name  HB1) 2.237 0.625 0.625 weight 1.000 ! spec=sumo...oesy, no=1135, id=1817, vol=9.316010e+00
assign (segid  A  and resid    4 and name HD22) (segid  A  and resid    4 and name  HB1) 3.265 1.333 1.333 weight 1.000 ! spec=sumo...oesy, no=1136, id=921, vol=2.370250e+00
assign (segid  A  and resid   40 and name  HB2) (segid  A  and resid   42 and name HD12) 2.472 0.764 0.764 weight 1.000 ! spec=sumo...oesy, no=1137, id=1819, vol=5.106480e+00
    or (segid  A  and resid   40 and name  HB2) (segid  A  and resid   42 and name HD11)
    or (segid  A  and resid   40 and name  HB2) (segid  A  and resid   42 and name HD13)
assign (segid  A  and resid   79 and name HE21) (segid  A  and resid   76 and name  HD1) 3.464 1.499 1.499 weight 1.000 ! spec=sumo...oesy, no=1141, id=924, vol=1.663640e+00
    or (segid  A  and resid   79 and name HE21) (segid  A  and resid   76 and name  HD2)
assign (segid  A  and resid   78 and name  HB1) (segid  A  and resid   78 and name   HA) 2.249 0.632 0.632 weight 1.000 ! spec=sumo...oesy, no=1144, id=1820, vol=9.005260e+00
assign (segid  A  and resid   77 and name  HB2) (segid  A  and resid   77 and name   HA) 2.446 0.748 0.748 weight 1.000 ! spec=sumo...oesy, no=1145, id=1821, vol=5.446790e+00
assign (segid  A  and resid   39 and name  HB2) (segid  A  and resid   36 and name  HD1) 3.005 1.129 1.129 weight 1.000 ! spec=sumo...oesy, no=1148, id=1824, vol=1.583590e+00
    or (segid  A  and resid   39 and name  HB2) (segid  A  and resid   36 and name  HD2)
assign (segid  A  and resid   46 and name HE22) (segid  A  and resid   77 and name HE22) 3.534 1.561 1.561 weight 1.000 ! spec=sumo...oesy, no=1152, id=927, vol=1.474520e+00
assign (segid  A  and resid   78 and name  HB2) (segid  A  and resid   46 and name   HA) 2.862 1.024 1.024 weight 1.000 ! spec=sumo...oesy, no=1153, id=1828, vol=2.120410e+00
assign (segid  A  and resid   54 and name HE21) (segid  A  and resid   54 and name HE22) 1.471 0.271 0.271 weight 1.000 ! spec=sumo...oesy, no=1154, id=928, vol=2.829957e+02
assign (segid  A  and resid   45 and name  HB2) (segid  A  and resid   45 and name  HD2) 2.402 0.721 0.721 weight 1.000 ! spec=sumo...oesy, no=1155, id=1830, vol=6.079060e+00
    or (segid  A  and resid   45 and name  HB2) (segid  A  and resid   45 and name  HD1)
assign (segid  A  and resid   54 and name HE21) (segid  A  and resid   65 and name HD22) 3.751 1.759 1.759 weight 1.000 ! spec=sumo...oesy, no=1157, id=931, vol=1.030660e+00
    or (segid  A  and resid   54 and name HE21) (segid  A  and resid   65 and name HD21)
    or (segid  A  and resid   54 and name HE21) (segid  A  and resid   65 and name HD23)
assign (segid  A  and resid   25 and name  HB1) (segid  A  and resid   25 and name   HA) 2.802 0.981 0.981 weight 1.000 ! spec=sumo...oesy, no=1158, id=1831, vol=2.409520e+00
assign (segid  A  and resid   25 and name  HG2) (segid  A  and resid    7 and name HD12) 3.259 1.327 1.327 weight 1.000 ! spec=sumo...oesy, no=1163, id=1835, vol=9.739200e-01
    or (segid  A  and resid   25 and name  HG2) (segid  A  and resid    7 and name HD11)
    or (segid  A  and resid   25 and name  HG2) (segid  A  and resid    7 and name HD13)
assign (segid  A  and resid   25 and name  HG1) (segid  A  and resid   25 and name   HA) 2.787 0.971 0.971 weight 1.000 ! spec=sumo...oesy, no=1165, id=1837, vol=2.485950e+00
assign (segid  A  and resid   25 and name  HG1) (segid  A  and resid   63 and name  HB2) 3.144 1.235 1.235 weight 1.000 ! spec=sumo...oesy, no=1167, id=1839, vol=1.208600e+00
    or (segid  A  and resid   25 and name  HG1) (segid  A  and resid   63 and name  HB1)
    or (segid  A  and resid   25 and name  HG1) (segid  A  and resid   63 and name  HB3)
assign (segid  A  and resid   79 and name HE21) (segid  A  and resid   79 and name HE22) 1.570 0.308 0.308 weight 1.000 ! spec=sumo...oesy, no=1168, id=936, vol=1.914009e+02
assign (segid  A  and resid   25 and name  HG1) (segid  A  and resid    7 and name HD12) 2.984 1.113 1.113 weight 1.000 ! spec=sumo...oesy, no=1169, id=1841, vol=1.653300e+00
    or (segid  A  and resid   25 and name  HG1) (segid  A  and resid    7 and name HD11)
    or (segid  A  and resid   25 and name  HG1) (segid  A  and resid    7 and name HD13)
assign (segid  A  and resid   34 and name  HD1) (segid  A  and resid   44 and name  HE2) 2.833 1.003 1.003 weight 1.000 ! spec=sumo...oesy, no=1174, id=1845, vol=2.254760e+00
    or (segid  A  and resid   34 and name  HD1) (segid  A  and resid   44 and name  HE1)
    or (segid  A  and resid   34 and name  HD1) (segid  A  and resid   44 and name  HE3)
assign (segid  A  and resid   46 and name HE21) (segid  A  and resid   46 and name HE22) 1.679 0.352 0.352 weight 1.000 ! spec=sumo...oesy, no=1175, id=939, vol=1.284133e+02
assign (segid  A  and resid   46 and name HE22) (segid  A  and resid   46 and name   HA) 3.637 1.653 1.653 weight 1.000 ! spec=sumo...oesy, no=1176, id=940, vol=1.241600e+00
assign (segid  A  and resid   46 and name HE22) (segid  A  and resid   46 and name  HG1) 2.811 0.988 0.988 weight 1.000 ! spec=sumo...oesy, no=1177, id=941, vol=5.824550e+00
assign (segid  A  and resid   46 and name HE22) (segid  A  and resid   46 and name  HB1) 3.671 1.685 1.685 weight 1.000 ! spec=sumo...oesy, no=1178, id=942, vol=1.172980e+00
assign (segid  A  and resid   46 and name HE22) (segid  A  and resid   42 and name HD22) 3.546 1.572 1.572 weight 1.000 ! spec=sumo...oesy, no=1179, id=943, vol=1.443450e+00
    or (segid  A  and resid   46 and name HE22) (segid  A  and resid   42 and name HD21)
    or (segid  A  and resid   46 and name HE22) (segid  A  and resid   42 and name HD23)
assign (segid  A  and resid   81 and name   HN) (segid  A  and resid   80 and name   HB) 3.684 1.697 1.697 weight 1.000 ! spec=sumo...oesy, no=1182, id=946, vol=1.148640e+00
assign (segid  A  and resid   29 and name   HG) (segid  A  and resid   29 and name   HA) 2.519 0.793 0.793 weight 1.000 ! spec=sumo...oesy, no=1184, id=1854, vol=4.561640e+00
assign (segid  A  and resid    6 and name  HD2) (segid  A  and resid   22 and name  HD1) 3.217 1.294 1.294 weight 1.000 ! spec=sumo...oesy, no=1188, id=1858, vol=1.051540e+00
assign (segid  A  and resid   25 and name  HG2) (segid  A  and resid   25 and name  HG1) 2.023 0.511 0.511 weight 1.000 ! spec=sumo...oesy, no=1189, id=1859, vol=1.702273e+01
assign (segid  A  and resid   31 and name  HD2) (segid  A  and resid   28 and name  HD2) 3.141 1.233 1.233 weight 1.000 ! spec=sumo...oesy, no=1193, id=1862, vol=1.215250e+00
assign (segid  A  and resid   72 and name   HA) (segid  A  and resid   10 and name  HD2) 2.696 0.909 0.909 weight 1.000 ! spec=sumo...oesy, no=1195, id=1864, vol=3.034570e+00
    or (segid  A  and resid   72 and name   HA) (segid  A  and resid   10 and name  HD1)
assign (segid  A  and resid   10 and name  HD2) (segid  A  and resid   70 and name   HA) 2.953 1.090 1.090 weight 1.000 ! spec=sumo...oesy, no=1197, id=1866, vol=1.759220e+00
    or (segid  A  and resid   10 and name  HD1) (segid  A  and resid   70 and name   HA)
assign (segid  A  and resid   10 and name  HD2) (segid  A  and resid   20 and name  HG2) 3.142 1.234 1.234 weight 1.000 ! spec=sumo...oesy, no=1198, id=1867, vol=1.211710e+00
    or (segid  A  and resid   10 and name  HD1) (segid  A  and resid   20 and name  HG2)
assign (segid  A  and resid   10 and name  HB1) (segid  A  and resid   10 and name  HD2) 2.337 0.682 0.682 weight 1.000 ! spec=sumo...oesy, no=1199, id=1868, vol=7.167320e+00
    or (segid  A  and resid   10 and name  HB1) (segid  A  and resid   10 and name  HD1)
assign (segid  A  and resid   10 and name  HD2) (segid  A  and resid   72 and name HG21) 3.084 1.189 1.189 weight 1.000 ! spec=sumo...oesy, no=1201, id=1870, vol=1.356420e+00
    or (segid  A  and resid   10 and name  HD2) (segid  A  and resid   72 and name HG22)
    or (segid  A  and resid   10 and name  HD2) (segid  A  and resid   72 and name HG23)
    or (segid  A  and resid   10 and name  HD1) (segid  A  and resid   72 and name HG21)
    or (segid  A  and resid   10 and name  HD1) (segid  A  and resid   72 and name HG22)
    or (segid  A  and resid   10 and name  HD1) (segid  A  and resid   72 and name HG23)
assign (segid  A  and resid    6 and name  HB1) (segid  A  and resid   22 and name  HD1) 2.918 1.064 1.064 weight 1.000 ! spec=sumo...oesy, no=1203, id=1872, vol=1.890660e+00
assign (segid  A  and resid    6 and name  HB2) (segid  A  and resid   22 and name  HD1) 2.907 1.056 1.056 weight 1.000 ! spec=sumo...oesy, no=1204, id=1873, vol=1.931670e+00
assign (segid  A  and resid   20 and name HE22) (segid  A  and resid   20 and name HE21) 1.718 0.369 0.369 weight 1.000 ! spec=sumo...oesy, no=1207, id=950, vol=1.115791e+02
assign (segid  A  and resid   20 and name HE21) (segid  A  and resid   20 and name  HG2) 3.034 1.151 1.151 weight 1.000 ! spec=sumo...oesy, no=1208, id=951, vol=3.680810e+00
assign (segid  A  and resid   20 and name HE21) (segid  A  and resid   20 and name  HB1) 3.829 1.833 1.833 weight 1.000 ! spec=sumo...oesy, no=1209, id=952, vol=9.110400e-01
assign (segid  A  and resid   73 and name HG11) (segid  A  and resid   73 and name HG12) 2.061 0.531 0.531 weight 1.000 ! spec=sumo...oesy, no=1210, id=1878, vol=1.520884e+01
assign (segid  A  and resid   73 and name HG11) (segid  A  and resid   73 and name HD12) 2.111 0.557 0.557 weight 1.000 ! spec=sumo...oesy, no=1211, id=1879, vol=1.319355e+01
    or (segid  A  and resid   73 and name HG11) (segid  A  and resid   73 and name HD11)
    or (segid  A  and resid   73 and name HG11) (segid  A  and resid   73 and name HD13)
assign (segid  A  and resid   78 and name HE21) (segid  A  and resid   78 and name HE22) 1.644 0.338 0.338 weight 1.000 ! spec=sumo...oesy, no=1212, id=954, vol=1.452900e+02
assign (segid  A  and resid   73 and name HG12) (segid  A  and resid   51 and name  HD1) 3.194 1.275 1.275 weight 1.000 ! spec=sumo...oesy, no=1215, id=1880, vol=1.098430e+00
    or (segid  A  and resid   73 and name HG12) (segid  A  and resid   51 and name  HD2)
assign (segid  A  and resid   73 and name HG12) (segid  A  and resid   73 and name   HA) 2.934 1.076 1.076 weight 1.000 ! spec=sumo...oesy, no=1216, id=1881, vol=1.829000e+00
assign (segid  A  and resid   73 and name HG12) (segid  A  and resid   73 and name   HB) 2.804 0.983 0.983 weight 1.000 ! spec=sumo...oesy, no=1217, id=1882, vol=2.400920e+00
assign (segid  A  and resid   81 and name   HN) (segid  A  and resid   80 and name HG21) 3.613 1.632 1.632 weight 1.000 ! spec=sumo...oesy, no=1218, id=958, vol=1.290420e+00
    or (segid  A  and resid   81 and name   HN) (segid  A  and resid   80 and name HG22)
    or (segid  A  and resid   81 and name   HN) (segid  A  and resid   80 and name HG23)
assign (segid  A  and resid   28 and name  HD1) (segid  A  and resid   28 and name  HG1) 2.399 0.720 0.720 weight 1.000 ! spec=sumo...oesy, no=1221, id=1886, vol=6.113550e+00
assign (segid  A  and resid   20 and name HE22) (segid  A  and resid   20 and name  HB1) 3.804 1.809 1.809 weight 1.000 ! spec=sumo...oesy, no=1222, id=959, vol=9.477100e-01
assign (segid  A  and resid   20 and name HE22) (segid  A  and resid   18 and name HG22) 3.394 1.440 1.440 weight 1.000 ! spec=sumo...oesy, no=1223, id=960, vol=1.878920e+00
    or (segid  A  and resid   20 and name HE22) (segid  A  and resid   18 and name HG21)
    or (segid  A  and resid   20 and name HE22) (segid  A  and resid   18 and name HG23)
assign (segid  A  and resid   28 and name  HG1) (segid  A  and resid   61 and name HG21) 2.680 0.898 0.898 weight 1.000 ! spec=sumo...oesy, no=1224, id=1887, vol=3.144100e+00
    or (segid  A  and resid   28 and name  HG1) (segid  A  and resid   61 and name HG22)
    or (segid  A  and resid   28 and name  HG1) (segid  A  and resid   61 and name HG23)
assign (segid  A  and resid   55 and name  HG2) (segid  A  and resid   55 and name  HD1) 2.423 0.734 0.734 weight 1.000 ! spec=sumo...oesy, no=1227, id=1890, vol=5.767840e+00
assign (segid  A  and resid   55 and name   HA) (segid  A  and resid   50 and name  HG2) 2.839 1.007 1.007 weight 1.000 ! spec=sumo...oesy, no=1238, id=1897, vol=2.229170e+00
assign (segid  A  and resid   76 and name  HD1) (segid  A  and resid   50 and name  HG1) 3.370 1.420 1.420 weight 1.000 ! spec=sumo...oesy, no=1241, id=1900, vol=7.956800e-01
    or (segid  A  and resid   76 and name  HD2) (segid  A  and resid   50 and name  HG1)
assign (segid  A  and resid   55 and name   HA) (segid  A  and resid   50 and name  HG1) 2.603 0.847 0.847 weight 1.000 ! spec=sumo...oesy, no=1243, id=1902, vol=3.745080e+00
assign (segid  A  and resid   50 and name  HG1) (segid  A  and resid   55 and name  HB1) 3.271 1.337 1.337 weight 1.000 ! spec=sumo...oesy, no=1245, id=1904, vol=9.527000e-01
assign (segid  A  and resid   50 and name  HG1) (segid  A  and resid   50 and name  HB1) 2.597 0.843 0.843 weight 1.000 ! spec=sumo...oesy, no=1246, id=1905, vol=3.803080e+00
assign (segid  A  and resid   45 and name   HE) (segid  A  and resid   45 and name  HG2) 3.111 1.210 1.210 weight 1.000 ! spec=sumo...oesy, no=1249, id=1906, vol=1.287070e+00
    or (segid  A  and resid   45 and name   HE) (segid  A  and resid   45 and name  HG1)
assign (segid  A  and resid   65 and name   HG) (segid  A  and resid   60 and name  HB1) 2.939 1.080 1.080 weight 1.000 ! spec=sumo...oesy, no=1250, id=1907, vol=1.809030e+00
assign (segid  A  and resid   65 and name   HG) (segid  A  and resid   65 and name HD12) 2.230 0.622 0.622 weight 1.000 ! spec=sumo...oesy, no=1252, id=1909, vol=9.481640e+00
    or (segid  A  and resid   65 and name   HG) (segid  A  and resid   65 and name HD11)
    or (segid  A  and resid   65 and name   HG) (segid  A  and resid   65 and name HD13)
assign (segid  A  and resid   64 and name HE21) (segid  A  and resid   64 and name HE22) 1.693 0.358 0.358 weight 1.000 ! spec=sumo...oesy, no=1255, id=966, vol=1.219389e+02
assign (segid  A  and resid   64 and name HE21) (segid  A  and resid   61 and name HG21) 3.704 1.715 1.715 weight 1.000 ! spec=sumo...oesy, no=1257, id=968, vol=1.111240e+00
    or (segid  A  and resid   64 and name HE21) (segid  A  and resid   61 and name HG22)
    or (segid  A  and resid   64 and name HE21) (segid  A  and resid   61 and name HG23)
assign (segid  A  and resid   65 and name   HG) (segid  A  and resid   64 and name  HB1) 2.748 0.944 0.944 weight 1.000 ! spec=sumo...oesy, no=1258, id=1914, vol=2.708460e+00
assign (segid  A  and resid    9 and name   HA) (segid  A  and resid    9 and name   HG) 2.843 1.010 1.010 weight 1.000 ! spec=sumo...oesy, no=1261, id=1917, vol=2.207940e+00
assign (segid  A  and resid   21 and name  HD1) (segid  A  and resid   32 and name   HG) 2.355 0.693 0.693 weight 1.000 ! spec=sumo...oesy, no=1265, id=1921, vol=6.837930e+00
    or (segid  A  and resid   21 and name  HD2) (segid  A  and resid   32 and name   HG)
assign (segid  A  and resid   32 and name   HG) (segid  A  and resid   32 and name   HA) 2.405 0.723 0.723 weight 1.000 ! spec=sumo...oesy, no=1269, id=1925, vol=6.030610e+00
assign (segid  A  and resid   21 and name  HB1) (segid  A  and resid   32 and name   HG) 2.382 0.709 0.709 weight 1.000 ! spec=sumo...oesy, no=1271, id=1927, vol=6.381360e+00
assign (segid  A  and resid   21 and name  HB2) (segid  A  and resid   32 and name   HG) 2.318 0.672 0.672 weight 1.000 ! spec=sumo...oesy, no=1272, id=1928, vol=7.516950e+00
assign (segid  A  and resid   12 and name   HN) (segid  A  and resid   73 and name   HB) 3.312 1.371 1.371 weight 1.000 ! spec=sumo...oesy, no=1273, id=974, vol=2.176330e+00
assign (segid  A  and resid   32 and name   HG) (segid  A  and resid   32 and name HD12) 1.851 0.428 0.428 weight 1.000 ! spec=sumo...oesy, no=1277, id=1931, vol=2.895059e+01
    or (segid  A  and resid   32 and name   HG) (segid  A  and resid   32 and name HD11)
    or (segid  A  and resid   32 and name   HG) (segid  A  and resid   32 and name HD13)
assign (segid  A  and resid   12 and name   HN) (segid  A  and resid   11 and name   HB) 3.434 1.474 1.474 weight 1.000 ! spec=sumo...oesy, no=1279, id=979, vol=1.750580e+00
assign (segid  A  and resid   12 and name   HN) (segid  A  and resid   12 and name  HB2) 2.356 0.694 0.694 weight 1.000 ! spec=sumo...oesy, no=1280, id=980, vol=1.678563e+01
    or (segid  A  and resid   12 and name   HN) (segid  A  and resid   12 and name  HB1)
    or (segid  A  and resid   12 and name   HN) (segid  A  and resid   12 and name  HB3)
assign (segid  A  and resid   12 and name   HN) (segid  A  and resid   72 and name HG21) 2.736 0.936 0.936 weight 1.000 ! spec=sumo...oesy, no=1281, id=981, vol=6.844350e+00
    or (segid  A  and resid   12 and name   HN) (segid  A  and resid   72 and name HG22)
    or (segid  A  and resid   12 and name   HN) (segid  A  and resid   72 and name HG23)
assign (segid  A  and resid   12 and name   HN) (segid  A  and resid   75 and name HG22) 3.338 1.393 1.393 weight 1.000 ! spec=sumo...oesy, no=1284, id=984, vol=2.074540e+00
    or (segid  A  and resid   12 and name   HN) (segid  A  and resid   75 and name HG21)
    or (segid  A  and resid   12 and name   HN) (segid  A  and resid   75 and name HG23)
assign (segid  A  and resid   12 and name   HN) (segid  A  and resid   11 and name HG22) 2.628 0.864 0.864 weight 1.000 ! spec=sumo...oesy, no=1285, id=985, vol=8.709290e+00
    or (segid  A  and resid   12 and name   HN) (segid  A  and resid   11 and name HG21)
    or (segid  A  and resid   12 and name   HN) (segid  A  and resid   11 and name HG23)
assign (segid  A  and resid   39 and name  HG1) (segid  A  and resid   19 and name HG22) 2.912 1.060 1.060 weight 1.000 ! spec=sumo...oesy, no=1287, id=1937, vol=1.913090e+00
    or (segid  A  and resid   39 and name  HG1) (segid  A  and resid   19 and name HG21)
    or (segid  A  and resid   39 and name  HG1) (segid  A  and resid   19 and name HG23)
assign (segid  A  and resid   13 and name   HN) (segid  A  and resid   11 and name HG22) 3.820 1.824 1.824 weight 1.000 ! spec=sumo...oesy, no=1288, id=988, vol=9.240200e-01
    or (segid  A  and resid   13 and name   HN) (segid  A  and resid   11 and name HG21)
    or (segid  A  and resid   13 and name   HN) (segid  A  and resid   11 and name HG23)
assign (segid  A  and resid   48 and name   HA) (segid  A  and resid   48 and name  HG1) 2.764 0.955 0.955 weight 1.000 ! spec=sumo...oesy, no=1289, id=1939, vol=2.616320e+00
assign (segid  A  and resid   48 and name  HD1) (segid  A  and resid   48 and name  HG1) 2.569 0.825 0.825 weight 1.000 ! spec=sumo...oesy, no=1290, id=1940, vol=4.058770e+00
assign (segid  A  and resid   48 and name  HG1) (segid  A  and resid   48 and name  HD2) 2.492 0.776 0.776 weight 1.000 ! spec=sumo...oesy, no=1291, id=1941, vol=4.867200e+00
assign (segid  A  and resid   13 and name   HN) (segid  A  and resid   12 and name   HA) 2.078 0.540 0.540 weight 1.000 ! spec=sumo...oesy, no=1293, id=992, vol=3.570495e+01
assign (segid  A  and resid   13 and name   HN) (segid  A  and resid   18 and name   HA) 2.787 0.971 0.971 weight 1.000 ! spec=sumo...oesy, no=1294, id=993, vol=6.133410e+00
assign (segid  A  and resid   48 and name  HD1) (segid  A  and resid   48 and name  HG2) 2.558 0.818 0.818 weight 1.000 ! spec=sumo...oesy, no=1295, id=1945, vol=4.160220e+00
assign (segid  A  and resid   48 and name  HG2) (segid  A  and resid   48 and name  HD2) 2.565 0.823 0.823 weight 1.000 ! spec=sumo...oesy, no=1296, id=1946, vol=4.090680e+00
assign (segid  A  and resid   13 and name   HN) (segid  A  and resid   13 and name  HA2) 2.345 0.687 0.687 weight 1.000 ! spec=sumo...oesy, no=1297, id=996, vol=1.728645e+01
assign (segid  A  and resid   13 and name   HN) (segid  A  and resid   12 and name  HB2) 2.477 0.767 0.767 weight 1.000 ! spec=sumo...oesy, no=1298, id=997, vol=1.241891e+01
    or (segid  A  and resid   13 and name   HN) (segid  A  and resid   12 and name  HB1)
    or (segid  A  and resid   13 and name   HN) (segid  A  and resid   12 and name  HB3)
assign (segid  A  and resid   23 and name HG12) (segid  A  and resid   27 and name   HB) 2.744 0.941 0.941 weight 1.000 ! spec=sumo...oesy, no=1299, id=1949, vol=2.729460e+00
assign (segid  A  and resid   23 and name HG12) (segid  A  and resid   23 and name HD12) 2.134 0.569 0.569 weight 1.000 ! spec=sumo...oesy, no=1300, id=1950, vol=1.234916e+01
    or (segid  A  and resid   23 and name HG12) (segid  A  and resid   23 and name HD11)
    or (segid  A  and resid   23 and name HG12) (segid  A  and resid   23 and name HD13)
assign (segid  A  and resid   13 and name   HN) (segid  A  and resid   75 and name HG22) 3.701 1.712 1.712 weight 1.000 ! spec=sumo...oesy, no=1301, id=1000, vol=1.118100e+00
    or (segid  A  and resid   13 and name   HN) (segid  A  and resid   75 and name HG21)
    or (segid  A  and resid   13 and name   HN) (segid  A  and resid   75 and name HG23)
assign (segid  A  and resid   42 and name   HN) (segid  A  and resid   41 and name   HN) 2.309 0.666 0.666 weight 1.000 ! spec=sumo...oesy, no=1303, id=1001, vol=1.896732e+01
assign (segid  A  and resid   42 and name   HG) (segid  A  and resid   37 and name   HA) 3.075 1.182 1.182 weight 1.000 ! spec=sumo...oesy, no=1305, id=1955, vol=1.378540e+00
assign (segid  A  and resid   41 and name   HN) (segid  A  and resid   41 and name  HA2) 2.092 0.547 0.547 weight 1.000 ! spec=sumo...oesy, no=1307, id=1004, vol=3.428429e+01
assign (segid  A  and resid   41 and name   HN) (segid  A  and resid   37 and name   HA) 3.699 1.711 1.711 weight 1.000 ! spec=sumo...oesy, no=1308, id=1005, vol=1.120260e+00
assign (segid  A  and resid   41 and name   HN) (segid  A  and resid   40 and name  HB1) 3.062 1.172 1.172 weight 1.000 ! spec=sumo...oesy, no=1309, id=1006, vol=3.484440e+00
assign (segid  A  and resid   41 and name   HN) (segid  A  and resid   40 and name  HB2) 2.771 0.960 0.960 weight 1.000 ! spec=sumo...oesy, no=1311, id=1008, vol=6.347100e+00
assign (segid  A  and resid   56 and name   HA) (segid  A  and resid   56 and name HG12) 2.723 0.927 0.927 weight 1.000 ! spec=sumo...oesy, no=1314, id=1962, vol=2.860600e+00
assign (segid  A  and resid   51 and name  HB1) (segid  A  and resid   56 and name HG12) 3.119 1.216 1.216 weight 1.000 ! spec=sumo...oesy, no=1317, id=1964, vol=1.267500e+00
assign (segid  A  and resid   40 and name HE21) (segid  A  and resid   40 and name   HA) 3.438 1.477 1.477 weight 1.000 ! spec=sumo...oesy, no=1318, id=1011, vol=1.740300e+00
assign (segid  A  and resid    7 and name HG12) (segid  A  and resid    7 and name HD12) 2.332 0.680 0.680 weight 1.000 ! spec=sumo...oesy, no=1319, id=1966, vol=7.247190e+00
    or (segid  A  and resid    7 and name HG12) (segid  A  and resid    7 and name HD11)
    or (segid  A  and resid    7 and name HG12) (segid  A  and resid    7 and name HD13)
assign (segid  A  and resid   40 and name HE21) (segid  A  and resid   40 and name  HB2) 3.378 1.427 1.427 weight 1.000 ! spec=sumo...oesy, no=1321, id=1014, vol=1.931570e+00
assign (segid  A  and resid   32 and name HD12) (segid  A  and resid   32 and name  HB2) 2.593 0.840 0.840 weight 1.000 ! spec=sumo...oesy, no=1323, id=1970, vol=3.837020e+00
    or (segid  A  and resid   32 and name HD11) (segid  A  and resid   32 and name  HB2)
    or (segid  A  and resid   32 and name HD13) (segid  A  and resid   32 and name  HB2)
assign (segid  A  and resid   21 and name  HD1) (segid  A  and resid   32 and name HD12) 2.889 1.043 1.043 weight 1.000 ! spec=sumo...oesy, no=1325, id=1971, vol=2.005170e+00
    or (segid  A  and resid   21 and name  HD1) (segid  A  and resid   32 and name HD11)
    or (segid  A  and resid   21 and name  HD1) (segid  A  and resid   32 and name HD13)
    or (segid  A  and resid   21 and name  HD2) (segid  A  and resid   32 and name HD12)
    or (segid  A  and resid   21 and name  HD2) (segid  A  and resid   32 and name HD11)
    or (segid  A  and resid   21 and name  HD2) (segid  A  and resid   32 and name HD13)
assign (segid  A  and resid   32 and name HD12) (segid  A  and resid   21 and name  HB1) 3.303 1.364 1.364 weight 1.000 ! spec=sumo...oesy, no=1326, id=1972, vol=8.978300e-01
    or (segid  A  and resid   32 and name HD11) (segid  A  and resid   21 and name  HB1)
    or (segid  A  and resid   32 and name HD13) (segid  A  and resid   21 and name  HB1)
assign (segid  A  and resid   52 and name   HN) (segid  A  and resid   51 and name  HD1) 2.737 0.937 0.937 weight 1.000 ! spec=sumo...oesy, no=1330, id=1021, vol=6.826500e+00
    or (segid  A  and resid   52 and name   HN) (segid  A  and resid   51 and name  HD2)
assign (segid  A  and resid    9 and name HD22) (segid  A  and resid   62 and name   HA) 3.055 1.167 1.167 weight 1.000 ! spec=sumo...oesy, no=1331, id=1977, vol=1.433970e+00
    or (segid  A  and resid    9 and name HD21) (segid  A  and resid   62 and name   HA)
    or (segid  A  and resid    9 and name HD23) (segid  A  and resid   62 and name   HA)
assign (segid  A  and resid    9 and name HD22) (segid  A  and resid   62 and name  HD1) 3.128 1.223 1.223 weight 1.000 ! spec=sumo...oesy, no=1332, id=1978, vol=1.244380e+00
    or (segid  A  and resid    9 and name HD21) (segid  A  and resid   62 and name  HD1)
    or (segid  A  and resid    9 and name HD23) (segid  A  and resid   62 and name  HD1)
assign (segid  A  and resid   52 and name   HN) (segid  A  and resid   51 and name  HB1) 3.325 1.382 1.382 weight 1.000 ! spec=sumo...oesy, no=1333, id=1024, vol=2.125190e+00
assign (segid  A  and resid   52 and name   HN) (segid  A  and resid   51 and name  HB2) 3.506 1.537 1.537 weight 1.000 ! spec=sumo...oesy, no=1334, id=1025, vol=1.545420e+00
assign (segid  A  and resid    9 and name HD22) (segid  A  and resid   21 and name  HB2) 3.077 1.184 1.184 weight 1.000 ! spec=sumo...oesy, no=1335, id=1981, vol=1.373350e+00
    or (segid  A  and resid    9 and name HD21) (segid  A  and resid   21 and name  HB2)
    or (segid  A  and resid    9 and name HD23) (segid  A  and resid   21 and name  HB2)
assign (segid  A  and resid    9 and name HD22) (segid  A  and resid   62 and name  HG1) 2.635 0.868 0.868 weight 1.000 ! spec=sumo...oesy, no=1336, id=1982, vol=3.486660e+00
    or (segid  A  and resid    9 and name HD21) (segid  A  and resid   62 and name  HG1)
    or (segid  A  and resid    9 and name HD23) (segid  A  and resid   62 and name  HG1)
assign (segid  A  and resid    9 and name HD22) (segid  A  and resid    9 and name  HB2) 2.098 0.550 0.550 weight 1.000 ! spec=sumo...oesy, no=1340, id=1986, vol=1.365869e+01
    or (segid  A  and resid    9 and name HD21) (segid  A  and resid    9 and name  HB2)
    or (segid  A  and resid    9 and name HD23) (segid  A  and resid    9 and name  HB2)
assign (segid  A  and resid   82 and name   HN) (segid  A  and resid   57 and name HD21) 3.184 1.267 1.267 weight 1.000 ! spec=sumo...oesy, no=1341, id=1031, vol=2.755920e+00
assign (segid  A  and resid    9 and name HD22) (segid  A  and resid   32 and name HD22) 2.639 0.871 0.871 weight 1.000 ! spec=sumo...oesy, no=1343, id=1987, vol=3.452540e+00
    or (segid  A  and resid    9 and name HD22) (segid  A  and resid   32 and name HD21)
    or (segid  A  and resid    9 and name HD22) (segid  A  and resid   32 and name HD23)
    or (segid  A  and resid    9 and name HD21) (segid  A  and resid   32 and name HD22)
    or (segid  A  and resid    9 and name HD21) (segid  A  and resid   32 and name HD21)
    or (segid  A  and resid    9 and name HD21) (segid  A  and resid   32 and name HD23)
    or (segid  A  and resid    9 and name HD23) (segid  A  and resid   32 and name HD22)
    or (segid  A  and resid    9 and name HD23) (segid  A  and resid   32 and name HD21)
    or (segid  A  and resid    9 and name HD23) (segid  A  and resid   32 and name HD23)
assign (segid  A  and resid    9 and name HD22) (segid  A  and resid   29 and name   HA) 3.167 1.253 1.253 weight 1.000 ! spec=sumo...oesy, no=1344, id=1988, vol=1.156670e+00
    or (segid  A  and resid    9 and name HD21) (segid  A  and resid   29 and name   HA)
    or (segid  A  and resid    9 and name HD23) (segid  A  and resid   29 and name   HA)
assign (segid  A  and resid   61 and name   HA) (segid  A  and resid   29 and name HD12) 2.789 0.972 0.972 weight 1.000 ! spec=sumo...oesy, no=1345, id=1989, vol=2.476730e+00
    or (segid  A  and resid   61 and name   HA) (segid  A  and resid   29 and name HD11)
    or (segid  A  and resid   61 and name   HA) (segid  A  and resid   29 and name HD13)
assign (segid  A  and resid   62 and name   HA) (segid  A  and resid   29 and name HD12) 2.656 0.882 0.882 weight 1.000 ! spec=sumo...oesy, no=1346, id=1990, vol=3.325270e+00
    or (segid  A  and resid   62 and name   HA) (segid  A  and resid   29 and name HD11)
    or (segid  A  and resid   62 and name   HA) (segid  A  and resid   29 and name HD13)
assign (segid  A  and resid   29 and name HD12) (segid  A  and resid   60 and name  HB1) 2.404 0.722 0.722 weight 1.000 ! spec=sumo...oesy, no=1348, id=1992, vol=6.046550e+00
    or (segid  A  and resid   29 and name HD11) (segid  A  and resid   60 and name  HB1)
    or (segid  A  and resid   29 and name HD13) (segid  A  and resid   60 and name  HB1)
assign (segid  A  and resid   29 and name HD12) (segid  A  and resid   60 and name  HB2) 2.516 0.791 0.791 weight 1.000 ! spec=sumo...oesy, no=1349, id=1993, vol=4.601920e+00
    or (segid  A  and resid   29 and name HD11) (segid  A  and resid   60 and name  HB2)
    or (segid  A  and resid   29 and name HD13) (segid  A  and resid   60 and name  HB2)
assign (segid  A  and resid   29 and name HD12) (segid  A  and resid   29 and name  HB2) 2.034 0.517 0.517 weight 1.000 ! spec=sumo...oesy, no=1350, id=1994, vol=1.647065e+01
    or (segid  A  and resid   29 and name HD11) (segid  A  and resid   29 and name  HB2)
    or (segid  A  and resid   29 and name HD13) (segid  A  and resid   29 and name  HB2)
assign (segid  A  and resid   29 and name HD12) (segid  A  and resid   29 and name  HB1) 2.284 0.652 0.652 weight 1.000 ! spec=sumo...oesy, no=1353, id=1997, vol=8.206510e+00
    or (segid  A  and resid   29 and name HD11) (segid  A  and resid   29 and name  HB1)
    or (segid  A  and resid   29 and name HD13) (segid  A  and resid   29 and name  HB1)
assign (segid  A  and resid   64 and name   HN) (segid  A  and resid   61 and name   HN) 3.005 1.129 1.129 weight 1.000 ! spec=sumo...oesy, no=1354, id=1040, vol=3.901020e+00
assign (segid  A  and resid   61 and name   HN) (segid  A  and resid   60 and name   HN) 3.565 1.589 1.589 weight 1.000 ! spec=sumo...oesy, no=1355, id=1041, vol=1.397940e+00
assign (segid  A  and resid   61 and name   HN) (segid  A  and resid   61 and name   HA) 3.036 1.152 1.152 weight 1.000 ! spec=sumo...oesy, no=1358, id=1042, vol=3.669910e+00
assign (segid  A  and resid   48 and name  HG1) (segid  A  and resid   80 and name   HB) 3.366 1.416 1.416 weight 1.000 ! spec=sumo...oesy, no=1359, id=1998, vol=8.023200e-01
assign (segid  A  and resid   61 and name   HN) (segid  A  and resid   61 and name   HB) 3.332 1.388 1.388 weight 1.000 ! spec=sumo...oesy, no=1360, id=1044, vol=2.097060e+00
assign (segid  A  and resid   24 and name  HG1) (segid  A  and resid    6 and name  HD1) 3.208 1.286 1.286 weight 1.000 ! spec=sumo...oesy, no=1362, id=2001, vol=1.070950e+00
assign (segid  A  and resid   61 and name   HN) (segid  A  and resid   62 and name  HD1) 3.720 1.730 1.730 weight 1.000 ! spec=sumo...oesy, no=1363, id=1047, vol=1.082950e+00
assign (segid  A  and resid   61 and name   HN) (segid  A  and resid   60 and name  HB1) 2.927 1.071 1.071 weight 1.000 ! spec=sumo...oesy, no=1364, id=1048, vol=4.564360e+00
assign (segid  A  and resid   10 and name  HG1) (segid  A  and resid   10 and name  HB1) 2.531 0.801 0.801 weight 1.000 ! spec=sumo...oesy, no=1366, id=2004, vol=4.432860e+00
assign (segid  A  and resid   61 and name   HN) (segid  A  and resid   64 and name  HB2) 2.646 0.875 0.875 weight 1.000 ! spec=sumo...oesy, no=1367, id=1051, vol=8.369520e+00
assign (segid  A  and resid   42 and name HD12) (segid  A  and resid   36 and name  HD1) 2.559 0.818 0.818 weight 1.000 ! spec=sumo...oesy, no=1368, id=2006, vol=4.155540e+00
    or (segid  A  and resid   42 and name HD12) (segid  A  and resid   36 and name  HD2)
    or (segid  A  and resid   42 and name HD11) (segid  A  and resid   36 and name  HD1)
    or (segid  A  and resid   42 and name HD11) (segid  A  and resid   36 and name  HD2)
    or (segid  A  and resid   42 and name HD13) (segid  A  and resid   36 and name  HD1)
    or (segid  A  and resid   42 and name HD13) (segid  A  and resid   36 and name  HD2)
assign (segid  A  and resid   61 and name   HN) (segid  A  and resid   61 and name HG21) 2.486 0.772 0.772 weight 1.000 ! spec=sumo...oesy, no=1370, id=1054, vol=1.217700e+01
    or (segid  A  and resid   61 and name   HN) (segid  A  and resid   61 and name HG22)
    or (segid  A  and resid   61 and name   HN) (segid  A  and resid   61 and name HG23)
assign (segid  A  and resid   61 and name   HN) (segid  A  and resid   65 and name HD12) 3.348 1.401 1.401 weight 1.000 ! spec=sumo...oesy, no=1371, id=1055, vol=2.038590e+00
    or (segid  A  and resid   61 and name   HN) (segid  A  and resid   65 and name HD11)
    or (segid  A  and resid   61 and name   HN) (segid  A  and resid   65 and name HD13)
assign (segid  A  and resid   42 and name HD12) (segid  A  and resid   37 and name   HA) 2.458 0.756 0.756 weight 1.000 ! spec=sumo...oesy, no=1372, id=2010, vol=5.281530e+00
    or (segid  A  and resid   42 and name HD11) (segid  A  and resid   37 and name   HA)
    or (segid  A  and resid   42 and name HD13) (segid  A  and resid   37 and name   HA)
assign (segid  A  and resid   16 and name   HN) (segid  A  and resid   14 and name   HN) 3.561 1.585 1.585 weight 1.000 ! spec=sumo...oesy, no=1374, id=1057, vol=1.409540e+00
assign (segid  A  and resid   13 and name   HN) (segid  A  and resid   16 and name   HN) 3.522 1.551 1.551 weight 1.000 ! spec=sumo...oesy, no=1375, id=1058, vol=1.503390e+00
assign (segid  A  and resid   15 and name   HN) (segid  A  and resid   16 and name   HN) 2.287 0.654 0.654 weight 1.000 ! spec=sumo...oesy, no=1376, id=1059, vol=2.004624e+01
assign (segid  A  and resid   42 and name HD12) (segid  A  and resid   75 and name HG22) 3.184 1.267 1.267 weight 1.000 ! spec=sumo...oesy, no=1378, id=2015, vol=1.118770e+00
    or (segid  A  and resid   42 and name HD12) (segid  A  and resid   75 and name HG21)
    or (segid  A  and resid   42 and name HD12) (segid  A  and resid   75 and name HG23)
    or (segid  A  and resid   42 and name HD11) (segid  A  and resid   75 and name HG22)
    or (segid  A  and resid   42 and name HD11) (segid  A  and resid   75 and name HG21)
    or (segid  A  and resid   42 and name HD11) (segid  A  and resid   75 and name HG23)
    or (segid  A  and resid   42 and name HD13) (segid  A  and resid   75 and name HG22)
    or (segid  A  and resid   42 and name HD13) (segid  A  and resid   75 and name HG21)
    or (segid  A  and resid   42 and name HD13) (segid  A  and resid   75 and name HG23)
assign (segid  A  and resid   16 and name   HN) (segid  A  and resid   15 and name   HA) 2.702 0.913 0.913 weight 1.000 ! spec=sumo...oesy, no=1379, id=1060, vol=7.380170e+00
assign (segid  A  and resid   65 and name HD12) (segid  A  and resid   51 and name  HD1) 2.582 0.833 0.833 weight 1.000 ! spec=sumo...oesy, no=1380, id=2017, vol=3.937910e+00
    or (segid  A  and resid   65 and name HD12) (segid  A  and resid   51 and name  HD2)
    or (segid  A  and resid   65 and name HD11) (segid  A  and resid   51 and name  HD1)
    or (segid  A  and resid   65 and name HD11) (segid  A  and resid   51 and name  HD2)
    or (segid  A  and resid   65 and name HD13) (segid  A  and resid   51 and name  HD1)
    or (segid  A  and resid   65 and name HD13) (segid  A  and resid   51 and name  HD2)
assign (segid  A  and resid   16 and name   HN) (segid  A  and resid   16 and name  HA2) 2.147 0.576 0.576 weight 1.000 ! spec=sumo...oesy, no=1382, id=1063, vol=2.934073e+01
assign (segid  A  and resid   16 and name   HN) (segid  A  and resid   15 and name  HB1) 3.345 1.399 1.399 weight 1.000 ! spec=sumo...oesy, no=1383, id=1064, vol=2.050040e+00
assign (segid  A  and resid   62 and name   HA) (segid  A  and resid   65 and name HD12) 2.630 0.865 0.865 weight 1.000 ! spec=sumo...oesy, no=1384, id=2021, vol=3.523430e+00
    or (segid  A  and resid   62 and name   HA) (segid  A  and resid   65 and name HD11)
    or (segid  A  and resid   62 and name   HA) (segid  A  and resid   65 and name HD13)
assign (segid  A  and resid   60 and name  HB1) (segid  A  and resid   65 and name HD12) 2.173 0.590 0.590 weight 1.000 ! spec=sumo...oesy, no=1385, id=2022, vol=1.107052e+01
    or (segid  A  and resid   60 and name  HB1) (segid  A  and resid   65 and name HD11)
    or (segid  A  and resid   60 and name  HB1) (segid  A  and resid   65 and name HD13)
assign (segid  A  and resid   16 and name   HN) (segid  A  and resid   14 and name  HB2) 3.613 1.631 1.631 weight 1.000 ! spec=sumo...oesy, no=1386, id=1067, vol=1.292040e+00
assign (segid  A  and resid   65 and name HD12) (segid  A  and resid   60 and name  HB2) 2.290 0.656 0.656 weight 1.000 ! spec=sumo...oesy, no=1387, id=2024, vol=8.078740e+00
    or (segid  A  and resid   65 and name HD11) (segid  A  and resid   60 and name  HB2)
    or (segid  A  and resid   65 and name HD13) (segid  A  and resid   60 and name  HB2)
assign (segid  A  and resid   65 and name HD12) (segid  A  and resid   64 and name  HB1) 3.096 1.198 1.198 weight 1.000 ! spec=sumo...oesy, no=1388, id=2025, vol=1.324300e+00
    or (segid  A  and resid   65 and name HD11) (segid  A  and resid   64 and name  HB1)
    or (segid  A  and resid   65 and name HD13) (segid  A  and resid   64 and name  HB1)
assign (segid  A  and resid   25 and name   HE) (segid  A  and resid   25 and name  HG2) 3.700 1.711 1.711 weight 1.000 ! spec=sumo...oesy, no=1394, id=1071, vol=1.119940e+00
assign (segid  A  and resid   29 and name HD12) (segid  A  and resid   56 and name   HA) 3.013 1.135 1.135 weight 1.000 ! spec=sumo...oesy, no=1395, id=2031, vol=1.559700e+00
    or (segid  A  and resid   29 and name HD11) (segid  A  and resid   56 and name   HA)
    or (segid  A  and resid   29 and name HD13) (segid  A  and resid   56 and name   HA)
assign (segid  A  and resid   42 and name   HN) (segid  A  and resid   37 and name  HB1) 3.366 1.417 1.417 weight 1.000 ! spec=sumo...oesy, no=1396, id=1073, vol=1.972980e+00
assign (segid  A  and resid   34 and name  HG2) (segid  A  and resid   44 and name  HE2) 2.708 0.917 0.917 weight 1.000 ! spec=sumo...oesy, no=1407, id=2041, vol=2.954170e+00
    or (segid  A  and resid   34 and name  HG2) (segid  A  and resid   44 and name  HE1)
    or (segid  A  and resid   34 and name  HG2) (segid  A  and resid   44 and name  HE3)
assign (segid  A  and resid   10 and name  HG2) (segid  A  and resid   10 and name  HB1) 2.528 0.799 0.799 weight 1.000 ! spec=sumo...oesy, no=1412, id=2046, vol=4.467570e+00
assign (segid  A  and resid    6 and name  HD2) (segid  A  and resid   22 and name  HG1) 3.215 1.292 1.292 weight 1.000 ! spec=sumo...oesy, no=1427, id=2053, vol=1.056970e+00
assign (segid  A  and resid    6 and name  HB2) (segid  A  and resid   22 and name  HG2) 3.023 1.142 1.142 weight 1.000 ! spec=sumo...oesy, no=1430, id=2056, vol=1.528530e+00
assign (segid  A  and resid    6 and name  HD2) (segid  A  and resid   22 and name  HG2) 2.838 1.007 1.007 weight 1.000 ! spec=sumo...oesy, no=1431, id=2057, vol=2.233340e+00
assign (segid  A  and resid    6 and name  HB1) (segid  A  and resid   22 and name  HG2) 3.081 1.186 1.186 weight 1.000 ! spec=sumo...oesy, no=1433, id=2059, vol=1.363930e+00
assign (segid  A  and resid   72 and name   HA) (segid  A  and resid    9 and name HD12) 3.237 1.309 1.309 weight 1.000 ! spec=sumo...oesy, no=1442, id=2063, vol=1.014470e+00
    or (segid  A  and resid   72 and name   HA) (segid  A  and resid    9 and name HD11)
    or (segid  A  and resid   72 and name   HA) (segid  A  and resid    9 and name HD13)
assign (segid  A  and resid    9 and name   HA) (segid  A  and resid    9 and name HD12) 1.914 0.458 0.458 weight 1.000 ! spec=sumo...oesy, no=1443, id=2064, vol=2.372755e+01
    or (segid  A  and resid    9 and name   HA) (segid  A  and resid    9 and name HD11)
    or (segid  A  and resid    9 and name   HA) (segid  A  and resid    9 and name HD13)
assign (segid  A  and resid    9 and name HD12) (segid  A  and resid   69 and name   HA) 2.813 0.989 0.989 weight 1.000 ! spec=sumo...oesy, no=1445, id=2066, vol=2.353130e+00
    or (segid  A  and resid    9 and name HD11) (segid  A  and resid   69 and name   HA)
    or (segid  A  and resid    9 and name HD13) (segid  A  and resid   69 and name   HA)
assign (segid  A  and resid    9 and name HD12) (segid  A  and resid   70 and name   HA) 3.176 1.261 1.261 weight 1.000 ! spec=sumo...oesy, no=1447, id=2068, vol=1.136400e+00
    or (segid  A  and resid    9 and name HD11) (segid  A  and resid   70 and name   HA)
    or (segid  A  and resid    9 and name HD13) (segid  A  and resid   70 and name   HA)
assign (segid  A  and resid   71 and name  HB1) (segid  A  and resid    9 and name HD12) 2.299 0.661 0.661 weight 1.000 ! spec=sumo...oesy, no=1448, id=2069, vol=7.904030e+00
    or (segid  A  and resid   71 and name  HB1) (segid  A  and resid    9 and name HD11)
    or (segid  A  and resid   71 and name  HB1) (segid  A  and resid    9 and name HD13)
assign (segid  A  and resid    9 and name HD12) (segid  A  and resid   71 and name  HB2) 2.383 0.710 0.710 weight 1.000 ! spec=sumo...oesy, no=1449, id=2070, vol=6.366030e+00
    or (segid  A  and resid    9 and name HD11) (segid  A  and resid   71 and name  HB2)
    or (segid  A  and resid    9 and name HD13) (segid  A  and resid   71 and name  HB2)
assign (segid  A  and resid    9 and name HD12) (segid  A  and resid    7 and name HD12) 2.085 0.543 0.543 weight 1.000 ! spec=sumo...oesy, no=1456, id=2073, vol=1.419198e+01
    or (segid  A  and resid    9 and name HD12) (segid  A  and resid    7 and name HD11)
    or (segid  A  and resid    9 and name HD12) (segid  A  and resid    7 and name HD13)
    or (segid  A  and resid    9 and name HD11) (segid  A  and resid    7 and name HD12)
    or (segid  A  and resid    9 and name HD11) (segid  A  and resid    7 and name HD11)
    or (segid  A  and resid    9 and name HD11) (segid  A  and resid    7 and name HD13)
    or (segid  A  and resid    9 and name HD13) (segid  A  and resid    7 and name HD12)
    or (segid  A  and resid    9 and name HD13) (segid  A  and resid    7 and name HD11)
    or (segid  A  and resid    9 and name HD13) (segid  A  and resid    7 and name HD13)
assign (segid  A  and resid   61 and name   HA) (segid  A  and resid   29 and name HD22) 2.732 0.933 0.933 weight 1.000 ! spec=sumo...oesy, no=1459, id=2074, vol=2.805710e+00
    or (segid  A  and resid   61 and name   HA) (segid  A  and resid   29 and name HD21)
    or (segid  A  and resid   61 and name   HA) (segid  A  and resid   29 and name HD23)
assign (segid  A  and resid   61 and name   HB) (segid  A  and resid   29 and name HD22) 3.199 1.279 1.279 weight 1.000 ! spec=sumo...oesy, no=1460, id=2075, vol=1.089110e+00
    or (segid  A  and resid   61 and name   HB) (segid  A  and resid   29 and name HD21)
    or (segid  A  and resid   61 and name   HB) (segid  A  and resid   29 and name HD23)
assign (segid  A  and resid   62 and name   HA) (segid  A  and resid   29 and name HD22) 2.807 0.985 0.985 weight 1.000 ! spec=sumo...oesy, no=1461, id=2076, vol=2.386320e+00
    or (segid  A  and resid   62 and name   HA) (segid  A  and resid   29 and name HD21)
    or (segid  A  and resid   62 and name   HA) (segid  A  and resid   29 and name HD23)
assign (segid  A  and resid   29 and name HD22) (segid  A  and resid   62 and name  HG1) 2.497 0.779 0.779 weight 1.000 ! spec=sumo...oesy, no=1466, id=2079, vol=4.809180e+00
    or (segid  A  and resid   29 and name HD21) (segid  A  and resid   62 and name  HG1)
    or (segid  A  and resid   29 and name HD23) (segid  A  and resid   62 and name  HG1)
assign (segid  A  and resid   21 and name  HD1) (segid  A  and resid   32 and name HD22) 2.401 0.721 0.721 weight 1.000 ! spec=sumo...oesy, no=1481, id=2080, vol=6.087110e+00
    or (segid  A  and resid   21 and name  HD1) (segid  A  and resid   32 and name HD21)
    or (segid  A  and resid   21 and name  HD1) (segid  A  and resid   32 and name HD23)
    or (segid  A  and resid   21 and name  HD2) (segid  A  and resid   32 and name HD22)
    or (segid  A  and resid   21 and name  HD2) (segid  A  and resid   32 and name HD21)
    or (segid  A  and resid   21 and name  HD2) (segid  A  and resid   32 and name HD23)
assign (segid  A  and resid   49 and name  HD1) (segid  A  and resid   32 and name HD22) 2.530 0.800 0.800 weight 1.000 ! spec=sumo...oesy, no=1482, id=2081, vol=4.444800e+00
    or (segid  A  and resid   49 and name  HD1) (segid  A  and resid   32 and name HD21)
    or (segid  A  and resid   49 and name  HD1) (segid  A  and resid   32 and name HD23)
    or (segid  A  and resid   49 and name  HD2) (segid  A  and resid   32 and name HD22)
    or (segid  A  and resid   49 and name  HD2) (segid  A  and resid   32 and name HD21)
    or (segid  A  and resid   49 and name  HD2) (segid  A  and resid   32 and name HD23)
assign (segid  A  and resid   49 and name  HE1) (segid  A  and resid   32 and name HD22) 2.616 0.856 0.856 weight 1.000 ! spec=sumo...oesy, no=1483, id=2082, vol=3.637650e+00
    or (segid  A  and resid   49 and name  HE1) (segid  A  and resid   32 and name HD21)
    or (segid  A  and resid   49 and name  HE1) (segid  A  and resid   32 and name HD23)
    or (segid  A  and resid   49 and name  HE2) (segid  A  and resid   32 and name HD22)
    or (segid  A  and resid   49 and name  HE2) (segid  A  and resid   32 and name HD21)
    or (segid  A  and resid   49 and name  HE2) (segid  A  and resid   32 and name HD23)
assign (segid  A  and resid   32 and name HD22) (segid  A  and resid   29 and name   HA) 3.019 1.139 1.139 weight 1.000 ! spec=sumo...oesy, no=1485, id=2084, vol=1.539590e+00
    or (segid  A  and resid   32 and name HD21) (segid  A  and resid   29 and name   HA)
    or (segid  A  and resid   32 and name HD23) (segid  A  and resid   29 and name   HA)
assign (segid  A  and resid   33 and name   HA) (segid  A  and resid   32 and name HD22) 2.183 0.596 0.596 weight 1.000 ! spec=sumo...oesy, no=1487, id=2086, vol=1.078595e+01
    or (segid  A  and resid   33 and name   HA) (segid  A  and resid   32 and name HD21)
    or (segid  A  and resid   33 and name   HA) (segid  A  and resid   32 and name HD23)
assign (segid  A  and resid   21 and name  HB2) (segid  A  and resid   32 and name HD22) 2.841 1.009 1.009 weight 1.000 ! spec=sumo...oesy, no=1489, id=2088, vol=2.219710e+00
    or (segid  A  and resid   21 and name  HB2) (segid  A  and resid   32 and name HD21)
    or (segid  A  and resid   21 and name  HB2) (segid  A  and resid   32 and name HD23)
assign (segid  A  and resid   32 and name HD22) (segid  A  and resid   73 and name HG22) 2.642 0.872 0.872 weight 1.000 ! spec=sumo...oesy, no=1496, id=2089, vol=3.430000e+00
    or (segid  A  and resid   32 and name HD22) (segid  A  and resid   73 and name HG21)
    or (segid  A  and resid   32 and name HD22) (segid  A  and resid   73 and name HG23)
    or (segid  A  and resid   32 and name HD21) (segid  A  and resid   73 and name HG22)
    or (segid  A  and resid   32 and name HD21) (segid  A  and resid   73 and name HG21)
    or (segid  A  and resid   32 and name HD21) (segid  A  and resid   73 and name HG23)
    or (segid  A  and resid   32 and name HD23) (segid  A  and resid   73 and name HG22)
    or (segid  A  and resid   32 and name HD23) (segid  A  and resid   73 and name HG21)
    or (segid  A  and resid   32 and name HD23) (segid  A  and resid   73 and name HG23)
assign (segid  A  and resid   32 and name HD12) (segid  A  and resid   32 and name HD22) 1.783 0.397 0.397 weight 1.000 ! spec=sumo...oesy, no=1497, id=2090, vol=3.633288e+01
    or (segid  A  and resid   32 and name HD12) (segid  A  and resid   32 and name HD21)
    or (segid  A  and resid   32 and name HD12) (segid  A  and resid   32 and name HD23)
    or (segid  A  and resid   32 and name HD11) (segid  A  and resid   32 and name HD22)
    or (segid  A  and resid   32 and name HD11) (segid  A  and resid   32 and name HD21)
    or (segid  A  and resid   32 and name HD11) (segid  A  and resid   32 and name HD23)
    or (segid  A  and resid   32 and name HD13) (segid  A  and resid   32 and name HD22)
    or (segid  A  and resid   32 and name HD13) (segid  A  and resid   32 and name HD21)
    or (segid  A  and resid   32 and name HD13) (segid  A  and resid   32 and name HD23)
assign (segid  A  and resid   32 and name   HG) (segid  A  and resid   32 and name HD22) 1.910 0.456 0.456 weight 1.000 ! spec=sumo...oesy, no=1499, id=2092, vol=2.398629e+01
    or (segid  A  and resid   32 and name   HG) (segid  A  and resid   32 and name HD21)
    or (segid  A  and resid   32 and name   HG) (segid  A  and resid   32 and name HD23)
assign (segid  A  and resid   19 and name HG12) (segid  A  and resid   20 and name   HA) 3.032 1.149 1.149 weight 1.000 ! spec=sumo...oesy, no=1511, id=2094, vol=1.501460e+00
    or (segid  A  and resid   19 and name HG11) (segid  A  and resid   20 and name   HA)
    or (segid  A  and resid   19 and name HG13) (segid  A  and resid   20 and name   HA)
assign (segid  A  and resid   19 and name   HA) (segid  A  and resid   19 and name HG12) 1.976 0.488 0.488 weight 1.000 ! spec=sumo...oesy, no=1512, id=2095, vol=1.957765e+01
    or (segid  A  and resid   19 and name   HA) (segid  A  and resid   19 and name HG11)
    or (segid  A  and resid   19 and name   HA) (segid  A  and resid   19 and name HG13)
assign (segid  A  and resid   39 and name  HD1) (segid  A  and resid   19 and name HG12) 2.302 0.662 0.662 weight 1.000 ! spec=sumo...oesy, no=1514, id=2097, vol=7.843520e+00
    or (segid  A  and resid   39 and name  HD1) (segid  A  and resid   19 and name HG11)
    or (segid  A  and resid   39 and name  HD1) (segid  A  and resid   19 and name HG13)
assign (segid  A  and resid   19 and name HG12) (segid  A  and resid   19 and name   HB) 1.869 0.437 0.437 weight 1.000 ! spec=sumo...oesy, no=1515, id=2098, vol=2.732484e+01
    or (segid  A  and resid   19 and name HG11) (segid  A  and resid   19 and name   HB)
    or (segid  A  and resid   19 and name HG13) (segid  A  and resid   19 and name   HB)
assign (segid  A  and resid   72 and name   HA) (segid  A  and resid   72 and name HG21) 1.923 0.462 0.462 weight 1.000 ! spec=sumo...oesy, no=1518, id=2100, vol=2.305501e+01
    or (segid  A  and resid   72 and name   HA) (segid  A  and resid   72 and name HG22)
    or (segid  A  and resid   72 and name   HA) (segid  A  and resid   72 and name HG23)
assign (segid  A  and resid   11 and name   HA) (segid  A  and resid   72 and name HG21) 2.511 0.788 0.788 weight 1.000 ! spec=sumo...oesy, no=1519, id=2101, vol=4.655810e+00
    or (segid  A  and resid   11 and name   HA) (segid  A  and resid   72 and name HG22)
    or (segid  A  and resid   11 and name   HA) (segid  A  and resid   72 and name HG23)
assign (segid  A  and resid   72 and name   HB) (segid  A  and resid   72 and name HG21) 1.760 0.387 0.387 weight 1.000 ! spec=sumo...oesy, no=1521, id=2103, vol=3.930066e+01
    or (segid  A  and resid   72 and name   HB) (segid  A  and resid   72 and name HG22)
    or (segid  A  and resid   72 and name   HB) (segid  A  and resid   72 and name HG23)
assign (segid  A  and resid   72 and name HG21) (segid  A  and resid   10 and name  HE1) 2.839 1.007 1.007 weight 1.000 ! spec=sumo...oesy, no=1522, id=2104, vol=2.229240e+00
    or (segid  A  and resid   72 and name HG22) (segid  A  and resid   10 and name  HE1)
    or (segid  A  and resid   72 and name HG23) (segid  A  and resid   10 and name  HE1)
assign (segid  A  and resid   65 and name HD22) (segid  A  and resid   64 and name   HA) 3.208 1.286 1.286 weight 1.000 ! spec=sumo...oesy, no=1527, id=2108, vol=1.070030e+00
    or (segid  A  and resid   65 and name HD21) (segid  A  and resid   64 and name   HA)
    or (segid  A  and resid   65 and name HD23) (segid  A  and resid   64 and name   HA)
assign (segid  A  and resid   65 and name HD22) (segid  A  and resid   54 and name  HG2) 2.269 0.644 0.644 weight 1.000 ! spec=sumo...oesy, no=1528, id=2109, vol=8.539960e+00
    or (segid  A  and resid   65 and name HD21) (segid  A  and resid   54 and name  HG2)
    or (segid  A  and resid   65 and name HD23) (segid  A  and resid   54 and name  HG2)
assign (segid  A  and resid   65 and name HD22) (segid  A  and resid   64 and name  HB1) 2.873 1.032 1.032 weight 1.000 ! spec=sumo...oesy, no=1529, id=2110, vol=2.072940e+00
    or (segid  A  and resid   65 and name HD21) (segid  A  and resid   64 and name  HB1)
    or (segid  A  and resid   65 and name HD23) (segid  A  and resid   64 and name  HB1)
assign (segid  A  and resid   51 and name  HD1) (segid  A  and resid   65 and name HD22) 2.568 0.825 0.825 weight 1.000 ! spec=sumo...oesy, no=1530, id=2111, vol=4.061810e+00
    or (segid  A  and resid   51 and name  HD1) (segid  A  and resid   65 and name HD21)
    or (segid  A  and resid   51 and name  HD1) (segid  A  and resid   65 and name HD23)
    or (segid  A  and resid   51 and name  HD2) (segid  A  and resid   65 and name HD22)
    or (segid  A  and resid   51 and name  HD2) (segid  A  and resid   65 and name HD21)
    or (segid  A  and resid   51 and name  HD2) (segid  A  and resid   65 and name HD23)
assign (segid  A  and resid   65 and name   HA) (segid  A  and resid   65 and name HD22) 1.807 0.408 0.408 weight 1.000 ! spec=sumo...oesy, no=1531, id=2112, vol=3.352037e+01
    or (segid  A  and resid   65 and name   HA) (segid  A  and resid   65 and name HD21)
    or (segid  A  and resid   65 and name   HA) (segid  A  and resid   65 and name HD23)
assign (segid  A  and resid   65 and name HD22) (segid  A  and resid   60 and name  HB1) 2.610 0.851 0.851 weight 1.000 ! spec=sumo...oesy, no=1532, id=2113, vol=3.692390e+00
    or (segid  A  and resid   65 and name HD21) (segid  A  and resid   60 and name  HB1)
    or (segid  A  and resid   65 and name HD23) (segid  A  and resid   60 and name  HB1)
assign (segid  A  and resid   65 and name   HG) (segid  A  and resid   65 and name HD22) 1.822 0.415 0.415 weight 1.000 ! spec=sumo...oesy, no=1534, id=2115, vol=3.189150e+01
    or (segid  A  and resid   65 and name   HG) (segid  A  and resid   65 and name HD21)
    or (segid  A  and resid   65 and name   HG) (segid  A  and resid   65 and name HD23)
assign (segid  A  and resid   65 and name HD22) (segid  A  and resid   65 and name  HB2) 2.325 0.676 0.676 weight 1.000 ! spec=sumo...oesy, no=1535, id=2116, vol=7.382960e+00
    or (segid  A  and resid   65 and name HD21) (segid  A  and resid   65 and name  HB2)
    or (segid  A  and resid   65 and name HD23) (segid  A  and resid   65 and name  HB2)
assign (segid  A  and resid   65 and name HD22) (segid  A  and resid   29 and name HD12) 2.736 0.936 0.936 weight 1.000 ! spec=sumo...oesy, no=1536, id=2117, vol=2.780320e+00
    or (segid  A  and resid   65 and name HD22) (segid  A  and resid   29 and name HD11)
    or (segid  A  and resid   65 and name HD22) (segid  A  and resid   29 and name HD13)
    or (segid  A  and resid   65 and name HD21) (segid  A  and resid   29 and name HD12)
    or (segid  A  and resid   65 and name HD21) (segid  A  and resid   29 and name HD11)
    or (segid  A  and resid   65 and name HD21) (segid  A  and resid   29 and name HD13)
    or (segid  A  and resid   65 and name HD23) (segid  A  and resid   29 and name HD12)
    or (segid  A  and resid   65 and name HD23) (segid  A  and resid   29 and name HD11)
    or (segid  A  and resid   65 and name HD23) (segid  A  and resid   29 and name HD13)
assign (segid  A  and resid   42 and name HD22) (segid  A  and resid   42 and name   HA) 1.935 0.468 0.468 weight 1.000 ! spec=sumo...oesy, no=1537, id=2118, vol=2.221292e+01
    or (segid  A  and resid   42 and name HD21) (segid  A  and resid   42 and name   HA)
    or (segid  A  and resid   42 and name HD23) (segid  A  and resid   42 and name   HA)
assign (segid  A  and resid   42 and name   HG) (segid  A  and resid   42 and name HD22) 1.834 0.420 0.420 weight 1.000 ! spec=sumo...oesy, no=1541, id=2122, vol=3.067537e+01
    or (segid  A  and resid   42 and name   HG) (segid  A  and resid   42 and name HD21)
    or (segid  A  and resid   42 and name   HG) (segid  A  and resid   42 and name HD23)
assign (segid  A  and resid   11 and name HG12) (segid  A  and resid   19 and name HG22) 2.841 1.009 1.009 weight 1.000 ! spec=sumo...oesy, no=1545, id=2126, vol=2.218890e+00
    or (segid  A  and resid   11 and name HG12) (segid  A  and resid   19 and name HG21)
    or (segid  A  and resid   11 and name HG12) (segid  A  and resid   19 and name HG23)
    or (segid  A  and resid   11 and name HG11) (segid  A  and resid   19 and name HG22)
    or (segid  A  and resid   11 and name HG11) (segid  A  and resid   19 and name HG21)
    or (segid  A  and resid   11 and name HG11) (segid  A  and resid   19 and name HG23)
    or (segid  A  and resid   11 and name HG13) (segid  A  and resid   19 and name HG22)
    or (segid  A  and resid   11 and name HG13) (segid  A  and resid   19 and name HG21)
    or (segid  A  and resid   11 and name HG13) (segid  A  and resid   19 and name HG23)
assign (segid  A  and resid   11 and name HG22) (segid  A  and resid   49 and name   HZ) 2.568 0.824 0.824 weight 1.000 ! spec=sumo...oesy, no=1547, id=2127, vol=4.065910e+00
    or (segid  A  and resid   11 and name HG21) (segid  A  and resid   49 and name   HZ)
    or (segid  A  and resid   11 and name HG23) (segid  A  and resid   49 and name   HZ)
assign (segid  A  and resid   49 and name  HE1) (segid  A  and resid   11 and name HG22) 2.425 0.735 0.735 weight 1.000 ! spec=sumo...oesy, no=1549, id=2129, vol=5.738500e+00
    or (segid  A  and resid   49 and name  HE1) (segid  A  and resid   11 and name HG21)
    or (segid  A  and resid   49 and name  HE1) (segid  A  and resid   11 and name HG23)
    or (segid  A  and resid   49 and name  HE2) (segid  A  and resid   11 and name HG22)
    or (segid  A  and resid   49 and name  HE2) (segid  A  and resid   11 and name HG21)
    or (segid  A  and resid   49 and name  HE2) (segid  A  and resid   11 and name HG23)
assign (segid  A  and resid   11 and name HG22) (segid  A  and resid   36 and name  HE1) 2.337 0.683 0.683 weight 1.000 ! spec=sumo...oesy, no=1550, id=2130, vol=7.152950e+00
    or (segid  A  and resid   11 and name HG22) (segid  A  and resid   36 and name  HE2)
    or (segid  A  and resid   11 and name HG21) (segid  A  and resid   36 and name  HE1)
    or (segid  A  and resid   11 and name HG21) (segid  A  and resid   36 and name  HE2)
    or (segid  A  and resid   11 and name HG23) (segid  A  and resid   36 and name  HE1)
    or (segid  A  and resid   11 and name HG23) (segid  A  and resid   36 and name  HE2)
assign (segid  A  and resid   11 and name HG22) (segid  A  and resid   11 and name   HA) 2.011 0.506 0.506 weight 1.000 ! spec=sumo...oesy, no=1552, id=2132, vol=1.762865e+01
    or (segid  A  and resid   11 and name HG21) (segid  A  and resid   11 and name   HA)
    or (segid  A  and resid   11 and name HG23) (segid  A  and resid   11 and name   HA)
assign (segid  A  and resid   11 and name HG22) (segid  A  and resid   36 and name  HB1) 3.059 1.170 1.170 weight 1.000 ! spec=sumo...oesy, no=1553, id=2133, vol=1.423720e+00
    or (segid  A  and resid   11 and name HG21) (segid  A  and resid   36 and name  HB1)
    or (segid  A  and resid   11 and name HG23) (segid  A  and resid   36 and name  HB1)
assign (segid  A  and resid   11 and name   HB) (segid  A  and resid   11 and name HG22) 1.957 0.479 0.479 weight 1.000 ! spec=sumo...oesy, no=1554, id=2134, vol=2.074863e+01
    or (segid  A  and resid   11 and name   HB) (segid  A  and resid   11 and name HG21)
    or (segid  A  and resid   11 and name   HB) (segid  A  and resid   11 and name HG23)
assign (segid  A  and resid   11 and name HG22) (segid  A  and resid   73 and name   HB) 2.547 0.811 0.811 weight 1.000 ! spec=sumo...oesy, no=1555, id=2135, vol=4.270020e+00
    or (segid  A  and resid   11 and name HG21) (segid  A  and resid   73 and name   HB)
    or (segid  A  and resid   11 and name HG23) (segid  A  and resid   73 and name   HB)
assign (segid  A  and resid   75 and name   HB) (segid  A  and resid   11 and name HG22) 2.533 0.802 0.802 weight 1.000 ! spec=sumo...oesy, no=1556, id=2136, vol=4.416700e+00
    or (segid  A  and resid   75 and name   HB) (segid  A  and resid   11 and name HG21)
    or (segid  A  and resid   75 and name   HB) (segid  A  and resid   11 and name HG23)
assign (segid  A  and resid   11 and name HG22) (segid  A  and resid   75 and name HG22) 1.922 0.462 0.462 weight 1.000 ! spec=sumo...oesy, no=1562, id=2142, vol=2.314382e+01
    or (segid  A  and resid   11 and name HG22) (segid  A  and resid   75 and name HG21)
    or (segid  A  and resid   11 and name HG22) (segid  A  and resid   75 and name HG23)
    or (segid  A  and resid   11 and name HG21) (segid  A  and resid   75 and name HG22)
    or (segid  A  and resid   11 and name HG21) (segid  A  and resid   75 and name HG21)
    or (segid  A  and resid   11 and name HG21) (segid  A  and resid   75 and name HG23)
    or (segid  A  and resid   11 and name HG23) (segid  A  and resid   75 and name HG22)
    or (segid  A  and resid   11 and name HG23) (segid  A  and resid   75 and name HG21)
    or (segid  A  and resid   11 and name HG23) (segid  A  and resid   75 and name HG23)
assign (segid  A  and resid   27 and name   HB) (segid  A  and resid   27 and name HG21) 1.894 0.448 0.448 weight 1.000 ! spec=sumo...oesy, no=1575, id=2146, vol=2.528856e+01
    or (segid  A  and resid   27 and name   HB) (segid  A  and resid   27 and name HG22)
    or (segid  A  and resid   27 and name   HB) (segid  A  and resid   27 and name HG23)
assign (segid  A  and resid   27 and name HG21) (segid  A  and resid   28 and name  HD2) 2.154 0.580 0.580 weight 1.000 ! spec=sumo...oesy, no=1576, id=2147, vol=1.167131e+01
    or (segid  A  and resid   27 and name HG22) (segid  A  and resid   28 and name  HD2)
    or (segid  A  and resid   27 and name HG23) (segid  A  and resid   28 and name  HD2)
assign (segid  A  and resid   27 and name HG21) (segid  A  and resid   31 and name  HE1) 2.647 0.876 0.876 weight 1.000 ! spec=sumo...oesy, no=1577, id=2148, vol=3.387960e+00
    or (segid  A  and resid   27 and name HG22) (segid  A  and resid   31 and name  HE1)
    or (segid  A  and resid   27 and name HG23) (segid  A  and resid   31 and name  HE1)
assign (segid  A  and resid   12 and name  HB2) (segid  A  and resid   18 and name   HB) 2.167 0.587 0.587 weight 1.000 ! spec=sumo...oesy, no=1579, id=2150, vol=1.127341e+01
    or (segid  A  and resid   12 and name  HB1) (segid  A  and resid   18 and name   HB)
    or (segid  A  and resid   12 and name  HB3) (segid  A  and resid   18 and name   HB)
assign (segid  A  and resid   59 and name   HB) (segid  A  and resid   59 and name HG21) 1.756 0.386 0.386 weight 1.000 ! spec=sumo...oesy, no=1583, id=2151, vol=3.974035e+01
    or (segid  A  and resid   59 and name   HB) (segid  A  and resid   59 and name HG22)
    or (segid  A  and resid   59 and name   HB) (segid  A  and resid   59 and name HG23)
assign (segid  A  and resid   11 and name HG22) (segid  A  and resid   19 and name HG22) 2.778 0.964 0.964 weight 1.000 ! spec=sumo...oesy, no=1591, id=2158, vol=2.538710e+00
    or (segid  A  and resid   11 and name HG22) (segid  A  and resid   19 and name HG21)
    or (segid  A  and resid   11 and name HG22) (segid  A  and resid   19 and name HG23)
    or (segid  A  and resid   11 and name HG21) (segid  A  and resid   19 and name HG22)
    or (segid  A  and resid   11 and name HG21) (segid  A  and resid   19 and name HG21)
    or (segid  A  and resid   11 and name HG21) (segid  A  and resid   19 and name HG23)
    or (segid  A  and resid   11 and name HG23) (segid  A  and resid   19 and name HG22)
    or (segid  A  and resid   11 and name HG23) (segid  A  and resid   19 and name HG21)
    or (segid  A  and resid   11 and name HG23) (segid  A  and resid   19 and name HG23)
assign (segid  A  and resid   18 and name HG22) (segid  A  and resid   19 and name   HA) 2.603 0.847 0.847 weight 1.000 ! spec=sumo...oesy, no=1596, id=2161, vol=3.751570e+00
    or (segid  A  and resid   18 and name HG21) (segid  A  and resid   19 and name   HA)
    or (segid  A  and resid   18 and name HG23) (segid  A  and resid   19 and name   HA)
assign (segid  A  and resid   18 and name   HB) (segid  A  and resid   18 and name HG22) 1.747 0.381 0.381 weight 1.000 ! spec=sumo...oesy, no=1599, id=2163, vol=4.107643e+01
    or (segid  A  and resid   18 and name   HB) (segid  A  and resid   18 and name HG21)
    or (segid  A  and resid   18 and name   HB) (segid  A  and resid   18 and name HG23)
assign (segid  A  and resid   21 and name  HD1) (segid  A  and resid   11 and name HG12) 2.021 0.511 0.511 weight 1.000 ! spec=sumo...oesy, no=1601, id=2164, vol=1.711605e+01
    or (segid  A  and resid   21 and name  HD1) (segid  A  and resid   11 and name HG11)
    or (segid  A  and resid   21 and name  HD1) (segid  A  and resid   11 and name HG13)
    or (segid  A  and resid   21 and name  HD2) (segid  A  and resid   11 and name HG12)
    or (segid  A  and resid   21 and name  HD2) (segid  A  and resid   11 and name HG11)
    or (segid  A  and resid   21 and name  HD2) (segid  A  and resid   11 and name HG13)
assign (segid  A  and resid   36 and name  HD1) (segid  A  and resid   11 and name HG12) 2.400 0.720 0.720 weight 1.000 ! spec=sumo...oesy, no=1602, id=2165, vol=6.103330e+00
    or (segid  A  and resid   36 and name  HD1) (segid  A  and resid   11 and name HG11)
    or (segid  A  and resid   36 and name  HD1) (segid  A  and resid   11 and name HG13)
    or (segid  A  and resid   36 and name  HD2) (segid  A  and resid   11 and name HG12)
    or (segid  A  and resid   36 and name  HD2) (segid  A  and resid   11 and name HG11)
    or (segid  A  and resid   36 and name  HD2) (segid  A  and resid   11 and name HG13)
assign (segid  A  and resid   11 and name HG12) (segid  A  and resid   49 and name  HE1) 2.850 1.015 1.015 weight 1.000 ! spec=sumo...oesy, no=1603, id=2166, vol=2.178340e+00
    or (segid  A  and resid   11 and name HG12) (segid  A  and resid   49 and name  HE2)
    or (segid  A  and resid   11 and name HG11) (segid  A  and resid   49 and name  HE1)
    or (segid  A  and resid   11 and name HG11) (segid  A  and resid   49 and name  HE2)
    or (segid  A  and resid   11 and name HG13) (segid  A  and resid   49 and name  HE1)
    or (segid  A  and resid   11 and name HG13) (segid  A  and resid   49 and name  HE2)
assign (segid  A  and resid   11 and name HG12) (segid  A  and resid   36 and name  HE1) 2.752 0.947 0.947 weight 1.000 ! spec=sumo...oesy, no=1604, id=2167, vol=2.683960e+00
    or (segid  A  and resid   11 and name HG12) (segid  A  and resid   36 and name  HE2)
    or (segid  A  and resid   11 and name HG11) (segid  A  and resid   36 and name  HE1)
    or (segid  A  and resid   11 and name HG11) (segid  A  and resid   36 and name  HE2)
    or (segid  A  and resid   11 and name HG13) (segid  A  and resid   36 and name  HE1)
    or (segid  A  and resid   11 and name HG13) (segid  A  and resid   36 and name  HE2)
assign (segid  A  and resid   36 and name  HB1) (segid  A  and resid   11 and name HG12) 2.969 1.102 1.102 weight 1.000 ! spec=sumo...oesy, no=1608, id=2170, vol=1.702490e+00
    or (segid  A  and resid   36 and name  HB1) (segid  A  and resid   11 and name HG11)
    or (segid  A  and resid   36 and name  HB1) (segid  A  and resid   11 and name HG13)
assign (segid  A  and resid   21 and name  HB2) (segid  A  and resid   11 and name HG12) 2.905 1.055 1.055 weight 1.000 ! spec=sumo...oesy, no=1610, id=2172, vol=1.941450e+00
    or (segid  A  and resid   21 and name  HB2) (segid  A  and resid   11 and name HG11)
    or (segid  A  and resid   21 and name  HB2) (segid  A  and resid   11 and name HG13)
assign (segid  A  and resid   11 and name   HB) (segid  A  and resid   11 and name HG12) 1.937 0.469 0.469 weight 1.000 ! spec=sumo...oesy, no=1611, id=2173, vol=2.208507e+01
    or (segid  A  and resid   11 and name   HB) (segid  A  and resid   11 and name HG11)
    or (segid  A  and resid   11 and name   HB) (segid  A  and resid   11 and name HG13)
assign (segid  A  and resid   32 and name HD22) (segid  A  and resid   11 and name HG12) 2.083 0.542 0.542 weight 1.000 ! spec=sumo...oesy, no=1616, id=2176, vol=1.429492e+01
    or (segid  A  and resid   32 and name HD22) (segid  A  and resid   11 and name HG11)
    or (segid  A  and resid   32 and name HD22) (segid  A  and resid   11 and name HG13)
    or (segid  A  and resid   32 and name HD21) (segid  A  and resid   11 and name HG12)
    or (segid  A  and resid   32 and name HD21) (segid  A  and resid   11 and name HG11)
    or (segid  A  and resid   32 and name HD21) (segid  A  and resid   11 and name HG13)
    or (segid  A  and resid   32 and name HD23) (segid  A  and resid   11 and name HG12)
    or (segid  A  and resid   32 and name HD23) (segid  A  and resid   11 and name HG11)
    or (segid  A  and resid   32 and name HD23) (segid  A  and resid   11 and name HG13)
assign (segid  A  and resid   11 and name HG22) (segid  A  and resid   11 and name HG12) 1.782 0.397 0.397 weight 1.000 ! spec=sumo...oesy, no=1617, id=2177, vol=3.643200e+01
    or (segid  A  and resid   11 and name HG22) (segid  A  and resid   11 and name HG11)
    or (segid  A  and resid   11 and name HG22) (segid  A  and resid   11 and name HG13)
    or (segid  A  and resid   11 and name HG21) (segid  A  and resid   11 and name HG12)
    or (segid  A  and resid   11 and name HG21) (segid  A  and resid   11 and name HG11)
    or (segid  A  and resid   11 and name HG21) (segid  A  and resid   11 and name HG13)
    or (segid  A  and resid   11 and name HG23) (segid  A  and resid   11 and name HG12)
    or (segid  A  and resid   11 and name HG23) (segid  A  and resid   11 and name HG11)
    or (segid  A  and resid   11 and name HG23) (segid  A  and resid   11 and name HG13)
assign (segid  A  and resid   75 and name HG12) (segid  A  and resid   36 and name  HE1) 2.272 0.645 0.645 weight 1.000 ! spec=sumo...oesy, no=1619, id=2179, vol=8.476400e+00
    or (segid  A  and resid   75 and name HG12) (segid  A  and resid   36 and name  HE2)
    or (segid  A  and resid   75 and name HG11) (segid  A  and resid   36 and name  HE1)
    or (segid  A  and resid   75 and name HG11) (segid  A  and resid   36 and name  HE2)
    or (segid  A  and resid   75 and name HG13) (segid  A  and resid   36 and name  HE1)
    or (segid  A  and resid   75 and name HG13) (segid  A  and resid   36 and name  HE2)
assign (segid  A  and resid   13 and name  HA1) (segid  A  and resid   75 and name HG12) 2.799 0.979 0.979 weight 1.000 ! spec=sumo...oesy, no=1622, id=2182, vol=2.425010e+00
    or (segid  A  and resid   13 and name  HA1) (segid  A  and resid   75 and name HG11)
    or (segid  A  and resid   13 and name  HA1) (segid  A  and resid   75 and name HG13)
assign (segid  A  and resid   75 and name HG12) (segid  A  and resid   13 and name  HA2) 2.852 1.017 1.017 weight 1.000 ! spec=sumo...oesy, no=1623, id=2183, vol=2.167270e+00
    or (segid  A  and resid   75 and name HG11) (segid  A  and resid   13 and name  HA2)
    or (segid  A  and resid   75 and name HG13) (segid  A  and resid   13 and name  HA2)
assign (segid  A  and resid   75 and name HG12) (segid  A  and resid   14 and name  HG1) 2.849 1.015 1.015 weight 1.000 ! spec=sumo...oesy, no=1625, id=2184, vol=2.178860e+00
    or (segid  A  and resid   75 and name HG11) (segid  A  and resid   14 and name  HG1)
    or (segid  A  and resid   75 and name HG13) (segid  A  and resid   14 and name  HG1)
assign (segid  A  and resid   75 and name HG12) (segid  A  and resid   14 and name  HB2) 2.846 1.013 1.013 weight 1.000 ! spec=sumo...oesy, no=1627, id=2186, vol=2.192800e+00
    or (segid  A  and resid   75 and name HG11) (segid  A  and resid   14 and name  HB2)
    or (segid  A  and resid   75 and name HG13) (segid  A  and resid   14 and name  HB2)
assign (segid  A  and resid   75 and name   HB) (segid  A  and resid   75 and name HG12) 2.016 0.508 0.508 weight 1.000 ! spec=sumo...oesy, no=1629, id=2188, vol=1.737504e+01
    or (segid  A  and resid   75 and name   HB) (segid  A  and resid   75 and name HG11)
    or (segid  A  and resid   75 and name   HB) (segid  A  and resid   75 and name HG13)
assign (segid  A  and resid   49 and name   HZ) (segid  A  and resid   75 and name HG22) 2.814 0.990 0.990 weight 1.000 ! spec=sumo...oesy, no=1637, id=2192, vol=2.346740e+00
    or (segid  A  and resid   49 and name   HZ) (segid  A  and resid   75 and name HG21)
    or (segid  A  and resid   49 and name   HZ) (segid  A  and resid   75 and name HG23)
assign (segid  A  and resid   49 and name  HE1) (segid  A  and resid   75 and name HG22) 2.380 0.708 0.708 weight 1.000 ! spec=sumo...oesy, no=1639, id=2194, vol=6.415530e+00
    or (segid  A  and resid   49 and name  HE1) (segid  A  and resid   75 and name HG21)
    or (segid  A  and resid   49 and name  HE1) (segid  A  and resid   75 and name HG23)
    or (segid  A  and resid   49 and name  HE2) (segid  A  and resid   75 and name HG22)
    or (segid  A  and resid   49 and name  HE2) (segid  A  and resid   75 and name HG21)
    or (segid  A  and resid   49 and name  HE2) (segid  A  and resid   75 and name HG23)
assign (segid  A  and resid   75 and name HG22) (segid  A  and resid   36 and name  HE1) 2.240 0.627 0.627 weight 1.000 ! spec=sumo...oesy, no=1640, id=2195, vol=9.242450e+00
    or (segid  A  and resid   75 and name HG22) (segid  A  and resid   36 and name  HE2)
    or (segid  A  and resid   75 and name HG21) (segid  A  and resid   36 and name  HE1)
    or (segid  A  and resid   75 and name HG21) (segid  A  and resid   36 and name  HE2)
    or (segid  A  and resid   75 and name HG23) (segid  A  and resid   36 and name  HE1)
    or (segid  A  and resid   75 and name HG23) (segid  A  and resid   36 and name  HE2)
assign (segid  A  and resid   49 and name   HA) (segid  A  and resid   75 and name HG22) 2.455 0.753 0.753 weight 1.000 ! spec=sumo...oesy, no=1641, id=2196, vol=5.325620e+00
    or (segid  A  and resid   49 and name   HA) (segid  A  and resid   75 and name HG21)
    or (segid  A  and resid   49 and name   HA) (segid  A  and resid   75 and name HG23)
assign (segid  A  and resid   75 and name HG22) (segid  A  and resid   75 and name   HA) 2.199 0.604 0.604 weight 1.000 ! spec=sumo...oesy, no=1643, id=2198, vol=1.031323e+01
    or (segid  A  and resid   75 and name HG21) (segid  A  and resid   75 and name   HA)
    or (segid  A  and resid   75 and name HG23) (segid  A  and resid   75 and name   HA)
assign (segid  A  and resid   75 and name HG22) (segid  A  and resid   13 and name  HA2) 2.827 0.999 0.999 weight 1.000 ! spec=sumo...oesy, no=1645, id=2200, vol=2.286510e+00
    or (segid  A  and resid   75 and name HG21) (segid  A  and resid   13 and name  HA2)
    or (segid  A  and resid   75 and name HG23) (segid  A  and resid   13 and name  HA2)
assign (segid  A  and resid   11 and name   HB) (segid  A  and resid   75 and name HG22) 2.754 0.948 0.948 weight 1.000 ! spec=sumo...oesy, no=1646, id=2201, vol=2.675710e+00
    or (segid  A  and resid   11 and name   HB) (segid  A  and resid   75 and name HG21)
    or (segid  A  and resid   11 and name   HB) (segid  A  and resid   75 and name HG23)
assign (segid  A  and resid   75 and name   HB) (segid  A  and resid   75 and name HG22) 2.013 0.506 0.506 weight 1.000 ! spec=sumo...oesy, no=1647, id=2202, vol=1.753573e+01
    or (segid  A  and resid   75 and name   HB) (segid  A  and resid   75 and name HG21)
    or (segid  A  and resid   75 and name   HB) (segid  A  and resid   75 and name HG23)
assign (segid  A  and resid   75 and name HG22) (segid  A  and resid   73 and name HG22) 2.586 0.836 0.836 weight 1.000 ! spec=sumo...oesy, no=1648, id=2203, vol=3.896770e+00
    or (segid  A  and resid   75 and name HG22) (segid  A  and resid   73 and name HG21)
    or (segid  A  and resid   75 and name HG22) (segid  A  and resid   73 and name HG23)
    or (segid  A  and resid   75 and name HG21) (segid  A  and resid   73 and name HG22)
    or (segid  A  and resid   75 and name HG21) (segid  A  and resid   73 and name HG21)
    or (segid  A  and resid   75 and name HG21) (segid  A  and resid   73 and name HG23)
    or (segid  A  and resid   75 and name HG23) (segid  A  and resid   73 and name HG22)
    or (segid  A  and resid   75 and name HG23) (segid  A  and resid   73 and name HG21)
    or (segid  A  and resid   75 and name HG23) (segid  A  and resid   73 and name HG23)
assign (segid  A  and resid   75 and name HG22) (segid  A  and resid   47 and name HD12) 2.184 0.596 0.596 weight 1.000 ! spec=sumo...oesy, no=1649, id=2204, vol=1.075529e+01
    or (segid  A  and resid   75 and name HG22) (segid  A  and resid   47 and name HD11)
    or (segid  A  and resid   75 and name HG22) (segid  A  and resid   47 and name HD13)
    or (segid  A  and resid   75 and name HG21) (segid  A  and resid   47 and name HD12)
    or (segid  A  and resid   75 and name HG21) (segid  A  and resid   47 and name HD11)
    or (segid  A  and resid   75 and name HG21) (segid  A  and resid   47 and name HD13)
    or (segid  A  and resid   75 and name HG23) (segid  A  and resid   47 and name HD12)
    or (segid  A  and resid   75 and name HG23) (segid  A  and resid   47 and name HD11)
    or (segid  A  and resid   75 and name HG23) (segid  A  and resid   47 and name HD13)
assign (segid  A  and resid   36 and name  HD1) (segid  A  and resid   19 and name HG22) 2.319 0.672 0.672 weight 1.000 ! spec=sumo...oesy, no=1684, id=2211, vol=7.505060e+00
    or (segid  A  and resid   36 and name  HD1) (segid  A  and resid   19 and name HG21)
    or (segid  A  and resid   36 and name  HD1) (segid  A  and resid   19 and name HG23)
    or (segid  A  and resid   36 and name  HD2) (segid  A  and resid   19 and name HG22)
    or (segid  A  and resid   36 and name  HD2) (segid  A  and resid   19 and name HG21)
    or (segid  A  and resid   36 and name  HD2) (segid  A  and resid   19 and name HG23)
assign (segid  A  and resid   19 and name HG22) (segid  A  and resid   36 and name  HE1) 2.060 0.531 0.531 weight 1.000 ! spec=sumo...oesy, no=1685, id=2212, vol=1.524128e+01
    or (segid  A  and resid   19 and name HG22) (segid  A  and resid   36 and name  HE2)
    or (segid  A  and resid   19 and name HG21) (segid  A  and resid   36 and name  HE1)
    or (segid  A  and resid   19 and name HG21) (segid  A  and resid   36 and name  HE2)
    or (segid  A  and resid   19 and name HG23) (segid  A  and resid   36 and name  HE1)
    or (segid  A  and resid   19 and name HG23) (segid  A  and resid   36 and name  HE2)
assign (segid  A  and resid   18 and name   HA) (segid  A  and resid   19 and name HG22) 2.832 1.003 1.003 weight 1.000 ! spec=sumo...oesy, no=1686, id=2213, vol=2.260670e+00
    or (segid  A  and resid   18 and name   HA) (segid  A  and resid   19 and name HG21)
    or (segid  A  and resid   18 and name   HA) (segid  A  and resid   19 and name HG23)
assign (segid  A  and resid   19 and name HG22) (segid  A  and resid   36 and name   HA) 3.021 1.140 1.140 weight 1.000 ! spec=sumo...oesy, no=1688, id=2214, vol=1.535690e+00
    or (segid  A  and resid   19 and name HG21) (segid  A  and resid   36 and name   HA)
    or (segid  A  and resid   19 and name HG23) (segid  A  and resid   36 and name   HA)
assign (segid  A  and resid   39 and name  HD1) (segid  A  and resid   19 and name HG22) 2.521 0.795 0.795 weight 1.000 ! spec=sumo...oesy, no=1689, id=2215, vol=4.540070e+00
    or (segid  A  and resid   39 and name  HD1) (segid  A  and resid   19 and name HG21)
    or (segid  A  and resid   39 and name  HD1) (segid  A  and resid   19 and name HG23)
assign (segid  A  and resid   19 and name HG22) (segid  A  and resid   19 and name   HB) 1.896 0.449 0.449 weight 1.000 ! spec=sumo...oesy, no=1690, id=2216, vol=2.512053e+01
    or (segid  A  and resid   19 and name HG21) (segid  A  and resid   19 and name   HB)
    or (segid  A  and resid   19 and name HG23) (segid  A  and resid   19 and name   HB)
assign (segid  A  and resid   19 and name HG12) (segid  A  and resid   19 and name HG22) 1.727 0.373 0.373 weight 1.000 ! spec=sumo...oesy, no=1693, id=2217, vol=4.400882e+01
    or (segid  A  and resid   19 and name HG12) (segid  A  and resid   19 and name HG21)
    or (segid  A  and resid   19 and name HG12) (segid  A  and resid   19 and name HG23)
    or (segid  A  and resid   19 and name HG11) (segid  A  and resid   19 and name HG22)
    or (segid  A  and resid   19 and name HG11) (segid  A  and resid   19 and name HG21)
    or (segid  A  and resid   19 and name HG11) (segid  A  and resid   19 and name HG23)
    or (segid  A  and resid   19 and name HG13) (segid  A  and resid   19 and name HG22)
    or (segid  A  and resid   19 and name HG13) (segid  A  and resid   19 and name HG21)
    or (segid  A  and resid   19 and name HG13) (segid  A  and resid   19 and name HG23)
assign (segid  A  and resid   61 and name   HA) (segid  A  and resid   61 and name HG21) 2.106 0.554 0.554 weight 1.000 ! spec=sumo...oesy, no=1694, id=2218, vol=1.337556e+01
    or (segid  A  and resid   61 and name   HA) (segid  A  and resid   61 and name HG22)
    or (segid  A  and resid   61 and name   HA) (segid  A  and resid   61 and name HG23)
assign (segid  A  and resid   61 and name HG21) (segid  A  and resid   26 and name  HB1) 3.021 1.140 1.140 weight 1.000 ! spec=sumo...oesy, no=1699, id=2220, vol=1.535510e+00
    or (segid  A  and resid   61 and name HG22) (segid  A  and resid   26 and name  HB1)
    or (segid  A  and resid   61 and name HG23) (segid  A  and resid   26 and name  HB1)
assign (segid  A  and resid   18 and name   HB) (segid  A  and resid   18 and name HG12) 1.762 0.388 0.388 weight 1.000 ! spec=sumo...oesy, no=1708, id=2226, vol=3.897702e+01
    or (segid  A  and resid   18 and name   HB) (segid  A  and resid   18 and name HG11)
    or (segid  A  and resid   18 and name   HB) (segid  A  and resid   18 and name HG13)
assign (segid  A  and resid   12 and name   HA) (segid  A  and resid   12 and name  HB2) 1.821 0.414 0.414 weight 1.000 ! spec=sumo...oesy, no=1722, id=2228, vol=3.202634e+01
    or (segid  A  and resid   12 and name   HA) (segid  A  and resid   12 and name  HB1)
    or (segid  A  and resid   12 and name   HA) (segid  A  and resid   12 and name  HB3)
assign (segid  A  and resid   12 and name  HB2) (segid  A  and resid   18 and name HG12) 2.103 0.553 0.553 weight 1.000 ! spec=sumo...oesy, no=1725, id=2230, vol=1.348863e+01
    or (segid  A  and resid   12 and name  HB2) (segid  A  and resid   18 and name HG11)
    or (segid  A  and resid   12 and name  HB2) (segid  A  and resid   18 and name HG13)
    or (segid  A  and resid   12 and name  HB1) (segid  A  and resid   18 and name HG12)
    or (segid  A  and resid   12 and name  HB1) (segid  A  and resid   18 and name HG11)
    or (segid  A  and resid   12 and name  HB1) (segid  A  and resid   18 and name HG13)
    or (segid  A  and resid   12 and name  HB3) (segid  A  and resid   18 and name HG12)
    or (segid  A  and resid   12 and name  HB3) (segid  A  and resid   18 and name HG11)
    or (segid  A  and resid   12 and name  HB3) (segid  A  and resid   18 and name HG13)
assign (segid  A  and resid   11 and name HG22) (segid  A  and resid   12 and name  HB2) 3.056 1.167 1.167 weight 1.000 ! spec=sumo...oesy, no=1726, id=2231, vol=1.432540e+00
    or (segid  A  and resid   11 and name HG22) (segid  A  and resid   12 and name  HB1)
    or (segid  A  and resid   11 and name HG22) (segid  A  and resid   12 and name  HB3)
    or (segid  A  and resid   11 and name HG21) (segid  A  and resid   12 and name  HB2)
    or (segid  A  and resid   11 and name HG21) (segid  A  and resid   12 and name  HB1)
    or (segid  A  and resid   11 and name HG21) (segid  A  and resid   12 and name  HB3)
    or (segid  A  and resid   11 and name HG23) (segid  A  and resid   12 and name  HB2)
    or (segid  A  and resid   11 and name HG23) (segid  A  and resid   12 and name  HB1)
    or (segid  A  and resid   11 and name HG23) (segid  A  and resid   12 and name  HB3)
assign (segid  A  and resid   18 and name HG12) (segid  A  and resid   18 and name HG22) 2.385 0.711 0.711 weight 1.000 ! spec=sumo...oesy, no=1727, id=2232, vol=6.335870e+00
    or (segid  A  and resid   18 and name HG12) (segid  A  and resid   18 and name HG21)
    or (segid  A  and resid   18 and name HG12) (segid  A  and resid   18 and name HG23)
    or (segid  A  and resid   18 and name HG11) (segid  A  and resid   18 and name HG22)
    or (segid  A  and resid   18 and name HG11) (segid  A  and resid   18 and name HG21)
    or (segid  A  and resid   18 and name HG11) (segid  A  and resid   18 and name HG23)
    or (segid  A  and resid   18 and name HG13) (segid  A  and resid   18 and name HG22)
    or (segid  A  and resid   18 and name HG13) (segid  A  and resid   18 and name HG21)
    or (segid  A  and resid   18 and name HG13) (segid  A  and resid   18 and name HG23)
assign (segid  A  and resid   56 and name HG22) (segid  A  and resid   60 and name  HB2) 2.654 0.881 0.881 weight 1.000 ! spec=sumo...oesy, no=1739, id=2235, vol=3.335770e+00
    or (segid  A  and resid   56 and name HG21) (segid  A  and resid   60 and name  HB2)
    or (segid  A  and resid   56 and name HG23) (segid  A  and resid   60 and name  HB2)
assign (segid  A  and resid   56 and name HG22) (segid  A  and resid   49 and name  HD1) 3.224 1.299 1.299 weight 1.000 ! spec=sumo...oesy, no=1741, id=2237, vol=1.039340e+00
    or (segid  A  and resid   56 and name HG22) (segid  A  and resid   49 and name  HD2)
    or (segid  A  and resid   56 and name HG21) (segid  A  and resid   49 and name  HD1)
    or (segid  A  and resid   56 and name HG21) (segid  A  and resid   49 and name  HD2)
    or (segid  A  and resid   56 and name HG23) (segid  A  and resid   49 and name  HD1)
    or (segid  A  and resid   56 and name HG23) (segid  A  and resid   49 and name  HD2)
assign (segid  A  and resid   56 and name   HA) (segid  A  and resid   56 and name HG22) 2.149 0.577 0.577 weight 1.000 ! spec=sumo...oesy, no=1743, id=2239, vol=1.185016e+01
    or (segid  A  and resid   56 and name   HA) (segid  A  and resid   56 and name HG21)
    or (segid  A  and resid   56 and name   HA) (segid  A  and resid   56 and name HG23)
assign (segid  A  and resid   49 and name  HB1) (segid  A  and resid   56 and name HG22) 2.321 0.673 0.673 weight 1.000 ! spec=sumo...oesy, no=1744, id=2240, vol=7.459860e+00
    or (segid  A  and resid   49 and name  HB1) (segid  A  and resid   56 and name HG21)
    or (segid  A  and resid   49 and name  HB1) (segid  A  and resid   56 and name HG23)
assign (segid  A  and resid   56 and name HG22) (segid  A  and resid   56 and name   HB) 1.928 0.465 0.465 weight 1.000 ! spec=sumo...oesy, no=1746, id=2242, vol=2.268038e+01
    or (segid  A  and resid   56 and name HG21) (segid  A  and resid   56 and name   HB)
    or (segid  A  and resid   56 and name HG23) (segid  A  and resid   56 and name   HB)
assign (segid  A  and resid   47 and name HG11) (segid  A  and resid   49 and name  HD1) 2.595 0.842 0.842 weight 1.000 ! spec=sumo...oesy, no=1763, id=2246, vol=3.815920e+00
    or (segid  A  and resid   47 and name HG11) (segid  A  and resid   49 and name  HD2)
assign (segid  A  and resid   49 and name  HE1) (segid  A  and resid   47 and name HG11) 2.645 0.875 0.875 weight 1.000 ! spec=sumo...oesy, no=1764, id=2247, vol=3.402610e+00
    or (segid  A  and resid   49 and name  HE2) (segid  A  and resid   47 and name HG11)
assign (segid  A  and resid   44 and name   HA) (segid  A  and resid   47 and name HG11) 2.703 0.913 0.913 weight 1.000 ! spec=sumo...oesy, no=1769, id=2252, vol=2.992390e+00
assign (segid  A  and resid   47 and name HG12) (segid  A  and resid   77 and name  HG1) 2.210 0.610 0.610 weight 1.000 ! spec=sumo...oesy, no=1771, id=2254, vol=1.002261e+01
assign (segid  A  and resid   47 and name HG11) (segid  A  and resid   47 and name HG22) 2.057 0.529 0.529 weight 1.000 ! spec=sumo...oesy, no=1777, id=2259, vol=1.541539e+01
    or (segid  A  and resid   47 and name HG11) (segid  A  and resid   47 and name HG21)
    or (segid  A  and resid   47 and name HG11) (segid  A  and resid   47 and name HG23)
assign (segid  A  and resid   47 and name HG12) (segid  A  and resid   75 and name HG12) 2.415 0.729 0.729 weight 1.000 ! spec=sumo...oesy, no=1779, id=2261, vol=5.879040e+00
    or (segid  A  and resid   47 and name HG12) (segid  A  and resid   75 and name HG11)
    or (segid  A  and resid   47 and name HG12) (segid  A  and resid   75 and name HG13)
assign (segid  A  and resid   35 and name  HB2) (segid  A  and resid   21 and name  HD1) 2.248 0.632 0.632 weight 1.000 ! spec=sumo...oesy, no=1785, id=2264, vol=9.025140e+00
    or (segid  A  and resid   35 and name  HB2) (segid  A  and resid   21 and name  HD2)
    or (segid  A  and resid   35 and name  HB1) (segid  A  and resid   21 and name  HD1)
    or (segid  A  and resid   35 and name  HB1) (segid  A  and resid   21 and name  HD2)
    or (segid  A  and resid   35 and name  HB3) (segid  A  and resid   21 and name  HD1)
    or (segid  A  and resid   35 and name  HB3) (segid  A  and resid   21 and name  HD2)
assign (segid  A  and resid   35 and name   HA) (segid  A  and resid   35 and name  HB2) 1.792 0.401 0.401 weight 1.000 ! spec=sumo...oesy, no=1786, id=2265, vol=3.522819e+01
    or (segid  A  and resid   35 and name   HA) (segid  A  and resid   35 and name  HB1)
    or (segid  A  and resid   35 and name   HA) (segid  A  and resid   35 and name  HB3)
assign (segid  A  and resid   35 and name  HB2) (segid  A  and resid   32 and name   HA) 2.244 0.630 0.630 weight 1.000 ! spec=sumo...oesy, no=1787, id=2266, vol=9.122150e+00
    or (segid  A  and resid   35 and name  HB1) (segid  A  and resid   32 and name   HA)
    or (segid  A  and resid   35 and name  HB3) (segid  A  and resid   32 and name   HA)
assign (segid  A  and resid   63 and name  HB2) (segid  A  and resid   26 and name   HA) 2.737 0.936 0.936 weight 1.000 ! spec=sumo...oesy, no=1805, id=2268, vol=2.775650e+00
    or (segid  A  and resid   63 and name  HB1) (segid  A  and resid   26 and name   HA)
    or (segid  A  and resid   63 and name  HB3) (segid  A  and resid   26 and name   HA)
assign (segid  A  and resid   61 and name   HB) (segid  A  and resid   63 and name  HB2) 2.956 1.093 1.093 weight 1.000 ! spec=sumo...oesy, no=1806, id=2269, vol=1.746520e+00
    or (segid  A  and resid   61 and name   HB) (segid  A  and resid   63 and name  HB1)
    or (segid  A  and resid   61 and name   HB) (segid  A  and resid   63 and name  HB3)
assign (segid  A  and resid   63 and name  HB2) (segid  A  and resid   63 and name   HA) 1.874 0.439 0.439 weight 1.000 ! spec=sumo...oesy, no=1807, id=2270, vol=2.690073e+01
    or (segid  A  and resid   63 and name  HB1) (segid  A  and resid   63 and name   HA)
    or (segid  A  and resid   63 and name  HB3) (segid  A  and resid   63 and name   HA)
assign (segid  A  and resid   63 and name  HB2) (segid  A  and resid   25 and name   HA) 3.100 1.202 1.202 weight 1.000 ! spec=sumo...oesy, no=1808, id=2271, vol=1.313090e+00
    or (segid  A  and resid   63 and name  HB1) (segid  A  and resid   25 and name   HA)
    or (segid  A  and resid   63 and name  HB3) (segid  A  and resid   25 and name   HA)
assign (segid  A  and resid   63 and name  HB2) (segid  A  and resid   64 and name  HB1) 3.149 1.240 1.240 weight 1.000 ! spec=sumo...oesy, no=1811, id=2274, vol=1.196040e+00
    or (segid  A  and resid   63 and name  HB1) (segid  A  and resid   64 and name  HB1)
    or (segid  A  and resid   63 and name  HB3) (segid  A  and resid   64 and name  HB1)
assign (segid  A  and resid   63 and name  HB2) (segid  A  and resid   62 and name  HB2) 3.371 1.420 1.420 weight 1.000 ! spec=sumo...oesy, no=1813, id=2276, vol=7.952600e-01
    or (segid  A  and resid   63 and name  HB1) (segid  A  and resid   62 and name  HB2)
    or (segid  A  and resid   63 and name  HB3) (segid  A  and resid   62 and name  HB2)
assign (segid  A  and resid   63 and name  HB2) (segid  A  and resid   25 and name  HB2) 2.330 0.679 0.679 weight 1.000 ! spec=sumo...oesy, no=1814, id=2277, vol=7.285140e+00
    or (segid  A  and resid   63 and name  HB1) (segid  A  and resid   25 and name  HB2)
    or (segid  A  and resid   63 and name  HB3) (segid  A  and resid   25 and name  HB2)
assign (segid  A  and resid   49 and name  HD1) (segid  A  and resid   73 and name HG22) 2.096 0.549 0.549 weight 1.000 ! spec=sumo...oesy, no=1818, id=2279, vol=1.375854e+01
    or (segid  A  and resid   49 and name  HD1) (segid  A  and resid   73 and name HG21)
    or (segid  A  and resid   49 and name  HD1) (segid  A  and resid   73 and name HG23)
    or (segid  A  and resid   49 and name  HD2) (segid  A  and resid   73 and name HG22)
    or (segid  A  and resid   49 and name  HD2) (segid  A  and resid   73 and name HG21)
    or (segid  A  and resid   49 and name  HD2) (segid  A  and resid   73 and name HG23)
assign (segid  A  and resid   49 and name  HE1) (segid  A  and resid   73 and name HG22) 2.682 0.899 0.899 weight 1.000 ! spec=sumo...oesy, no=1819, id=2280, vol=3.132020e+00
    or (segid  A  and resid   49 and name  HE1) (segid  A  and resid   73 and name HG21)
    or (segid  A  and resid   49 and name  HE1) (segid  A  and resid   73 and name HG23)
    or (segid  A  and resid   49 and name  HE2) (segid  A  and resid   73 and name HG22)
    or (segid  A  and resid   49 and name  HE2) (segid  A  and resid   73 and name HG21)
    or (segid  A  and resid   49 and name  HE2) (segid  A  and resid   73 and name HG23)
assign (segid  A  and resid   11 and name   HA) (segid  A  and resid   73 and name HG22) 2.666 0.888 0.888 weight 1.000 ! spec=sumo...oesy, no=1821, id=2282, vol=3.249690e+00
    or (segid  A  and resid   11 and name   HA) (segid  A  and resid   73 and name HG21)
    or (segid  A  and resid   11 and name   HA) (segid  A  and resid   73 and name HG23)
assign (segid  A  and resid   73 and name HG22) (segid  A  and resid   75 and name   HA) 3.032 1.149 1.149 weight 1.000 ! spec=sumo...oesy, no=1822, id=2283, vol=1.501310e+00
    or (segid  A  and resid   73 and name HG21) (segid  A  and resid   75 and name   HA)
    or (segid  A  and resid   73 and name HG23) (segid  A  and resid   75 and name   HA)
assign (segid  A  and resid   73 and name HG22) (segid  A  and resid   49 and name  HB1) 2.458 0.755 0.755 weight 1.000 ! spec=sumo...oesy, no=1824, id=2285, vol=5.293570e+00
    or (segid  A  and resid   73 and name HG21) (segid  A  and resid   49 and name  HB1)
    or (segid  A  and resid   73 and name HG23) (segid  A  and resid   49 and name  HB1)
assign (segid  A  and resid   49 and name  HB2) (segid  A  and resid   73 and name HG22) 2.405 0.723 0.723 weight 1.000 ! spec=sumo...oesy, no=1825, id=2286, vol=6.026290e+00
    or (segid  A  and resid   49 and name  HB2) (segid  A  and resid   73 and name HG21)
    or (segid  A  and resid   49 and name  HB2) (segid  A  and resid   73 and name HG23)
assign (segid  A  and resid   73 and name HG22) (segid  A  and resid   73 and name   HB) 2.052 0.526 0.526 weight 1.000 ! spec=sumo...oesy, no=1826, id=2287, vol=1.563050e+01
    or (segid  A  and resid   73 and name HG21) (segid  A  and resid   73 and name   HB)
    or (segid  A  and resid   73 and name HG23) (segid  A  and resid   73 and name   HB)
assign (segid  A  and resid   73 and name HG22) (segid  A  and resid   73 and name HG11) 2.381 0.708 0.708 weight 1.000 ! spec=sumo...oesy, no=1827, id=2288, vol=6.408010e+00
    or (segid  A  and resid   73 and name HG21) (segid  A  and resid   73 and name HG11)
    or (segid  A  and resid   73 and name HG23) (segid  A  and resid   73 and name HG11)
assign (segid  A  and resid   11 and name HG22) (segid  A  and resid   73 and name HG22) 2.405 0.723 0.723 weight 1.000 ! spec=sumo...oesy, no=1831, id=2292, vol=6.031950e+00
    or (segid  A  and resid   11 and name HG22) (segid  A  and resid   73 and name HG21)
    or (segid  A  and resid   11 and name HG22) (segid  A  and resid   73 and name HG23)
    or (segid  A  and resid   11 and name HG21) (segid  A  and resid   73 and name HG22)
    or (segid  A  and resid   11 and name HG21) (segid  A  and resid   73 and name HG21)
    or (segid  A  and resid   11 and name HG21) (segid  A  and resid   73 and name HG23)
    or (segid  A  and resid   11 and name HG23) (segid  A  and resid   73 and name HG22)
    or (segid  A  and resid   11 and name HG23) (segid  A  and resid   73 and name HG21)
    or (segid  A  and resid   11 and name HG23) (segid  A  and resid   73 and name HG23)
assign (segid  A  and resid   33 and name  HE2) (segid  A  and resid   32 and name HD22) 3.141 1.233 1.233 weight 1.000 ! spec=sumo...oesy, no=1833, id=2293, vol=1.214770e+00
    or (segid  A  and resid   33 and name  HE2) (segid  A  and resid   32 and name HD21)
    or (segid  A  and resid   33 and name  HE2) (segid  A  and resid   32 and name HD23)
    or (segid  A  and resid   33 and name  HE1) (segid  A  and resid   32 and name HD22)
    or (segid  A  and resid   33 and name  HE1) (segid  A  and resid   32 and name HD21)
    or (segid  A  and resid   33 and name  HE1) (segid  A  and resid   32 and name HD23)
    or (segid  A  and resid   33 and name  HE3) (segid  A  and resid   32 and name HD22)
    or (segid  A  and resid   33 and name  HE3) (segid  A  and resid   32 and name HD21)
    or (segid  A  and resid   33 and name  HE3) (segid  A  and resid   32 and name HD23)
assign (segid  A  and resid   63 and name  HB2) (segid  A  and resid   66 and name   HA) 3.225 1.300 1.300 weight 1.000 ! spec=sumo...oesy, no=1835, id=2294, vol=1.036510e+00
    or (segid  A  and resid   63 and name  HB1) (segid  A  and resid   66 and name   HA)
    or (segid  A  and resid   63 and name  HB3) (segid  A  and resid   66 and name   HA)
assign (segid  A  and resid   49 and name  HD1) (segid  A  and resid   33 and name  HE2) 2.394 0.716 0.716 weight 1.000 ! spec=sumo...oesy, no=1838, id=2296, vol=6.192590e+00
    or (segid  A  and resid   49 and name  HD1) (segid  A  and resid   33 and name  HE1)
    or (segid  A  and resid   49 and name  HD1) (segid  A  and resid   33 and name  HE3)
    or (segid  A  and resid   49 and name  HD2) (segid  A  and resid   33 and name  HE2)
    or (segid  A  and resid   49 and name  HD2) (segid  A  and resid   33 and name  HE1)
    or (segid  A  and resid   49 and name  HD2) (segid  A  and resid   33 and name  HE3)
assign (segid  A  and resid   49 and name  HE1) (segid  A  and resid   33 and name  HE2) 2.818 0.992 0.992 weight 1.000 ! spec=sumo...oesy, no=1839, id=2297, vol=2.330180e+00
    or (segid  A  and resid   49 and name  HE1) (segid  A  and resid   33 and name  HE1)
    or (segid  A  and resid   49 and name  HE1) (segid  A  and resid   33 and name  HE3)
    or (segid  A  and resid   49 and name  HE2) (segid  A  and resid   33 and name  HE2)
    or (segid  A  and resid   49 and name  HE2) (segid  A  and resid   33 and name  HE1)
    or (segid  A  and resid   49 and name  HE2) (segid  A  and resid   33 and name  HE3)
assign (segid  A  and resid   33 and name  HE2) (segid  A  and resid   49 and name   HA) 3.135 1.228 1.228 weight 1.000 ! spec=sumo...oesy, no=1840, id=2298, vol=1.229580e+00
    or (segid  A  and resid   33 and name  HE1) (segid  A  and resid   49 and name   HA)
    or (segid  A  and resid   33 and name  HE3) (segid  A  and resid   49 and name   HA)
assign (segid  A  and resid   33 and name  HE2) (segid  A  and resid   56 and name   HA) 3.319 1.377 1.377 weight 1.000 ! spec=sumo...oesy, no=1843, id=2301, vol=8.717700e-01
    or (segid  A  and resid   33 and name  HE1) (segid  A  and resid   56 and name   HA)
    or (segid  A  and resid   33 and name  HE3) (segid  A  and resid   56 and name   HA)
assign (segid  A  and resid   33 and name  HE2) (segid  A  and resid   58 and name   HA) 2.238 0.626 0.626 weight 1.000 ! spec=sumo...oesy, no=1844, id=2302, vol=9.292360e+00
    or (segid  A  and resid   33 and name  HE1) (segid  A  and resid   58 and name   HA)
    or (segid  A  and resid   33 and name  HE3) (segid  A  and resid   58 and name   HA)
assign (segid  A  and resid   33 and name  HE2) (segid  A  and resid   49 and name  HB1) 2.444 0.747 0.747 weight 1.000 ! spec=sumo...oesy, no=1846, id=2304, vol=5.470580e+00
    or (segid  A  and resid   33 and name  HE1) (segid  A  and resid   49 and name  HB1)
    or (segid  A  and resid   33 and name  HE3) (segid  A  and resid   49 and name  HB1)
assign (segid  A  and resid   33 and name  HE2) (segid  A  and resid   49 and name  HB2) 2.632 0.866 0.866 weight 1.000 ! spec=sumo...oesy, no=1848, id=2306, vol=3.512010e+00
    or (segid  A  and resid   33 and name  HE1) (segid  A  and resid   49 and name  HB2)
    or (segid  A  and resid   33 and name  HE3) (segid  A  and resid   49 and name  HB2)
assign (segid  A  and resid   33 and name  HE2) (segid  A  and resid   58 and name  HG1) 2.617 0.856 0.856 weight 1.000 ! spec=sumo...oesy, no=1849, id=2307, vol=3.633720e+00
    or (segid  A  and resid   33 and name  HE1) (segid  A  and resid   58 and name  HG1)
    or (segid  A  and resid   33 and name  HE3) (segid  A  and resid   58 and name  HG1)
assign (segid  A  and resid   33 and name  HE2) (segid  A  and resid   44 and name  HE2) 2.522 0.795 0.795 weight 1.000 ! spec=sumo...oesy, no=1850, id=2308, vol=4.529330e+00
    or (segid  A  and resid   33 and name  HE2) (segid  A  and resid   44 and name  HE1)
    or (segid  A  and resid   33 and name  HE2) (segid  A  and resid   44 and name  HE3)
    or (segid  A  and resid   33 and name  HE1) (segid  A  and resid   44 and name  HE2)
    or (segid  A  and resid   33 and name  HE1) (segid  A  and resid   44 and name  HE1)
    or (segid  A  and resid   33 and name  HE1) (segid  A  and resid   44 and name  HE3)
    or (segid  A  and resid   33 and name  HE3) (segid  A  and resid   44 and name  HE2)
    or (segid  A  and resid   33 and name  HE3) (segid  A  and resid   44 and name  HE1)
    or (segid  A  and resid   33 and name  HE3) (segid  A  and resid   44 and name  HE3)
assign (segid  A  and resid   33 and name  HE2) (segid  A  and resid   33 and name  HG1) 2.540 0.806 0.806 weight 1.000 ! spec=sumo...oesy, no=1851, id=2309, vol=4.344960e+00
    or (segid  A  and resid   33 and name  HE1) (segid  A  and resid   33 and name  HG1)
    or (segid  A  and resid   33 and name  HE3) (segid  A  and resid   33 and name  HG1)
assign (segid  A  and resid   33 and name  HE2) (segid  A  and resid   29 and name  HB1) 2.656 0.882 0.882 weight 1.000 ! spec=sumo...oesy, no=1854, id=2311, vol=3.321240e+00
    or (segid  A  and resid   33 and name  HE1) (segid  A  and resid   29 and name  HB1)
    or (segid  A  and resid   33 and name  HE3) (segid  A  and resid   29 and name  HB1)
assign (segid  A  and resid   33 and name  HE2) (segid  A  and resid   56 and name HG22) 2.076 0.539 0.539 weight 1.000 ! spec=sumo...oesy, no=1855, id=2312, vol=1.456279e+01
    or (segid  A  and resid   33 and name  HE2) (segid  A  and resid   56 and name HG21)
    or (segid  A  and resid   33 and name  HE2) (segid  A  and resid   56 and name HG23)
    or (segid  A  and resid   33 and name  HE1) (segid  A  and resid   56 and name HG22)
    or (segid  A  and resid   33 and name  HE1) (segid  A  and resid   56 and name HG21)
    or (segid  A  and resid   33 and name  HE1) (segid  A  and resid   56 and name HG23)
    or (segid  A  and resid   33 and name  HE3) (segid  A  and resid   56 and name HG22)
    or (segid  A  and resid   33 and name  HE3) (segid  A  and resid   56 and name HG21)
    or (segid  A  and resid   33 and name  HE3) (segid  A  and resid   56 and name HG23)
assign (segid  A  and resid   33 and name  HG2) (segid  A  and resid   33 and name  HE2) 2.425 0.735 0.735 weight 1.000 ! spec=sumo...oesy, no=1857, id=2314, vol=5.735750e+00
    or (segid  A  and resid   33 and name  HG2) (segid  A  and resid   33 and name  HE1)
    or (segid  A  and resid   33 and name  HG2) (segid  A  and resid   33 and name  HE3)
assign (segid  A  and resid   23 and name HG22) (segid  A  and resid   22 and name   HA) 3.125 1.221 1.221 weight 1.000 ! spec=sumo...oesy, no=1865, id=2315, vol=1.251430e+00
    or (segid  A  and resid   23 and name HG21) (segid  A  and resid   22 and name   HA)
    or (segid  A  and resid   23 and name HG23) (segid  A  and resid   22 and name   HA)
assign (segid  A  and resid   21 and name  HB2) (segid  A  and resid   23 and name HG22) 2.811 0.988 0.988 weight 1.000 ! spec=sumo...oesy, no=1866, id=2316, vol=2.363960e+00
    or (segid  A  and resid   21 and name  HB2) (segid  A  and resid   23 and name HG21)
    or (segid  A  and resid   21 and name  HB2) (segid  A  and resid   23 and name HG23)
assign (segid  A  and resid   23 and name HG22) (segid  A  and resid   32 and name HD22) 3.056 1.167 1.167 weight 1.000 ! spec=sumo...oesy, no=1867, id=2317, vol=1.433070e+00
    or (segid  A  and resid   23 and name HG22) (segid  A  and resid   32 and name HD21)
    or (segid  A  and resid   23 and name HG22) (segid  A  and resid   32 and name HD23)
    or (segid  A  and resid   23 and name HG21) (segid  A  and resid   32 and name HD22)
    or (segid  A  and resid   23 and name HG21) (segid  A  and resid   32 and name HD21)
    or (segid  A  and resid   23 and name HG21) (segid  A  and resid   32 and name HD23)
    or (segid  A  and resid   23 and name HG23) (segid  A  and resid   32 and name HD22)
    or (segid  A  and resid   23 and name HG23) (segid  A  and resid   32 and name HD21)
    or (segid  A  and resid   23 and name HG23) (segid  A  and resid   32 and name HD23)
assign (segid  A  and resid   21 and name  HB1) (segid  A  and resid   23 and name HG22) 2.719 0.924 0.924 weight 1.000 ! spec=sumo...oesy, no=1872, id=2322, vol=2.887060e+00
    or (segid  A  and resid   21 and name  HB1) (segid  A  and resid   23 and name HG21)
    or (segid  A  and resid   21 and name  HB1) (segid  A  and resid   23 and name HG23)
assign (segid  A  and resid   23 and name HG22) (segid  A  and resid   23 and name   HB) 2.047 0.524 0.524 weight 1.000 ! spec=sumo...oesy, no=1874, id=2324, vol=1.586471e+01
    or (segid  A  and resid   23 and name HG21) (segid  A  and resid   23 and name   HB)
    or (segid  A  and resid   23 and name HG23) (segid  A  and resid   23 and name   HB)
assign (segid  A  and resid   23 and name HG22) (segid  A  and resid   29 and name   HA) 3.333 1.388 1.388 weight 1.000 ! spec=sumo...oesy, no=1877, id=2327, vol=8.513200e-01
    or (segid  A  and resid   23 and name HG21) (segid  A  and resid   29 and name   HA)
    or (segid  A  and resid   23 and name HG23) (segid  A  and resid   29 and name   HA)
assign (segid  A  and resid    7 and name HG22) (segid  A  and resid    7 and name   HA) 2.379 0.707 0.707 weight 1.000 ! spec=sumo...oesy, no=1878, id=2328, vol=6.437130e+00
    or (segid  A  and resid    7 and name HG21) (segid  A  and resid    7 and name   HA)
    or (segid  A  and resid    7 and name HG23) (segid  A  and resid    7 and name   HA)
assign (segid  A  and resid    7 and name HG22) (segid  A  and resid   25 and name   HA) 2.805 0.984 0.984 weight 1.000 ! spec=sumo...oesy, no=1879, id=2329, vol=2.393090e+00
    or (segid  A  and resid    7 and name HG21) (segid  A  and resid   25 and name   HA)
    or (segid  A  and resid    7 and name HG23) (segid  A  and resid   25 and name   HA)
assign (segid  A  and resid    7 and name HG22) (segid  A  and resid   69 and name  HB1) 2.496 0.779 0.779 weight 1.000 ! spec=sumo...oesy, no=1881, id=2331, vol=4.826550e+00
    or (segid  A  and resid    7 and name HG21) (segid  A  and resid   69 and name  HB1)
    or (segid  A  and resid    7 and name HG23) (segid  A  and resid   69 and name  HB1)
assign (segid  A  and resid    7 and name HG22) (segid  A  and resid    7 and name   HB) 2.096 0.549 0.549 weight 1.000 ! spec=sumo...oesy, no=1884, id=2334, vol=1.377213e+01
    or (segid  A  and resid    7 and name HG21) (segid  A  and resid    7 and name   HB)
    or (segid  A  and resid    7 and name HG23) (segid  A  and resid    7 and name   HB)
assign (segid  A  and resid   25 and name  HG2) (segid  A  and resid    7 and name HG22) 2.258 0.637 0.637 weight 1.000 ! spec=sumo...oesy, no=1885, id=2335, vol=8.796040e+00
    or (segid  A  and resid   25 and name  HG2) (segid  A  and resid    7 and name HG21)
    or (segid  A  and resid   25 and name  HG2) (segid  A  and resid    7 and name HG23)
assign (segid  A  and resid   25 and name  HG1) (segid  A  and resid    7 and name HG22) 2.343 0.686 0.686 weight 1.000 ! spec=sumo...oesy, no=1886, id=2336, vol=7.055700e+00
    or (segid  A  and resid   25 and name  HG1) (segid  A  and resid    7 and name HG21)
    or (segid  A  and resid   25 and name  HG1) (segid  A  and resid    7 and name HG23)
assign (segid  A  and resid   51 and name  HD1) (segid  A  and resid   56 and name HD12) 2.806 0.984 0.984 weight 1.000 ! spec=sumo...oesy, no=1898, id=2337, vol=2.389510e+00
    or (segid  A  and resid   51 and name  HD1) (segid  A  and resid   56 and name HD11)
    or (segid  A  and resid   51 and name  HD1) (segid  A  and resid   56 and name HD13)
    or (segid  A  and resid   51 and name  HD2) (segid  A  and resid   56 and name HD12)
    or (segid  A  and resid   51 and name  HD2) (segid  A  and resid   56 and name HD11)
    or (segid  A  and resid   51 and name  HD2) (segid  A  and resid   56 and name HD13)
assign (segid  A  and resid   56 and name HD12) (segid  A  and resid   49 and name  HD1) 2.688 0.903 0.903 weight 1.000 ! spec=sumo...oesy, no=1899, id=2338, vol=3.089410e+00
    or (segid  A  and resid   56 and name HD12) (segid  A  and resid   49 and name  HD2)
    or (segid  A  and resid   56 and name HD11) (segid  A  and resid   49 and name  HD1)
    or (segid  A  and resid   56 and name HD11) (segid  A  and resid   49 and name  HD2)
    or (segid  A  and resid   56 and name HD13) (segid  A  and resid   49 and name  HD1)
    or (segid  A  and resid   56 and name HD13) (segid  A  and resid   49 and name  HD2)
assign (segid  A  and resid   51 and name   HA) (segid  A  and resid   56 and name HD12) 2.638 0.870 0.870 weight 1.000 ! spec=sumo...oesy, no=1900, id=2339, vol=3.456850e+00
    or (segid  A  and resid   51 and name   HA) (segid  A  and resid   56 and name HD11)
    or (segid  A  and resid   51 and name   HA) (segid  A  and resid   56 and name HD13)
assign (segid  A  and resid   49 and name  HB1) (segid  A  and resid   56 and name HD12) 2.331 0.679 0.679 weight 1.000 ! spec=sumo...oesy, no=1902, id=2341, vol=7.273060e+00
    or (segid  A  and resid   49 and name  HB1) (segid  A  and resid   56 and name HD11)
    or (segid  A  and resid   49 and name  HB1) (segid  A  and resid   56 and name HD13)
assign (segid  A  and resid   49 and name  HB2) (segid  A  and resid   56 and name HD12) 2.443 0.746 0.746 weight 1.000 ! spec=sumo...oesy, no=1904, id=2343, vol=5.492290e+00
    or (segid  A  and resid   49 and name  HB2) (segid  A  and resid   56 and name HD11)
    or (segid  A  and resid   49 and name  HB2) (segid  A  and resid   56 and name HD13)
assign (segid  A  and resid   56 and name HD12) (segid  A  and resid   56 and name   HB) 2.134 0.569 0.569 weight 1.000 ! spec=sumo...oesy, no=1905, id=2344, vol=1.233349e+01
    or (segid  A  and resid   56 and name HD11) (segid  A  and resid   56 and name   HB)
    or (segid  A  and resid   56 and name HD13) (segid  A  and resid   56 and name   HB)
assign (segid  A  and resid   47 and name HD12) (segid  A  and resid   49 and name   HZ) 2.414 0.729 0.729 weight 1.000 ! spec=sumo...oesy, no=1909, id=2346, vol=5.891410e+00
    or (segid  A  and resid   47 and name HD11) (segid  A  and resid   49 and name   HZ)
    or (segid  A  and resid   47 and name HD13) (segid  A  and resid   49 and name   HZ)
assign (segid  A  and resid   36 and name  HD1) (segid  A  and resid   47 and name HD12) 2.339 0.684 0.684 weight 1.000 ! spec=sumo...oesy, no=1910, id=2347, vol=7.119700e+00
    or (segid  A  and resid   36 and name  HD1) (segid  A  and resid   47 and name HD11)
    or (segid  A  and resid   36 and name  HD1) (segid  A  and resid   47 and name HD13)
    or (segid  A  and resid   36 and name  HD2) (segid  A  and resid   47 and name HD12)
    or (segid  A  and resid   36 and name  HD2) (segid  A  and resid   47 and name HD11)
    or (segid  A  and resid   36 and name  HD2) (segid  A  and resid   47 and name HD13)
assign (segid  A  and resid   49 and name  HE1) (segid  A  and resid   47 and name HD12) 2.550 0.813 0.813 weight 1.000 ! spec=sumo...oesy, no=1911, id=2348, vol=4.240590e+00
    or (segid  A  and resid   49 and name  HE1) (segid  A  and resid   47 and name HD11)
    or (segid  A  and resid   49 and name  HE1) (segid  A  and resid   47 and name HD13)
    or (segid  A  and resid   49 and name  HE2) (segid  A  and resid   47 and name HD12)
    or (segid  A  and resid   49 and name  HE2) (segid  A  and resid   47 and name HD11)
    or (segid  A  and resid   49 and name  HE2) (segid  A  and resid   47 and name HD13)
assign (segid  A  and resid   23 and name HD12) (segid  A  and resid   29 and name   HA) 2.381 0.709 0.709 weight 1.000 ! spec=sumo...oesy, no=1920, id=2355, vol=6.397180e+00
    or (segid  A  and resid   23 and name HD11) (segid  A  and resid   29 and name   HA)
    or (segid  A  and resid   23 and name HD13) (segid  A  and resid   29 and name   HA)
assign (segid  A  and resid   23 and name HD12) (segid  A  and resid   32 and name   HA) 2.930 1.073 1.073 weight 1.000 ! spec=sumo...oesy, no=1925, id=2359, vol=1.842630e+00
    or (segid  A  and resid   23 and name HD11) (segid  A  and resid   32 and name   HA)
    or (segid  A  and resid   23 and name HD13) (segid  A  and resid   32 and name   HA)
assign (segid  A  and resid   51 and name  HD1) (segid  A  and resid   73 and name HD12) 3.077 1.184 1.184 weight 1.000 ! spec=sumo...oesy, no=1931, id=2361, vol=1.373340e+00
    or (segid  A  and resid   51 and name  HD1) (segid  A  and resid   73 and name HD11)
    or (segid  A  and resid   51 and name  HD1) (segid  A  and resid   73 and name HD13)
    or (segid  A  and resid   51 and name  HD2) (segid  A  and resid   73 and name HD12)
    or (segid  A  and resid   51 and name  HD2) (segid  A  and resid   73 and name HD11)
    or (segid  A  and resid   51 and name  HD2) (segid  A  and resid   73 and name HD13)
assign (segid  A  and resid   73 and name HD12) (segid  A  and resid   49 and name  HD1) 2.784 0.969 0.969 weight 1.000 ! spec=sumo...oesy, no=1932, id=2362, vol=2.506590e+00
    or (segid  A  and resid   73 and name HD12) (segid  A  and resid   49 and name  HD2)
    or (segid  A  and resid   73 and name HD11) (segid  A  and resid   49 and name  HD1)
    or (segid  A  and resid   73 and name HD11) (segid  A  and resid   49 and name  HD2)
    or (segid  A  and resid   73 and name HD13) (segid  A  and resid   49 and name  HD1)
    or (segid  A  and resid   73 and name HD13) (segid  A  and resid   49 and name  HD2)
assign (segid  A  and resid   73 and name HD12) (segid  A  and resid   73 and name   HA) 2.842 1.010 1.010 weight 1.000 ! spec=sumo...oesy, no=1933, id=2363, vol=2.211320e+00
    or (segid  A  and resid   73 and name HD11) (segid  A  and resid   73 and name   HA)
    or (segid  A  and resid   73 and name HD13) (segid  A  and resid   73 and name   HA)
assign (segid  A  and resid   73 and name HD12) (segid  A  and resid   49 and name  HB2) 3.134 1.228 1.228 weight 1.000 ! spec=sumo...oesy, no=1934, id=2364, vol=1.229660e+00
    or (segid  A  and resid   73 and name HD11) (segid  A  and resid   49 and name  HB2)
    or (segid  A  and resid   73 and name HD13) (segid  A  and resid   49 and name  HB2)
assign (segid  A  and resid   73 and name HD12) (segid  A  and resid    9 and name   HG) 2.506 0.785 0.785 weight 1.000 ! spec=sumo...oesy, no=1937, id=2365, vol=4.709600e+00
    or (segid  A  and resid   73 and name HD11) (segid  A  and resid    9 and name   HG)
    or (segid  A  and resid   73 and name HD13) (segid  A  and resid    9 and name   HG)
assign (segid  A  and resid    7 and name HD12) (segid  A  and resid   25 and name   HA) 2.865 1.026 1.026 weight 1.000 ! spec=sumo...oesy, no=1947, id=2369, vol=2.109750e+00
    or (segid  A  and resid    7 and name HD11) (segid  A  and resid   25 and name   HA)
    or (segid  A  and resid    7 and name HD13) (segid  A  and resid   25 and name   HA)
assign (segid  A  and resid    7 and name HD12) (segid  A  and resid   62 and name  HB1) 2.373 0.704 0.704 weight 1.000 ! spec=sumo...oesy, no=1950, id=2372, vol=6.538030e+00
    or (segid  A  and resid    7 and name HD11) (segid  A  and resid   62 and name  HB1)
    or (segid  A  and resid    7 and name HD13) (segid  A  and resid   62 and name  HB1)
assign (segid  A  and resid    7 and name HD12) (segid  A  and resid    7 and name   HB) 2.197 0.603 0.603 weight 1.000 ! spec=sumo...oesy, no=1952, id=2374, vol=1.037140e+01
    or (segid  A  and resid    7 and name HD11) (segid  A  and resid    7 and name   HB)
    or (segid  A  and resid    7 and name HD13) (segid  A  and resid    7 and name   HB)
assign (segid  A  and resid    7 and name HG11) (segid  A  and resid    7 and name HD12) 2.065 0.533 0.533 weight 1.000 ! spec=sumo...oesy, no=1953, id=2375, vol=1.502127e+01
    or (segid  A  and resid    7 and name HG11) (segid  A  and resid    7 and name HD11)
    or (segid  A  and resid    7 and name HG11) (segid  A  and resid    7 and name HD13)
assign (segid  A  and resid    7 and name HD12) (segid  A  and resid   71 and name  HB1) 3.166 1.253 1.253 weight 1.000 ! spec=sumo...oesy, no=1955, id=2376, vol=1.158700e+00
    or (segid  A  and resid    7 and name HD11) (segid  A  and resid   71 and name  HB1)
    or (segid  A  and resid    7 and name HD13) (segid  A  and resid   71 and name  HB1)
assign (segid  A  and resid    9 and name   HA) (segid  A  and resid    9 and name  HB1) 2.623 0.860 0.860 weight 1.000 ! spec=sumo...oesy, no=1964, id=2377, vol=3.582430e+00
assign (segid  A  and resid    9 and name HD22) (segid  A  and resid    9 and name  HB1) 2.384 0.710 0.710 weight 1.000 ! spec=sumo...oesy, no=1966, id=2379, vol=6.351170e+00
    or (segid  A  and resid    9 and name HD21) (segid  A  and resid    9 and name  HB1)
    or (segid  A  and resid    9 and name HD23) (segid  A  and resid    9 and name  HB1)
assign (segid  A  and resid    9 and name  HB1) (segid  A  and resid   32 and name   HG) 2.903 1.053 1.053 weight 1.000 ! spec=sumo...oesy, no=1967, id=2380, vol=1.948850e+00
assign (segid  A  and resid    9 and name  HB1) (segid  A  and resid    9 and name  HB2) 2.088 0.545 0.545 weight 1.000 ! spec=sumo...oesy, no=1968, id=2381, vol=1.406932e+01
assign (segid  A  and resid    9 and name  HB2) (segid  A  and resid   32 and name   HG) 3.077 1.184 1.184 weight 1.000 ! spec=sumo...oesy, no=1973, id=2385, vol=1.373640e+00
assign (segid  A  and resid   42 and name  HB1) (segid  A  and resid   42 and name   HA) 2.660 0.884 0.884 weight 1.000 ! spec=sumo...oesy, no=1979, id=2388, vol=3.294600e+00
assign (segid  A  and resid   42 and name  HB1) (segid  A  and resid   42 and name  HB2) 2.171 0.589 0.589 weight 1.000 ! spec=sumo...oesy, no=1982, id=2390, vol=1.113105e+01
assign (segid  A  and resid   42 and name  HB1) (segid  A  and resid   47 and name HD12) 3.131 1.225 1.225 weight 1.000 ! spec=sumo...oesy, no=1984, id=2392, vol=1.238780e+00
    or (segid  A  and resid   42 and name  HB1) (segid  A  and resid   47 and name HD11)
    or (segid  A  and resid   42 and name  HB1) (segid  A  and resid   47 and name HD13)
assign (segid  A  and resid   42 and name  HB2) (segid  A  and resid   42 and name   HA) 2.786 0.970 0.970 weight 1.000 ! spec=sumo...oesy, no=1985, id=2393, vol=2.493110e+00
assign (segid  A  and resid   23 and name   HB) (segid  A  and resid   23 and name HD12) 2.289 0.655 0.655 weight 1.000 ! spec=sumo...oesy, no=2016, id=2399, vol=8.113070e+00
    or (segid  A  and resid   23 and name   HB) (segid  A  and resid   23 and name HD11)
    or (segid  A  and resid   23 and name   HB) (segid  A  and resid   23 and name HD13)
assign (segid  A  and resid   51 and name  HD1) (segid  A  and resid   65 and name  HB1) 2.958 1.094 1.094 weight 1.000 ! spec=sumo...oesy, no=2022, id=2403, vol=1.741620e+00
    or (segid  A  and resid   51 and name  HD2) (segid  A  and resid   65 and name  HB1)
assign (segid  A  and resid   65 and name   HA) (segid  A  and resid   65 and name  HB1) 2.535 0.803 0.803 weight 1.000 ! spec=sumo...oesy, no=2023, id=2404, vol=4.396990e+00
assign (segid  A  and resid   65 and name  HB1) (segid  A  and resid   67 and name  HG1) 2.900 1.052 1.052 weight 1.000 ! spec=sumo...oesy, no=2025, id=2406, vol=1.958740e+00
assign (segid  A  and resid   69 and name  HB1) (segid  A  and resid    7 and name   HB) 2.805 0.984 0.984 weight 1.000 ! spec=sumo...oesy, no=2028, id=2408, vol=2.393220e+00
assign (segid  A  and resid   65 and name  HB2) (segid  A  and resid   51 and name  HD1) 3.324 1.381 1.381 weight 1.000 ! spec=sumo...oesy, no=2030, id=2409, vol=8.640900e-01
    or (segid  A  and resid   65 and name  HB2) (segid  A  and resid   51 and name  HD2)
assign (segid  A  and resid   65 and name  HB2) (segid  A  and resid   67 and name  HG1) 2.844 1.011 1.011 weight 1.000 ! spec=sumo...oesy, no=2033, id=2410, vol=2.205840e+00
assign (segid  A  and resid   32 and name  HB1) (segid  A  and resid   32 and name   HA) 2.604 0.848 0.848 weight 1.000 ! spec=sumo...oesy, no=2035, id=2411, vol=3.739590e+00
assign (segid  A  and resid   32 and name  HB1) (segid  A  and resid   32 and name   HG) 2.627 0.862 0.862 weight 1.000 ! spec=sumo...oesy, no=2038, id=2412, vol=3.550500e+00
assign (segid  A  and resid   32 and name  HB1) (segid  A  and resid   32 and name HD22) 2.621 0.859 0.859 weight 1.000 ! spec=sumo...oesy, no=2039, id=2413, vol=3.594690e+00
    or (segid  A  and resid   32 and name  HB1) (segid  A  and resid   32 and name HD21)
    or (segid  A  and resid   32 and name  HB1) (segid  A  and resid   32 and name HD23)
assign (segid  A  and resid   32 and name  HB2) (segid  A  and resid   32 and name   HA) 2.450 0.751 0.751 weight 1.000 ! spec=sumo...oesy, no=2040, id=2414, vol=5.387890e+00
assign (segid  A  and resid   32 and name  HB2) (segid  A  and resid   32 and name   HG) 2.489 0.774 0.774 weight 1.000 ! spec=sumo...oesy, no=2043, id=2415, vol=4.907110e+00
assign (segid  A  and resid   32 and name  HB2) (segid  A  and resid   32 and name HD22) 2.692 0.906 0.906 weight 1.000 ! spec=sumo...oesy, no=2044, id=2416, vol=3.062730e+00
    or (segid  A  and resid   32 and name  HB2) (segid  A  and resid   32 and name HD21)
    or (segid  A  and resid   32 and name  HB2) (segid  A  and resid   32 and name HD23)
assign (segid  A  and resid   29 and name  HB2) (segid  A  and resid   29 and name   HA) 2.650 0.878 0.878 weight 1.000 ! spec=sumo...oesy, no=2058, id=2417, vol=3.367520e+00
assign (segid  A  and resid   47 and name   HB) (segid  A  and resid   77 and name   HA) 2.860 1.023 1.023 weight 1.000 ! spec=sumo...oesy, no=2060, id=2419, vol=2.129810e+00
assign (segid  A  and resid   47 and name   HB) (segid  A  and resid   77 and name  HG1) 3.096 1.198 1.198 weight 1.000 ! spec=sumo...oesy, no=2061, id=2420, vol=1.323650e+00
assign (segid  A  and resid   29 and name  HB1) (segid  A  and resid   29 and name   HA) 2.584 0.835 0.835 weight 1.000 ! spec=sumo...oesy, no=2065, id=2422, vol=3.917980e+00
assign (segid  A  and resid   29 and name  HB2) (segid  A  and resid   29 and name  HB1) 2.284 0.652 0.652 weight 1.000 ! spec=sumo...oesy, no=2066, id=2423, vol=8.206710e+00
assign (segid  A  and resid   29 and name  HB1) (segid  A  and resid   56 and name HG22) 2.968 1.101 1.101 weight 1.000 ! spec=sumo...oesy, no=2068, id=2424, vol=1.706040e+00
    or (segid  A  and resid   29 and name  HB1) (segid  A  and resid   56 and name HG21)
    or (segid  A  and resid   29 and name  HB1) (segid  A  and resid   56 and name HG23)
assign (segid  A  and resid   73 and name HG11) (segid  A  and resid   73 and name   HB) 2.545 0.810 0.810 weight 1.000 ! spec=sumo...oesy, no=2085, id=2428, vol=4.287200e+00
assign (segid  A  and resid   73 and name   HB) (segid  A  and resid   73 and name HD12) 2.287 0.654 0.654 weight 1.000 ! spec=sumo...oesy, no=2086, id=2429, vol=8.151830e+00
    or (segid  A  and resid   73 and name   HB) (segid  A  and resid   73 and name HD11)
    or (segid  A  and resid   73 and name   HB) (segid  A  and resid   73 and name HD13)
assign (segid  A  and resid   47 and name HG22) (segid  A  and resid   47 and name   HB) 2.179 0.593 0.593 weight 1.000 ! spec=sumo...oesy, no=2089, id=2432, vol=1.090872e+01
    or (segid  A  and resid   47 and name HG21) (segid  A  and resid   47 and name   HB)
    or (segid  A  and resid   47 and name HG23) (segid  A  and resid   47 and name   HB)
assign (segid  A  and resid   73 and name   HB) (segid  A  and resid    9 and name  HB2) 2.865 1.026 1.026 weight 1.000 ! spec=sumo...oesy, no=2094, id=2435, vol=2.109220e+00
assign (segid  A  and resid   56 and name   HB) (segid  A  and resid   49 and name  HB1) 2.704 0.914 0.914 weight 1.000 ! spec=sumo...oesy, no=2096, id=2437, vol=2.984170e+00
assign (segid  A  and resid   56 and name   HB) (segid  A  and resid   49 and name  HB2) 2.886 1.041 1.041 weight 1.000 ! spec=sumo...oesy, no=2097, id=2438, vol=2.019020e+00
assign (segid  A  and resid   56 and name HG11) (segid  A  and resid   56 and name   HB) 2.619 0.857 0.857 weight 1.000 ! spec=sumo...oesy, no=2098, id=2439, vol=3.617830e+00
assign (segid  A  and resid   39 and name  HG1) (segid  A  and resid   36 and name  HD1) 2.959 1.094 1.094 weight 1.000 ! spec=sumo...oesy, no=2127, id=2442, vol=1.738900e+00
    or (segid  A  and resid   39 and name  HG1) (segid  A  and resid   36 and name  HD2)
assign (segid  A  and resid    9 and name  HB2) (segid  A  and resid   73 and name HG12) 2.669 0.890 0.890 weight 1.000 ! spec=sumo...oesy, no=2128, id=2443, vol=3.228040e+00
assign (segid  A  and resid   34 and name  HG1) (segid  A  and resid   44 and name  HE2) 2.905 1.055 1.055 weight 1.000 ! spec=sumo...oesy, no=2129, id=2444, vol=1.941780e+00
    or (segid  A  and resid   34 and name  HG1) (segid  A  and resid   44 and name  HE1)
    or (segid  A  and resid   34 and name  HG1) (segid  A  and resid   44 and name  HE3)
assign (segid  A  and resid   32 and name HD22) (segid  A  and resid   29 and name HD22) 2.316 0.671 0.671 weight 1.000 ! spec=sumo...oesy, no=2130, id=2445, vol=7.550940e+00
    or (segid  A  and resid   32 and name HD22) (segid  A  and resid   29 and name HD21)
    or (segid  A  and resid   32 and name HD22) (segid  A  and resid   29 and name HD23)
    or (segid  A  and resid   32 and name HD21) (segid  A  and resid   29 and name HD22)
    or (segid  A  and resid   32 and name HD21) (segid  A  and resid   29 and name HD21)
    or (segid  A  and resid   32 and name HD21) (segid  A  and resid   29 and name HD23)
    or (segid  A  and resid   32 and name HD23) (segid  A  and resid   29 and name HD22)
    or (segid  A  and resid   32 and name HD23) (segid  A  and resid   29 and name HD21)
    or (segid  A  and resid   32 and name HD23) (segid  A  and resid   29 and name HD23)
assign (segid  A  and resid   61 and name HG21) (segid  A  and resid   27 and name   HA) 2.931 1.074 1.074 weight 1.000 ! spec=sumo...oesy, no=2135, id=2450, vol=1.839740e+00
    or (segid  A  and resid   61 and name HG22) (segid  A  and resid   27 and name   HA)
    or (segid  A  and resid   61 and name HG23) (segid  A  and resid   27 and name   HA)
assign (segid  A  and resid   42 and name  HB2) (segid  A  and resid   37 and name   HA) 2.736 0.936 0.936 weight 1.000 ! spec=sumo...oesy, no=2138, id=2451, vol=2.777960e+00
assign (segid  A  and resid   32 and name  HB1) (segid  A  and resid   29 and name   HA) 3.139 1.232 1.232 weight 1.000 ! spec=sumo...oesy, no=2139, id=2452, vol=1.219560e+00
assign (segid  A  and resid   58 and name  HG1) (segid  A  and resid   58 and name   HA) 2.494 0.777 0.777 weight 1.000 ! spec=sumo...oesy, no=2144, id=2453, vol=4.851540e+00
assign (segid  A  and resid   58 and name  HG2) (segid  A  and resid   58 and name   HA) 2.465 0.759 0.759 weight 1.000 ! spec=sumo...oesy, no=2149, id=2457, vol=5.199240e+00
assign (segid  A  and resid   58 and name  HG2) (segid  A  and resid   33 and name  HE2) 2.931 1.074 1.074 weight 1.000 ! spec=sumo...oesy, no=2151, id=2459, vol=1.839590e+00
    or (segid  A  and resid   58 and name  HG2) (segid  A  and resid   33 and name  HE1)
    or (segid  A  and resid   58 and name  HG2) (segid  A  and resid   33 and name  HE3)
assign (segid  A  and resid   70 and name  HG1) (segid  A  and resid   70 and name   HA) 2.442 0.746 0.746 weight 1.000 ! spec=sumo...oesy, no=2153, id=2461, vol=5.492540e+00
assign (segid  A  and resid    3 and name   HA) (segid  A  and resid    3 and name  HG2) 2.625 0.862 0.862 weight 1.000 ! spec=sumo...oesy, no=2156, id=2462, vol=3.561840e+00
assign (segid  A  and resid    3 and name  HG2) (segid  A  and resid    3 and name  HB2) 2.501 0.782 0.782 weight 1.000 ! spec=sumo...oesy, no=2157, id=2463, vol=4.764100e+00
assign (segid  A  and resid   20 and name  HG2) (segid  A  and resid   10 and name   HA) 2.918 1.064 1.064 weight 1.000 ! spec=sumo...oesy, no=2163, id=2468, vol=1.890930e+00
assign (segid  A  and resid   18 and name HG22) (segid  A  and resid   20 and name  HG2) 2.641 0.872 0.872 weight 1.000 ! spec=sumo...oesy, no=2164, id=2469, vol=3.439750e+00
    or (segid  A  and resid   18 and name HG21) (segid  A  and resid   20 and name  HG2)
    or (segid  A  and resid   18 and name HG23) (segid  A  and resid   20 and name  HG2)
assign (segid  A  and resid   20 and name  HG2) (segid  A  and resid   20 and name   HA) 2.494 0.778 0.778 weight 1.000 ! spec=sumo...oesy, no=2165, id=2470, vol=4.842590e+00
assign (segid  A  and resid   67 and name  HG1) (segid  A  and resid   51 and name  HD1) 2.933 1.075 1.075 weight 1.000 ! spec=sumo...oesy, no=2167, id=2472, vol=1.833590e+00
    or (segid  A  and resid   67 and name  HG1) (segid  A  and resid   51 and name  HD2)
assign (segid  A  and resid   67 and name  HG2) (segid  A  and resid   67 and name  HG1) 2.256 0.636 0.636 weight 1.000 ! spec=sumo...oesy, no=2169, id=2474, vol=8.854160e+00
assign (segid  A  and resid   55 and name   HA) (segid  A  and resid   55 and name  HB1) 2.292 0.657 0.657 weight 1.000 ! spec=sumo...oesy, no=2171, id=2476, vol=8.042060e+00
assign (segid  A  and resid   61 and name HG21) (segid  A  and resid   28 and name  HB1) 2.679 0.897 0.897 weight 1.000 ! spec=sumo...oesy, no=2175, id=2477, vol=3.155480e+00
    or (segid  A  and resid   61 and name HG22) (segid  A  and resid   28 and name  HB1)
    or (segid  A  and resid   61 and name HG23) (segid  A  and resid   28 and name  HB1)
assign (segid  A  and resid   46 and name  HB1) (segid  A  and resid   46 and name   HA) 2.493 0.777 0.777 weight 1.000 ! spec=sumo...oesy, no=2177, id=2478, vol=4.853390e+00
assign (segid  A  and resid   46 and name  HB1) (segid  A  and resid   42 and name  HB1) 3.312 1.371 1.371 weight 1.000 ! spec=sumo...oesy, no=2179, id=2480, vol=8.841600e-01
assign (segid  A  and resid   46 and name  HB1) (segid  A  and resid   47 and name HG22) 3.270 1.336 1.336 weight 1.000 ! spec=sumo...oesy, no=2180, id=2481, vol=9.544200e-01
    or (segid  A  and resid   46 and name  HB1) (segid  A  and resid   47 and name HG21)
    or (segid  A  and resid   46 and name  HB1) (segid  A  and resid   47 and name HG23)
assign (segid  A  and resid   46 and name  HB1) (segid  A  and resid   43 and name  HB2) 2.557 0.817 0.817 weight 1.000 ! spec=sumo...oesy, no=2182, id=2483, vol=4.173690e+00
assign (segid  A  and resid   46 and name  HB1) (segid  A  and resid   46 and name  HB2) 1.810 0.410 0.410 weight 1.000 ! spec=sumo...oesy, no=2183, id=2484, vol=3.314099e+01
assign (segid  A  and resid   65 and name   HG) (segid  A  and resid   64 and name  HB2) 3.084 1.189 1.189 weight 1.000 ! spec=sumo...oesy, no=2192, id=2489, vol=1.356020e+00
assign (segid  A  and resid   55 and name  HG1) (segid  A  and resid   55 and name  HD1) 2.399 0.719 0.719 weight 1.000 ! spec=sumo...oesy, no=2196, id=2492, vol=6.122820e+00
assign (segid  A  and resid   55 and name  HG1) (segid  A  and resid   55 and name  HD2) 2.315 0.670 0.670 weight 1.000 ! spec=sumo...oesy, no=2199, id=2494, vol=7.576960e+00
assign (segid  A  and resid   66 and name  HB1) (segid  A  and resid   66 and name   HA) 2.533 0.802 0.802 weight 1.000 ! spec=sumo...oesy, no=2200, id=2495, vol=4.415850e+00
assign (segid  A  and resid   70 and name  HB2) (segid  A  and resid   70 and name   HA) 2.398 0.719 0.719 weight 1.000 ! spec=sumo...oesy, no=2201, id=2496, vol=6.126530e+00
# chain B
assign (segid  B  and resid   83 and name   HN) (segid  B  and resid   20 and name   HN) 3.219 1.295 1.295 weight 1.000 ! spec=sumo...oesy, no=1, id=0, vol=8.939800e-01
assign (segid  B  and resid   83 and name   HN) (segid  B  and resid   82 and name   HA) 2.301 0.662 0.662 weight 1.000 ! spec=sumo...oesy, no=2, id=1, vol=6.695580e+00
assign (segid  B  and resid   83 and name   HN) (segid  B  and resid   21 and name   HA) 2.818 0.993 0.993 weight 1.000 ! spec=sumo...oesy, no=3, id=2, vol=1.984020e+00
assign (segid  B  and resid   83 and name   HN) (segid  B  and resid   83 and name   HB) 2.606 0.849 0.849 weight 1.000 ! spec=sumo...oesy, no=4, id=3, vol=3.171870e+00
assign (segid  B  and resid   83 and name   HN) (segid  B  and resid   82 and name HG21) 2.610 0.852 0.852 weight 1.000 ! spec=sumo...oesy, no=6, id=5, vol=3.142320e+00
    or (segid  B  and resid   83 and name   HN) (segid  B  and resid   82 and name HG22)
    or (segid  B  and resid   83 and name   HN) (segid  B  and resid   82 and name HG23)
assign (segid  B  and resid   83 and name   HN) (segid  B  and resid   83 and name HG22) 3.175 1.260 1.260 weight 1.000 ! spec=sumo...oesy, no=7, id=6, vol=9.710100e-01
    or (segid  B  and resid   83 and name   HN) (segid  B  and resid   83 and name HG21)
    or (segid  B  and resid   83 and name   HN) (segid  B  and resid   83 and name HG23)
assign (segid  B  and resid   83 and name   HN) (segid  B  and resid   83 and name HD12) 3.124 1.220 1.220 weight 1.000 ! spec=sumo...oesy, no=9, id=8, vol=1.070350e+00
    or (segid  B  and resid   83 and name   HN) (segid  B  and resid   83 and name HD11)
    or (segid  B  and resid   83 and name   HN) (segid  B  and resid   83 and name HD13)
assign (segid  B  and resid   37 and name   HB) (segid  B  and resid   34 and name  HB1) 2.483 0.770 0.770 weight 1.000 ! spec=sumo...oesy, no=10, id=747, vol=2.698510e+00
assign (segid  B  and resid   37 and name   HB) (segid  B  and resid   33 and name HG12) 2.679 0.897 0.897 weight 1.000 ! spec=sumo...oesy, no=12, id=749, vol=1.709730e+00
assign (segid  B  and resid   37 and name   HB) (segid  B  and resid   33 and name HD12) 2.339 0.684 0.684 weight 1.000 ! spec=sumo...oesy, no=13, id=750, vol=3.861810e+00
    or (segid  B  and resid   37 and name   HB) (segid  B  and resid   33 and name HD11)
    or (segid  B  and resid   37 and name   HB) (segid  B  and resid   33 and name HD13)
assign (segid  B  and resid   90 and name   HB) (segid  B  and resid   90 and name HG21) 1.819 0.413 0.413 weight 1.000 ! spec=sumo...oesy, no=14, id=751, vol=1.746753e+01
    or (segid  B  and resid   90 and name   HB) (segid  B  and resid   90 and name HG22)
    or (segid  B  and resid   90 and name   HB) (segid  B  and resid   90 and name HG23)
assign (segid  B  and resid   29 and name   HN) (segid  B  and resid   28 and name   HA) 2.159 0.582 0.582 weight 1.000 ! spec=sumo...oesy, no=15, id=13, vol=9.826580e+00
assign (segid  B  and resid   29 and name   HN) (segid  B  and resid   22 and name  HB2) 3.344 1.398 1.398 weight 1.000 ! spec=sumo...oesy, no=17, id=15, vol=7.105200e-01
    or (segid  B  and resid   29 and name   HN) (segid  B  and resid   22 and name  HB1)
    or (segid  B  and resid   29 and name   HN) (segid  B  and resid   22 and name  HB3)
assign (segid  B  and resid   29 and name   HN) (segid  B  and resid   29 and name HG22) 2.656 0.881 0.881 weight 1.000 ! spec=sumo...oesy, no=18, id=16, vol=2.834740e+00
    or (segid  B  and resid   29 and name   HN) (segid  B  and resid   29 and name HG21)
    or (segid  B  and resid   29 and name   HN) (segid  B  and resid   29 and name HG23)
assign (segid  B  and resid   29 and name   HN) (segid  B  and resid   28 and name HG22) 2.559 0.818 0.818 weight 1.000 ! spec=sumo...oesy, no=19, id=17, vol=3.541430e+00
    or (segid  B  and resid   29 and name   HN) (segid  B  and resid   28 and name HG21)
    or (segid  B  and resid   29 and name   HN) (segid  B  and resid   28 and name HG23)
assign (segid  B  and resid   69 and name   HB) (segid  B  and resid   69 and name HG21) 1.844 0.425 0.425 weight 1.000 ! spec=sumo...oesy, no=23, id=752, vol=1.604952e+01
    or (segid  B  and resid   69 and name   HB) (segid  B  and resid   69 and name HG22)
    or (segid  B  and resid   69 and name   HB) (segid  B  and resid   69 and name HG23)
assign (segid  B  and resid   71 and name   HB) (segid  B  and resid   71 and name   HA) 2.249 0.632 0.632 weight 1.000 ! spec=sumo...oesy, no=24, id=753, vol=4.881000e+00
assign (segid  B  and resid   71 and name   HB) (segid  B  and resid   36 and name   HA) 2.436 0.742 0.742 weight 1.000 ! spec=sumo...oesy, no=25, id=754, vol=3.023530e+00
assign (segid  B  and resid   84 and name   HN) (segid  B  and resid   83 and name HG22) 2.666 0.889 0.889 weight 1.000 ! spec=sumo...oesy, no=26, id=23, vol=2.765910e+00
    or (segid  B  and resid   84 and name   HN) (segid  B  and resid   83 and name HG21)
    or (segid  B  and resid   84 and name   HN) (segid  B  and resid   83 and name HG23)
assign (segid  B  and resid   84 and name   HN) (segid  B  and resid   60 and name   HN) 2.980 1.110 1.110 weight 1.000 ! spec=sumo...oesy, no=27, id=24, vol=1.419990e+00
assign (segid  B  and resid   54 and name   HN) (segid  B  and resid   54 and name   HA) 3.045 1.159 1.159 weight 1.000 ! spec=sumo...oesy, no=30, id=26, vol=1.247960e+00
assign (segid  B  and resid   69 and name   HB) (segid  B  and resid   69 and name   HA) 2.063 0.532 0.532 weight 1.000 ! spec=sumo...oesy, no=31, id=759, vol=8.185390e+00
assign (segid  B  and resid   69 and name   HB) (segid  B  and resid   38 and name  HB1) 2.976 1.107 1.107 weight 1.000 ! spec=sumo...oesy, no=32, id=760, vol=9.098400e-01
assign (segid  B  and resid   54 and name   HN) (segid  B  and resid   53 and name  HB1) 3.301 1.362 1.362 weight 1.000 ! spec=sumo...oesy, no=34, id=30, vol=7.681900e-01
assign (segid  B  and resid   72 and name   HA) (segid  B  and resid   72 and name  HB1) 2.311 0.668 0.668 weight 1.000 ! spec=sumo...oesy, no=38, id=761, vol=4.144260e+00
assign (segid  B  and resid   72 and name   HA) (segid  B  and resid   72 and name  HB2) 2.551 0.814 0.814 weight 1.000 ! spec=sumo...oesy, no=39, id=762, vol=2.290010e+00
assign (segid  B  and resid   72 and name   HA) (segid  B  and resid   75 and name  HB2) 2.629 0.864 0.864 weight 1.000 ! spec=sumo...oesy, no=41, id=764, vol=1.913270e+00
assign (segid  B  and resid   72 and name   HA) (segid  B  and resid   75 and name HD12) 2.706 0.915 0.915 weight 1.000 ! spec=sumo...oesy, no=43, id=766, vol=1.609760e+00
    or (segid  B  and resid   72 and name   HA) (segid  B  and resid   75 and name HD11)
    or (segid  B  and resid   72 and name   HA) (segid  B  and resid   75 and name HD13)
assign (segid  B  and resid   63 and name   HN) (segid  B  and resid   62 and name   HA) 2.413 0.728 0.728 weight 1.000 ! spec=sumo...oesy, no=44, id=36, vol=5.039070e+00
assign (segid  B  and resid   63 and name   HN) (segid  B  and resid   63 and name  HA2) 2.266 0.642 0.642 weight 1.000 ! spec=sumo...oesy, no=45, id=37, vol=7.337970e+00
assign (segid  B  and resid   65 and name   HA) (segid  B  and resid   60 and name   HA) 2.600 0.845 0.845 weight 1.000 ! spec=sumo...oesy, no=51, id=768, vol=2.045230e+00
assign (segid  B  and resid   65 and name   HA) (segid  B  and resid   65 and name  HB1) 2.508 0.786 0.786 weight 1.000 ! spec=sumo...oesy, no=53, id=770, vol=2.541620e+00
assign (segid  B  and resid   11 and name   HN) (segid  B  and resid   10 and name   HA) 2.065 0.533 0.533 weight 1.000 ! spec=sumo...oesy, no=54, id=43, vol=1.280180e+01
assign (segid  B  and resid   11 and name   HN) (segid  B  and resid   11 and name  HB2) 2.393 0.716 0.716 weight 1.000 ! spec=sumo...oesy, no=55, id=44, vol=5.298160e+00
assign (segid  B  and resid   90 and name   HA) (segid  B  and resid   90 and name HG21) 2.447 0.749 0.749 weight 1.000 ! spec=sumo...oesy, no=58, id=773, vol=2.940090e+00
    or (segid  B  and resid   90 and name   HA) (segid  B  and resid   90 and name HG22)
    or (segid  B  and resid   90 and name   HA) (segid  B  and resid   90 and name HG23)
assign (segid  B  and resid   69 and name   HN) (segid  B  and resid   69 and name   HB) 3.178 1.263 1.263 weight 1.000 ! spec=sumo...oesy, no=59, id=47, vol=9.640900e-01
assign (segid  B  and resid    6 and name   HA) (segid  B  and resid    6 and name  HB1) 2.085 0.543 0.543 weight 1.000 ! spec=sumo...oesy, no=60, id=774, vol=7.691850e+00
assign (segid  B  and resid    6 and name   HA) (segid  B  and resid    6 and name  HB2) 2.621 0.858 0.858 weight 1.000 ! spec=sumo...oesy, no=61, id=775, vol=1.950980e+00
assign (segid  B  and resid   38 and name   HA) (segid  B  and resid   71 and name   HA) 2.565 0.822 0.822 weight 1.000 ! spec=sumo...oesy, no=63, id=777, vol=2.220100e+00
assign (segid  B  and resid   38 and name   HA) (segid  B  and resid   38 and name  HB1) 2.201 0.605 0.605 weight 1.000 ! spec=sumo...oesy, no=64, id=778, vol=5.559200e+00
assign (segid  B  and resid   30 and name   HN) (segid  B  and resid   29 and name HG22) 2.822 0.996 0.996 weight 1.000 ! spec=sumo...oesy, no=65, id=53, vol=1.966540e+00
    or (segid  B  and resid   30 and name   HN) (segid  B  and resid   29 and name HG21)
    or (segid  B  and resid   30 and name   HN) (segid  B  and resid   29 and name HG23)
assign (segid  B  and resid   38 and name   HA) (segid  B  and resid   37 and name HG21) 3.051 1.164 1.164 weight 1.000 ! spec=sumo...oesy, no=67, id=781, vol=7.832400e-01
    or (segid  B  and resid   38 and name   HA) (segid  B  and resid   37 and name HG22)
    or (segid  B  and resid   38 and name   HA) (segid  B  and resid   37 and name HG23)
assign (segid  B  and resid   38 and name   HA) (segid  B  and resid   71 and name HG21) 2.068 0.535 0.535 weight 1.000 ! spec=sumo...oesy, no=68, id=782, vol=8.076550e+00
    or (segid  B  and resid   38 and name   HA) (segid  B  and resid   71 and name HG22)
    or (segid  B  and resid   38 and name   HA) (segid  B  and resid   71 and name HG23)
assign (segid  B  and resid   30 and name   HN) (segid  B  and resid   29 and name HG12) 2.378 0.707 0.707 weight 1.000 ! spec=sumo...oesy, no=69, id=57, vol=5.496250e+00
    or (segid  B  and resid   30 and name   HN) (segid  B  and resid   29 and name HG11)
    or (segid  B  and resid   30 and name   HN) (segid  B  and resid   29 and name HG13)
assign (segid  B  and resid   69 and name   HN) (segid  B  and resid   67 and name   HA) 3.152 1.242 1.242 weight 1.000 ! spec=sumo...oesy, no=70, id=58, vol=1.014540e+00
assign (segid  B  and resid   46 and name   HA) (segid  B  and resid   46 and name  HD1) 2.055 0.528 0.528 weight 1.000 ! spec=sumo...oesy, no=71, id=784, vol=8.390220e+00
    or (segid  B  and resid   46 and name   HA) (segid  B  and resid   46 and name  HD2)
assign (segid  B  and resid   46 and name   HA) (segid  B  and resid   50 and name HE21) 3.005 1.129 1.129 weight 1.000 ! spec=sumo...oesy, no=72, id=785, vol=8.573100e-01
assign (segid  B  and resid   46 and name   HA) (segid  B  and resid   46 and name  HB1) 2.460 0.757 0.757 weight 1.000 ! spec=sumo...oesy, no=73, id=786, vol=2.848440e+00
assign (segid  B  and resid   46 and name   HA) (segid  B  and resid   46 and name  HB2) 2.384 0.711 0.711 weight 1.000 ! spec=sumo...oesy, no=74, id=787, vol=3.439280e+00
assign (segid  B  and resid   46 and name   HA) (segid  B  and resid   49 and name  HB2) 2.679 0.897 0.897 weight 1.000 ! spec=sumo...oesy, no=75, id=788, vol=1.709090e+00
assign (segid  B  and resid   31 and name  HD1) (segid  B  and resid   31 and name   HA) 2.662 0.886 0.886 weight 1.000 ! spec=sumo...oesy, no=79, id=792, vol=1.773890e+00
    or (segid  B  and resid   31 and name  HD2) (segid  B  and resid   31 and name   HA)
assign (segid  B  and resid   31 and name  HD1) (segid  B  and resid   31 and name  HB2) 2.356 0.694 0.694 weight 1.000 ! spec=sumo...oesy, no=80, id=793, vol=3.696450e+00
    or (segid  B  and resid   31 and name  HD2) (segid  B  and resid   31 and name  HB2)
assign (segid  B  and resid   86 and name   HN) (segid  B  and resid   86 and name  HB1) 2.926 1.070 1.070 weight 1.000 ! spec=sumo...oesy, no=81, id=65, vol=1.583440e+00
assign (segid  B  and resid   86 and name   HN) (segid  B  and resid   86 and name  HB2) 2.788 0.972 0.972 weight 1.000 ! spec=sumo...oesy, no=82, id=66, vol=2.115520e+00
assign (segid  B  and resid   86 and name   HN) (segid  B  and resid   85 and name HG12) 2.752 0.946 0.946 weight 1.000 ! spec=sumo...oesy, no=84, id=68, vol=2.289980e+00
    or (segid  B  and resid   86 and name   HN) (segid  B  and resid   85 and name HG11)
    or (segid  B  and resid   86 and name   HN) (segid  B  and resid   85 and name HG13)
assign (segid  B  and resid   86 and name   HN) (segid  B  and resid   85 and name HG22) 2.960 1.095 1.095 weight 1.000 ! spec=sumo...oesy, no=85, id=69, vol=1.478680e+00
    or (segid  B  and resid   86 and name   HN) (segid  B  and resid   85 and name HG21)
    or (segid  B  and resid   86 and name   HN) (segid  B  and resid   85 and name HG23)
assign (segid  B  and resid   86 and name   HN) (segid  B  and resid   57 and name HG22) 3.318 1.376 1.376 weight 1.000 ! spec=sumo...oesy, no=86, id=70, vol=7.444900e-01
    or (segid  B  and resid   86 and name   HN) (segid  B  and resid   57 and name HG21)
    or (segid  B  and resid   86 and name   HN) (segid  B  and resid   57 and name HG23)
assign (segid  B  and resid   86 and name   HN) (segid  B  and resid   59 and name   HA) 3.122 1.218 1.218 weight 1.000 ! spec=sumo...oesy, no=87, id=71, vol=1.073460e+00
assign (segid  B  and resid   46 and name  HD1) (segid  B  and resid   46 and name  HB1) 2.322 0.674 0.674 weight 1.000 ! spec=sumo...oesy, no=88, id=801, vol=4.031630e+00
    or (segid  B  and resid   46 and name  HD2) (segid  B  and resid   46 and name  HB1)
assign (segid  B  and resid   67 and name   HN) (segid  B  and resid   70 and name  HB1) 3.322 1.380 1.380 weight 1.000 ! spec=sumo...oesy, no=89, id=73, vol=7.391400e-01
assign (segid  B  and resid   67 and name   HN) (segid  B  and resid   67 and name HD21) 3.135 1.229 1.229 weight 1.000 ! spec=sumo...oesy, no=91, id=74, vol=1.046670e+00
assign (segid  B  and resid   67 and name   HN) (segid  B  and resid   67 and name   HA) 2.764 0.955 0.955 weight 1.000 ! spec=sumo...oesy, no=93, id=76, vol=2.230510e+00
assign (segid  B  and resid   67 and name   HN) (segid  B  and resid   66 and name   HA) 2.190 0.599 0.599 weight 1.000 ! spec=sumo...oesy, no=94, id=77, vol=9.014030e+00
assign (segid  B  and resid   67 and name   HN) (segid  B  and resid   67 and name  HB2) 2.582 0.834 0.834 weight 1.000 ! spec=sumo...oesy, no=95, id=78, vol=3.352760e+00
assign (segid  B  and resid   67 and name   HN) (segid  B  and resid   66 and name   HB) 2.721 0.926 0.926 weight 1.000 ! spec=sumo...oesy, no=96, id=79, vol=2.447040e+00
assign (segid  B  and resid   59 and name  HD1) (segid  B  and resid   59 and name  HB1) 2.494 0.778 0.778 weight 1.000 ! spec=sumo...oesy, no=98, id=811, vol=2.624900e+00
    or (segid  B  and resid   59 and name  HD2) (segid  B  and resid   59 and name  HB1)
assign (segid  B  and resid   59 and name  HD1) (segid  B  and resid   59 and name  HB2) 2.483 0.771 0.771 weight 1.000 ! spec=sumo...oesy, no=99, id=812, vol=2.693910e+00
    or (segid  B  and resid   59 and name  HD2) (segid  B  and resid   59 and name  HB2)
assign (segid  B  and resid    5 and name   HN) (segid  B  and resid    4 and name   HA) 2.201 0.605 0.605 weight 1.000 ! spec=sumo...oesy, no=102, id=84, vol=8.753960e+00
assign (segid  B  and resid   59 and name  HD1) (segid  B  and resid   85 and name HG12) 2.835 1.005 1.005 weight 1.000 ! spec=sumo...oesy, no=103, id=816, vol=1.217030e+00
    or (segid  B  and resid   59 and name  HD1) (segid  B  and resid   85 and name HG11)
    or (segid  B  and resid   59 and name  HD1) (segid  B  and resid   85 and name HG13)
    or (segid  B  and resid   59 and name  HD2) (segid  B  and resid   85 and name HG12)
    or (segid  B  and resid   59 and name  HD2) (segid  B  and resid   85 and name HG11)
    or (segid  B  and resid   59 and name  HD2) (segid  B  and resid   85 and name HG13)
assign (segid  B  and resid   59 and name  HD1) (segid  B  and resid   85 and name HG22) 2.430 0.738 0.738 weight 1.000 ! spec=sumo...oesy, no=104, id=817, vol=3.067320e+00
    or (segid  B  and resid   59 and name  HD1) (segid  B  and resid   85 and name HG21)
    or (segid  B  and resid   59 and name  HD1) (segid  B  and resid   85 and name HG23)
    or (segid  B  and resid   59 and name  HD2) (segid  B  and resid   85 and name HG22)
    or (segid  B  and resid   59 and name  HD2) (segid  B  and resid   85 and name HG21)
    or (segid  B  and resid   59 and name  HD2) (segid  B  and resid   85 and name HG23)
assign (segid  B  and resid   82 and name   HB) (segid  B  and resid   82 and name   HA) 2.342 0.686 0.686 weight 1.000 ! spec=sumo...oesy, no=106, id=819, vol=3.824940e+00
assign (segid  B  and resid   82 and name   HA) (segid  B  and resid   20 and name  HB1) 2.212 0.612 0.612 weight 1.000 ! spec=sumo...oesy, no=107, id=820, vol=5.393220e+00
assign (segid  B  and resid   82 and name   HA) (segid  B  and resid   20 and name  HB2) 2.372 0.703 0.703 weight 1.000 ! spec=sumo...oesy, no=108, id=821, vol=3.551150e+00
assign (segid  B  and resid   10 and name   HA) (segid  B  and resid   10 and name   HB) 2.095 0.549 0.549 weight 1.000 ! spec=sumo...oesy, no=111, id=824, vol=7.466400e+00
assign (segid  B  and resid   10 and name   HA) (segid  B  and resid   10 and name HG22) 1.890 0.447 0.447 weight 1.000 ! spec=sumo...oesy, no=112, id=825, vol=1.384192e+01
    or (segid  B  and resid   10 and name   HA) (segid  B  and resid   10 and name HG21)
    or (segid  B  and resid   10 and name   HA) (segid  B  and resid   10 and name HG23)
assign (segid  B  and resid   89 and name   HN) (segid  B  and resid   88 and name   HA) 2.468 0.762 0.762 weight 1.000 ! spec=sumo...oesy, no=114, id=94, vol=4.395560e+00
assign (segid  B  and resid   19 and name   HN) (segid  B  and resid   18 and name   HA) 2.198 0.604 0.604 weight 1.000 ! spec=sumo...oesy, no=117, id=96, vol=8.824370e+00
assign (segid  B  and resid   19 and name   HN) (segid  B  and resid   32 and name   HA) 3.092 1.195 1.195 weight 1.000 ! spec=sumo...oesy, no=118, id=97, vol=1.137470e+00
assign (segid  B  and resid   61 and name  HD1) (segid  B  and resid   75 and name  HB1) 2.754 0.948 0.948 weight 1.000 ! spec=sumo...oesy, no=119, id=831, vol=1.448710e+00
    or (segid  B  and resid   61 and name  HD2) (segid  B  and resid   75 and name  HB1)
assign (segid  B  and resid   19 and name   HN) (segid  B  and resid   19 and name  HB2) 3.007 1.130 1.130 weight 1.000 ! spec=sumo...oesy, no=121, id=100, vol=1.345160e+00
assign (segid  B  and resid   34 and name   HN) (segid  B  and resid   33 and name   HA) 2.521 0.794 0.794 weight 1.000 ! spec=sumo...oesy, no=124, id=102, vol=3.874830e+00
assign (segid  B  and resid   34 and name   HN) (segid  B  and resid   34 and name   HA) 3.014 1.135 1.135 weight 1.000 ! spec=sumo...oesy, no=125, id=103, vol=1.327180e+00
assign (segid  B  and resid   34 and name   HN) (segid  B  and resid   37 and name   HB) 3.404 1.448 1.448 weight 1.000 ! spec=sumo...oesy, no=126, id=104, vol=6.392800e-01
assign (segid  B  and resid   86 and name  HD1) (segid  B  and resid   86 and name   HA) 2.585 0.835 0.835 weight 1.000 ! spec=sumo...oesy, no=127, id=838, vol=2.118620e+00
    or (segid  B  and resid   86 and name  HD2) (segid  B  and resid   86 and name   HA)
assign (segid  B  and resid   86 and name  HD1) (segid  B  and resid   86 and name  HB1) 2.415 0.729 0.729 weight 1.000 ! spec=sumo...oesy, no=128, id=839, vol=3.185000e+00
    or (segid  B  and resid   86 and name  HD2) (segid  B  and resid   86 and name  HB1)
assign (segid  B  and resid   86 and name  HD1) (segid  B  and resid   86 and name  HB2) 2.376 0.705 0.705 weight 1.000 ! spec=sumo...oesy, no=129, id=840, vol=3.514610e+00
    or (segid  B  and resid   86 and name  HD2) (segid  B  and resid   86 and name  HB2)
assign (segid  B  and resid   82 and name   HA) (segid  B  and resid   20 and name  HE1) 3.001 1.126 1.126 weight 1.000 ! spec=sumo...oesy, no=131, id=842, vol=8.648300e-01
assign (segid  B  and resid   28 and name   HA) (segid  B  and resid   22 and name   HA) 1.964 0.482 0.482 weight 1.000 ! spec=sumo...oesy, no=132, id=843, vol=1.102437e+01
assign (segid  B  and resid   28 and name   HA) (segid  B  and resid   28 and name   HB) 2.269 0.643 0.643 weight 1.000 ! spec=sumo...oesy, no=133, id=844, vol=4.631290e+00
assign (segid  B  and resid   70 and name   HN) (segid  B  and resid   69 and name   HA) 2.874 1.033 1.033 weight 1.000 ! spec=sumo...oesy, no=134, id=111, vol=1.762600e+00
assign (segid  B  and resid   28 and name   HA) (segid  B  and resid   29 and name HG22) 2.777 0.964 0.964 weight 1.000 ! spec=sumo...oesy, no=135, id=846, vol=1.378710e+00
    or (segid  B  and resid   28 and name   HA) (segid  B  and resid   29 and name HG21)
    or (segid  B  and resid   28 and name   HA) (segid  B  and resid   29 and name HG23)
assign (segid  B  and resid   70 and name   HN) (segid  B  and resid   70 and name  HB1) 2.589 0.838 0.838 weight 1.000 ! spec=sumo...oesy, no=136, id=113, vol=3.302220e+00
assign (segid  B  and resid   70 and name   HN) (segid  B  and resid   39 and name HD12) 3.076 1.183 1.183 weight 1.000 ! spec=sumo...oesy, no=139, id=116, vol=1.172930e+00
    or (segid  B  and resid   70 and name   HN) (segid  B  and resid   39 and name HD11)
    or (segid  B  and resid   70 and name   HN) (segid  B  and resid   39 and name HD13)
assign (segid  B  and resid   12 and name   HA) (segid  B  and resid   12 and name HG21) 1.941 0.471 0.471 weight 1.000 ! spec=sumo...oesy, no=141, id=849, vol=1.182504e+01
    or (segid  B  and resid   12 and name   HA) (segid  B  and resid   12 and name HG22)
    or (segid  B  and resid   12 and name   HA) (segid  B  and resid   12 and name HG23)
assign (segid  B  and resid   70 and name   HN) (segid  B  and resid   67 and name  HB2) 3.006 1.130 1.130 weight 1.000 ! spec=sumo...oesy, no=142, id=119, vol=1.347290e+00
assign (segid  B  and resid   46 and name  HE1) (segid  B  and resid   85 and name   HB) 2.303 0.663 0.663 weight 1.000 ! spec=sumo...oesy, no=144, id=852, vol=4.240250e+00
    or (segid  B  and resid   46 and name  HE2) (segid  B  and resid   85 and name   HB)
assign (segid  B  and resid   46 and name  HE1) (segid  B  and resid   29 and name HG12) 2.129 0.567 0.567 weight 1.000 ! spec=sumo...oesy, no=145, id=853, vol=6.777350e+00
    or (segid  B  and resid   46 and name  HE1) (segid  B  and resid   29 and name HG11)
    or (segid  B  and resid   46 and name  HE1) (segid  B  and resid   29 and name HG13)
    or (segid  B  and resid   46 and name  HE2) (segid  B  and resid   29 and name HG12)
    or (segid  B  and resid   46 and name  HE2) (segid  B  and resid   29 and name HG11)
    or (segid  B  and resid   46 and name  HE2) (segid  B  and resid   29 and name HG13)
assign (segid  B  and resid   46 and name  HE1) (segid  B  and resid   49 and name  HD2) 2.906 1.055 1.055 weight 1.000 ! spec=sumo...oesy, no=146, id=854, vol=1.049770e+00
    or (segid  B  and resid   46 and name  HE2) (segid  B  and resid   49 and name  HD2)
assign (segid  B  and resid   18 and name   HN) (segid  B  and resid   18 and name HD21) 3.128 1.223 1.223 weight 1.000 ! spec=sumo...oesy, no=147, id=123, vol=1.060340e+00
assign (segid  B  and resid   46 and name  HE1) (segid  B  and resid   21 and name HG12) 2.925 1.069 1.069 weight 1.000 ! spec=sumo...oesy, no=148, id=856, vol=1.009680e+00
    or (segid  B  and resid   46 and name  HE1) (segid  B  and resid   21 and name HG11)
    or (segid  B  and resid   46 and name  HE1) (segid  B  and resid   21 and name HG13)
    or (segid  B  and resid   46 and name  HE2) (segid  B  and resid   21 and name HG12)
    or (segid  B  and resid   46 and name  HE2) (segid  B  and resid   21 and name HG11)
    or (segid  B  and resid   46 and name  HE2) (segid  B  and resid   21 and name HG13)
assign (segid  B  and resid   18 and name   HN) (segid  B  and resid   18 and name  HB2) 2.803 0.982 0.982 weight 1.000 ! spec=sumo...oesy, no=150, id=126, vol=2.050160e+00
assign (segid  B  and resid   18 and name   HN) (segid  B  and resid   17 and name   HB) 2.790 0.973 0.973 weight 1.000 ! spec=sumo...oesy, no=151, id=127, vol=2.107610e+00
assign (segid  B  and resid   18 and name   HN) (segid  B  and resid   17 and name HG12) 3.125 1.221 1.221 weight 1.000 ! spec=sumo...oesy, no=152, id=128, vol=1.066400e+00
assign (segid  B  and resid   21 and name   HA) (segid  B  and resid   21 and name   HB) 2.620 0.858 0.858 weight 1.000 ! spec=sumo...oesy, no=154, id=858, vol=1.954020e+00
assign (segid  B  and resid   21 and name   HA) (segid  B  and resid   83 and name   HB) 2.480 0.769 0.769 weight 1.000 ! spec=sumo...oesy, no=155, id=859, vol=2.713840e+00
assign (segid  B  and resid   21 and name   HA) (segid  B  and resid   22 and name  HB2) 2.914 1.061 1.061 weight 1.000 ! spec=sumo...oesy, no=156, id=860, vol=1.032090e+00
    or (segid  B  and resid   21 and name   HA) (segid  B  and resid   22 and name  HB1)
    or (segid  B  and resid   21 and name   HA) (segid  B  and resid   22 and name  HB3)
assign (segid  B  and resid   13 and name   HN) (segid  B  and resid   13 and name  HB2) 2.782 0.967 0.967 weight 1.000 ! spec=sumo...oesy, no=157, id=133, vol=2.145290e+00
assign (segid  B  and resid   21 and name   HA) (segid  B  and resid   21 and name HG22) 2.204 0.607 0.607 weight 1.000 ! spec=sumo...oesy, no=158, id=862, vol=5.512040e+00
    or (segid  B  and resid   21 and name   HA) (segid  B  and resid   21 and name HG21)
    or (segid  B  and resid   21 and name   HA) (segid  B  and resid   21 and name HG23)
assign (segid  B  and resid   32 and name   HN) (segid  B  and resid   31 and name  HD1) 3.311 1.370 1.370 weight 1.000 ! spec=sumo...oesy, no=161, id=136, vol=7.547700e-01
    or (segid  B  and resid   32 and name   HN) (segid  B  and resid   31 and name  HD2)
assign (segid  B  and resid   32 and name   HN) (segid  B  and resid   32 and name   HA) 2.863 1.025 1.025 weight 1.000 ! spec=sumo...oesy, no=162, id=137, vol=1.803870e+00
assign (segid  B  and resid   32 and name   HN) (segid  B  and resid   31 and name  HB2) 2.755 0.949 0.949 weight 1.000 ! spec=sumo...oesy, no=163, id=138, vol=2.273790e+00
assign (segid  B  and resid   32 and name   HN) (segid  B  and resid   31 and name  HB1) 3.025 1.143 1.143 weight 1.000 ! spec=sumo...oesy, no=164, id=139, vol=1.298490e+00
assign (segid  B  and resid   32 and name   HN) (segid  B  and resid   31 and name   HN) 3.294 1.356 1.356 weight 1.000 ! spec=sumo...oesy, no=167, id=142, vol=7.779300e-01
assign (segid  B  and resid   32 and name   HN) (segid  B  and resid   33 and name   HN) 3.195 1.276 1.276 weight 1.000 ! spec=sumo...oesy, no=168, id=143, vol=9.353500e-01
assign (segid  B  and resid   69 and name   HA) (segid  B  and resid   69 and name HG21) 1.882 0.443 0.443 weight 1.000 ! spec=sumo...oesy, no=173, id=873, vol=1.421443e+01
    or (segid  B  and resid   69 and name   HA) (segid  B  and resid   69 and name HG22)
    or (segid  B  and resid   69 and name   HA) (segid  B  and resid   69 and name HG23)
assign (segid  B  and resid   46 and name  HE1) (segid  B  and resid   46 and name  HD1) 1.920 0.461 0.461 weight 1.000 ! spec=sumo...oesy, no=174, id=874, vol=1.259669e+01
    or (segid  B  and resid   46 and name  HE1) (segid  B  and resid   46 and name  HD2)
    or (segid  B  and resid   46 and name  HE2) (segid  B  and resid   46 and name  HD1)
    or (segid  B  and resid   46 and name  HE2) (segid  B  and resid   46 and name  HD2)
assign (segid  B  and resid   59 and name  HE1) (segid  B  and resid   59 and name   HZ) 2.155 0.581 0.581 weight 1.000 ! spec=sumo...oesy, no=175, id=875, vol=6.302120e+00
    or (segid  B  and resid   59 and name  HE2) (segid  B  and resid   59 and name   HZ)
assign (segid  B  and resid   59 and name  HE1) (segid  B  and resid   59 and name  HD1) 1.796 0.403 0.403 weight 1.000 ! spec=sumo...oesy, no=176, id=876, vol=1.882633e+01
    or (segid  B  and resid   59 and name  HE1) (segid  B  and resid   59 and name  HD2)
    or (segid  B  and resid   59 and name  HE2) (segid  B  and resid   59 and name  HD1)
    or (segid  B  and resid   59 and name  HE2) (segid  B  and resid   59 and name  HD2)
assign (segid  B  and resid   39 and name   HN) (segid  B  and resid   71 and name HG21) 2.813 0.989 0.989 weight 1.000 ! spec=sumo...oesy, no=177, id=145, vol=2.005620e+00
    or (segid  B  and resid   39 and name   HN) (segid  B  and resid   71 and name HG22)
    or (segid  B  and resid   39 and name   HN) (segid  B  and resid   71 and name HG23)
assign (segid  B  and resid   59 and name  HE1) (segid  B  and resid   43 and name   HA) 2.630 0.864 0.864 weight 1.000 ! spec=sumo...oesy, no=178, id=877, vol=1.911010e+00
    or (segid  B  and resid   59 and name  HE2) (segid  B  and resid   43 and name   HA)
assign (segid  B  and resid   59 and name  HE1) (segid  B  and resid   57 and name HG11) 3.059 1.170 1.170 weight 1.000 ! spec=sumo...oesy, no=181, id=880, vol=7.705700e-01
    or (segid  B  and resid   59 and name  HE2) (segid  B  and resid   57 and name HG11)
assign (segid  B  and resid   59 and name  HE1) (segid  B  and resid   57 and name HD12) 2.469 0.762 0.762 weight 1.000 ! spec=sumo...oesy, no=183, id=882, vol=2.787590e+00
    or (segid  B  and resid   59 and name  HE1) (segid  B  and resid   57 and name HD11)
    or (segid  B  and resid   59 and name  HE1) (segid  B  and resid   57 and name HD13)
    or (segid  B  and resid   59 and name  HE2) (segid  B  and resid   57 and name HD12)
    or (segid  B  and resid   59 and name  HE2) (segid  B  and resid   57 and name HD11)
    or (segid  B  and resid   59 and name  HE2) (segid  B  and resid   57 and name HD13)
assign (segid  B  and resid   39 and name   HN) (segid  B  and resid   39 and name   HG) 2.697 0.909 0.909 weight 1.000 ! spec=sumo...oesy, no=186, id=153, vol=2.584990e+00
assign (segid  B  and resid   33 and name   HN) (segid  B  and resid   17 and name   HN) 2.805 0.984 0.984 weight 1.000 ! spec=sumo...oesy, no=187, id=154, vol=2.040030e+00
assign (segid  B  and resid   33 and name   HN) (segid  B  and resid   32 and name   HA) 2.300 0.661 0.661 weight 1.000 ! spec=sumo...oesy, no=189, id=155, vol=6.713640e+00
assign (segid  B  and resid   83 and name   HA) (segid  B  and resid   82 and name HG21) 2.903 1.053 1.053 weight 1.000 ! spec=sumo...oesy, no=191, id=887, vol=1.056550e+00
    or (segid  B  and resid   83 and name   HA) (segid  B  and resid   82 and name HG22)
    or (segid  B  and resid   83 and name   HA) (segid  B  and resid   82 and name HG23)
assign (segid  B  and resid   28 and name   HN) (segid  B  and resid   28 and name HG12) 2.575 0.829 0.829 weight 1.000 ! spec=sumo...oesy, no=193, id=159, vol=3.409530e+00
    or (segid  B  and resid   28 and name   HN) (segid  B  and resid   28 and name HG11)
    or (segid  B  and resid   28 and name   HN) (segid  B  and resid   28 and name HG13)
assign (segid  B  and resid   28 and name   HN) (segid  B  and resid   28 and name   HA) 2.680 0.898 0.898 weight 1.000 ! spec=sumo...oesy, no=196, id=161, vol=2.685060e+00
assign (segid  B  and resid   29 and name   HA) (segid  B  and resid   29 and name   HB) 2.231 0.622 0.622 weight 1.000 ! spec=sumo...oesy, no=197, id=893, vol=5.119280e+00
assign (segid  B  and resid   29 and name   HA) (segid  B  and resid   29 and name HG12) 1.989 0.495 0.495 weight 1.000 ! spec=sumo...oesy, no=199, id=895, vol=1.019030e+01
    or (segid  B  and resid   29 and name   HA) (segid  B  and resid   29 and name HG11)
    or (segid  B  and resid   29 and name   HA) (segid  B  and resid   29 and name HG13)
assign (segid  B  and resid   85 and name   HA) (segid  B  and resid   59 and name   HA) 2.851 1.016 1.016 weight 1.000 ! spec=sumo...oesy, no=201, id=896, vol=1.177080e+00
assign (segid  B  and resid   78 and name   HN) (segid  B  and resid   77 and name   HA) 2.321 0.673 0.673 weight 1.000 ! spec=sumo...oesy, no=202, id=166, vol=6.357750e+00
assign (segid  B  and resid   78 and name   HN) (segid  B  and resid   78 and name  HB1) 2.777 0.964 0.964 weight 1.000 ! spec=sumo...oesy, no=203, id=167, vol=2.168430e+00
assign (segid  B  and resid   78 and name   HN) (segid  B  and resid   17 and name HD12) 3.177 1.261 1.261 weight 1.000 ! spec=sumo...oesy, no=204, id=168, vol=9.675800e-01
    or (segid  B  and resid   78 and name   HN) (segid  B  and resid   17 and name HD11)
    or (segid  B  and resid   78 and name   HN) (segid  B  and resid   17 and name HD13)
assign (segid  B  and resid   78 and name   HN) (segid  B  and resid   81 and name  HB2) 3.268 1.335 1.335 weight 1.000 ! spec=sumo...oesy, no=205, id=169, vol=8.163600e-01
assign (segid  B  and resid   61 and name  HD1) (segid  B  and resid   83 and name   HA) 2.601 0.845 0.845 weight 1.000 ! spec=sumo...oesy, no=206, id=901, vol=2.041890e+00
    or (segid  B  and resid   61 and name  HD2) (segid  B  and resid   83 and name   HA)
assign (segid  B  and resid   83 and name   HA) (segid  B  and resid   61 and name   HA) 2.636 0.869 0.869 weight 1.000 ! spec=sumo...oesy, no=207, id=902, vol=1.882960e+00
assign (segid  B  and resid   83 and name   HA) (segid  B  and resid   83 and name   HB) 2.499 0.781 0.781 weight 1.000 ! spec=sumo...oesy, no=208, id=903, vol=2.592230e+00
assign (segid  B  and resid   33 and name   HN) (segid  B  and resid   18 and name   HA) 3.253 1.322 1.322 weight 1.000 ! spec=sumo...oesy, no=209, id=173, vol=8.394900e-01
assign (segid  B  and resid   83 and name   HA) (segid  B  and resid   83 and name HG22) 2.347 0.689 0.689 weight 1.000 ! spec=sumo...oesy, no=210, id=905, vol=3.775640e+00
    or (segid  B  and resid   83 and name   HA) (segid  B  and resid   83 and name HG21)
    or (segid  B  and resid   83 and name   HA) (segid  B  and resid   83 and name HG23)
assign (segid  B  and resid   66 and name   HA) (segid  B  and resid   66 and name   HB) 2.301 0.662 0.662 weight 1.000 ! spec=sumo...oesy, no=214, id=909, vol=4.254470e+00
assign (segid  B  and resid   66 and name   HA) (segid  B  and resid   66 and name HG11) 2.704 0.914 0.914 weight 1.000 ! spec=sumo...oesy, no=215, id=910, vol=1.616980e+00
assign (segid  B  and resid   66 and name   HA) (segid  B  and resid   66 and name HG22) 2.011 0.506 0.506 weight 1.000 ! spec=sumo...oesy, no=216, id=911, vol=9.543340e+00
    or (segid  B  and resid   66 and name   HA) (segid  B  and resid   66 and name HG21)
    or (segid  B  and resid   66 and name   HA) (segid  B  and resid   66 and name HG23)
assign (segid  B  and resid   44 and name   HA) (segid  B  and resid   47 and name  HB2) 2.493 0.777 0.777 weight 1.000 ! spec=sumo...oesy, no=217, id=912, vol=2.630070e+00
assign (segid  B  and resid   78 and name   HN) (segid  B  and resid   77 and name   HN) 3.293 1.356 1.356 weight 1.000 ! spec=sumo...oesy, no=218, id=181, vol=7.793000e-01
assign (segid  B  and resid   78 and name   HN) (segid  B  and resid   81 and name  HB1) 3.069 1.177 1.177 weight 1.000 ! spec=sumo...oesy, no=219, id=182, vol=1.190630e+00
assign (segid  B  and resid   78 and name   HN) (segid  B  and resid   77 and name  HB2) 2.945 1.084 1.084 weight 1.000 ! spec=sumo...oesy, no=220, id=183, vol=1.525170e+00
assign (segid  B  and resid   33 and name   HA) (segid  B  and resid   33 and name   HB) 2.111 0.557 0.557 weight 1.000 ! spec=sumo...oesy, no=222, id=917, vol=7.136330e+00
assign (segid  B  and resid   33 and name   HA) (segid  B  and resid   33 and name HG11) 2.370 0.702 0.702 weight 1.000 ! spec=sumo...oesy, no=223, id=918, vol=3.568410e+00
assign (segid  B  and resid   33 and name   HA) (segid  B  and resid   33 and name HG12) 2.598 0.843 0.843 weight 1.000 ! spec=sumo...oesy, no=224, id=919, vol=2.056210e+00
assign (segid  B  and resid   85 and name   HA) (segid  B  and resid   57 and name   HB) 2.849 1.015 1.015 weight 1.000 ! spec=sumo...oesy, no=226, id=921, vol=1.181790e+00
assign (segid  B  and resid   17 and name   HA) (segid  B  and resid   17 and name HG22) 2.384 0.710 0.710 weight 1.000 ! spec=sumo...oesy, no=229, id=924, vol=3.444590e+00
    or (segid  B  and resid   17 and name   HA) (segid  B  and resid   17 and name HG21)
    or (segid  B  and resid   17 and name   HA) (segid  B  and resid   17 and name HG23)
assign (segid  B  and resid   60 and name   HN) (segid  B  and resid   59 and name  HB2) 2.986 1.114 1.114 weight 1.000 ! spec=sumo...oesy, no=230, id=190, vol=1.402720e+00
assign (segid  B  and resid   60 and name   HN) (segid  B  and resid   60 and name  HB1) 2.751 0.946 0.946 weight 1.000 ! spec=sumo...oesy, no=231, id=191, vol=2.292860e+00
assign (segid  B  and resid   44 and name   HA) (segid  B  and resid   44 and name  HB2) 1.900 0.451 0.451 weight 1.000 ! spec=sumo...oesy, no=232, id=926, vol=1.342148e+01
assign (segid  B  and resid   60 and name   HN) (segid  B  and resid   66 and name HD12) 3.208 1.287 1.287 weight 1.000 ! spec=sumo...oesy, no=233, id=193, vol=9.112200e-01
    or (segid  B  and resid   60 and name   HN) (segid  B  and resid   66 and name HD11)
    or (segid  B  and resid   60 and name   HN) (segid  B  and resid   66 and name HD13)
assign (segid  B  and resid   60 and name   HN) (segid  B  and resid   59 and name  HD1) 3.068 1.176 1.176 weight 1.000 ! spec=sumo...oesy, no=236, id=195, vol=1.192720e+00
    or (segid  B  and resid   60 and name   HN) (segid  B  and resid   59 and name  HD2)
assign (segid  B  and resid   57 and name   HA) (segid  B  and resid   87 and name HE22) 2.754 0.948 0.948 weight 1.000 ! spec=sumo...oesy, no=237, id=931, vol=1.449670e+00
assign (segid  B  and resid   57 and name   HA) (segid  B  and resid   87 and name  HB1) 3.010 1.133 1.133 weight 1.000 ! spec=sumo...oesy, no=238, id=932, vol=8.487900e-01
assign (segid  B  and resid   57 and name   HA) (segid  B  and resid   87 and name  HB2) 2.905 1.055 1.055 weight 1.000 ! spec=sumo...oesy, no=239, id=933, vol=1.050620e+00
assign (segid  B  and resid   57 and name   HA) (segid  B  and resid   57 and name   HB) 2.129 0.567 0.567 weight 1.000 ! spec=sumo...oesy, no=240, id=934, vol=6.785210e+00
assign (segid  B  and resid    8 and name   HN) (segid  B  and resid    7 and name   HA) 2.076 0.538 0.538 weight 1.000 ! spec=sumo...oesy, no=241, id=200, vol=1.243455e+01
assign (segid  B  and resid    8 and name   HN) (segid  B  and resid    8 and name  HB2) 2.526 0.797 0.797 weight 1.000 ! spec=sumo...oesy, no=243, id=202, vol=3.828650e+00
assign (segid  B  and resid   33 and name   HA) (segid  B  and resid   16 and name  HD2) 2.700 0.911 0.911 weight 1.000 ! spec=sumo...oesy, no=244, id=938, vol=1.629760e+00
assign (segid  B  and resid   21 and name   HN) (segid  B  and resid   20 and name  HB2) 3.121 1.217 1.217 weight 1.000 ! spec=sumo...oesy, no=245, id=204, vol=1.076430e+00
assign (segid  B  and resid   21 and name   HN) (segid  B  and resid   29 and name HG22) 3.384 1.431 1.431 weight 1.000 ! spec=sumo...oesy, no=246, id=205, vol=6.619600e-01
    or (segid  B  and resid   21 and name   HN) (segid  B  and resid   29 and name HG21)
    or (segid  B  and resid   21 and name   HN) (segid  B  and resid   29 and name HG23)
assign (segid  B  and resid   29 and name   HN) (segid  B  and resid   21 and name   HN) 2.600 0.845 0.845 weight 1.000 ! spec=sumo...oesy, no=248, id=206, vol=3.217870e+00
assign (segid  B  and resid   48 and name   HA) (segid  B  and resid   48 and name  HB1) 1.933 0.467 0.467 weight 1.000 ! spec=sumo...oesy, no=250, id=943, vol=1.210735e+01
assign (segid  B  and resid   21 and name   HN) (segid  B  and resid   21 and name   HB) 2.534 0.803 0.803 weight 1.000 ! spec=sumo...oesy, no=251, id=209, vol=3.755800e+00
assign (segid  B  and resid   21 and name   HN) (segid  B  and resid   21 and name HG22) 2.615 0.855 0.855 weight 1.000 ! spec=sumo...oesy, no=253, id=211, vol=3.108720e+00
    or (segid  B  and resid   21 and name   HN) (segid  B  and resid   21 and name HG21)
    or (segid  B  and resid   21 and name   HN) (segid  B  and resid   21 and name HG23)
assign (segid  B  and resid   21 and name   HN) (segid  B  and resid   21 and name HG12) 3.207 1.286 1.286 weight 1.000 ! spec=sumo...oesy, no=254, id=212, vol=9.136000e-01
    or (segid  B  and resid   21 and name   HN) (segid  B  and resid   21 and name HG11)
    or (segid  B  and resid   21 and name   HN) (segid  B  and resid   21 and name HG13)
assign (segid  B  and resid   58 and name   HN) (segid  B  and resid   87 and name   HN) 3.304 1.365 1.365 weight 1.000 ! spec=sumo...oesy, no=255, id=213, vol=7.636600e-01
assign (segid  B  and resid   45 and name   HN) (segid  B  and resid   45 and name   HA) 2.544 0.809 0.809 weight 1.000 ! spec=sumo...oesy, no=261, id=215, vol=3.663550e+00
assign (segid  B  and resid   45 and name   HN) (segid  B  and resid   45 and name  HB2) 2.127 0.566 0.566 weight 1.000 ! spec=sumo...oesy, no=264, id=218, vol=1.072111e+01
    or (segid  B  and resid   45 and name   HN) (segid  B  and resid   45 and name  HB1)
    or (segid  B  and resid   45 and name   HN) (segid  B  and resid   45 and name  HB3)
assign (segid  B  and resid   45 and name   HN) (segid  B  and resid   42 and name   HA) 2.994 1.120 1.120 weight 1.000 ! spec=sumo...oesy, no=265, id=219, vol=1.380880e+00
assign (segid  B  and resid   27 and name   HA) (segid  B  and resid   28 and name HG12) 2.554 0.815 0.815 weight 1.000 ! spec=sumo...oesy, no=266, id=946, vol=2.277940e+00
    or (segid  B  and resid   27 and name   HA) (segid  B  and resid   28 and name HG11)
    or (segid  B  and resid   27 and name   HA) (segid  B  and resid   28 and name HG13)
assign (segid  B  and resid   42 and name   HN) (segid  B  and resid   42 and name  HB1) 2.498 0.780 0.780 weight 1.000 ! spec=sumo...oesy, no=267, id=221, vol=4.091110e+00
assign (segid  B  and resid   42 and name   HN) (segid  B  and resid   33 and name HD12) 2.924 1.069 1.069 weight 1.000 ! spec=sumo...oesy, no=268, id=222, vol=1.589380e+00
    or (segid  B  and resid   42 and name   HN) (segid  B  and resid   33 and name HD11)
    or (segid  B  and resid   42 and name   HN) (segid  B  and resid   33 and name HD13)
assign (segid  B  and resid   49 and name   HA) (segid  B  and resid   49 and name  HB2) 2.220 0.616 0.616 weight 1.000 ! spec=sumo...oesy, no=269, id=949, vol=5.271540e+00
assign (segid  B  and resid   42 and name   HN) (segid  B  and resid   43 and name   HN) 2.436 0.742 0.742 weight 1.000 ! spec=sumo...oesy, no=270, id=224, vol=4.761960e+00
assign (segid  B  and resid   42 and name   HN) (segid  B  and resid   41 and name   HN) 2.640 0.871 0.871 weight 1.000 ! spec=sumo...oesy, no=271, id=225, vol=2.936520e+00
assign (segid  B  and resid   74 and name   HA) (segid  B  and resid   74 and name  HB2) 2.052 0.526 0.526 weight 1.000 ! spec=sumo...oesy, no=273, id=953, vol=8.458270e+00
assign (segid  B  and resid   74 and name   HA) (segid  B  and resid   73 and name  HB2) 2.702 0.913 0.913 weight 1.000 ! spec=sumo...oesy, no=274, id=954, vol=1.622840e+00
    or (segid  B  and resid   74 and name   HA) (segid  B  and resid   73 and name  HB1)
    or (segid  B  and resid   74 and name   HA) (segid  B  and resid   73 and name  HB3)
assign (segid  B  and resid   42 and name   HN) (segid  B  and resid   41 and name  HB1) 2.832 1.002 1.002 weight 1.000 ! spec=sumo...oesy, no=275, id=228, vol=1.927750e+00
assign (segid  B  and resid   42 and name   HN) (segid  B  and resid   42 and name   HG) 3.125 1.221 1.221 weight 1.000 ! spec=sumo...oesy, no=276, id=229, vol=1.067180e+00
assign (segid  B  and resid   54 and name   HA) (segid  B  and resid   57 and name HD12) 2.691 0.905 0.905 weight 1.000 ! spec=sumo...oesy, no=278, id=956, vol=1.664080e+00
    or (segid  B  and resid   54 and name   HA) (segid  B  and resid   57 and name HD11)
    or (segid  B  and resid   54 and name   HA) (segid  B  and resid   57 and name HD13)
assign (segid  B  and resid   87 and name   HN) (segid  B  and resid   86 and name  HB1) 2.732 0.933 0.933 weight 1.000 ! spec=sumo...oesy, no=279, id=231, vol=2.391460e+00
assign (segid  B  and resid   87 and name   HN) (segid  B  and resid   87 and name  HB1) 2.682 0.899 0.899 weight 1.000 ! spec=sumo...oesy, no=282, id=234, vol=2.672440e+00
assign (segid  B  and resid   24 and name   HA) (segid  B  and resid   24 and name  HB1) 1.983 0.492 0.492 weight 1.000 ! spec=sumo...oesy, no=283, id=961, vol=1.038928e+01
assign (segid  B  and resid   45 and name   HN) (segid  B  and resid   46 and name   HN) 2.545 0.810 0.810 weight 1.000 ! spec=sumo...oesy, no=284, id=236, vol=3.654420e+00
assign (segid  B  and resid   74 and name   HA) (segid  B  and resid   75 and name HD22) 2.980 1.110 1.110 weight 1.000 ! spec=sumo...oesy, no=285, id=963, vol=9.017700e-01
    or (segid  B  and resid   74 and name   HA) (segid  B  and resid   75 and name HD21)
    or (segid  B  and resid   74 and name   HA) (segid  B  and resid   75 and name HD23)
assign (segid  B  and resid   45 and name   HN) (segid  B  and resid   44 and name  HB1) 2.412 0.727 0.727 weight 1.000 ! spec=sumo...oesy, no=286, id=237, vol=5.049660e+00
assign (segid  B  and resid   45 and name   HN) (segid  B  and resid   44 and name   HN) 2.498 0.780 0.780 weight 1.000 ! spec=sumo...oesy, no=287, id=238, vol=4.089620e+00
assign (segid  B  and resid   42 and name   HN) (segid  B  and resid   39 and name   HA) 3.034 1.150 1.150 weight 1.000 ! spec=sumo...oesy, no=288, id=239, vol=1.275550e+00
assign (segid  B  and resid   71 and name   HA) (segid  B  and resid   39 and name   HG) 2.565 0.823 0.823 weight 1.000 ! spec=sumo...oesy, no=289, id=967, vol=2.217540e+00
assign (segid  B  and resid   13 and name   HA) (segid  B  and resid   35 and name  HD1) 2.590 0.839 0.839 weight 1.000 ! spec=sumo...oesy, no=293, id=970, vol=2.090890e+00
assign (segid  B  and resid    7 and name   HA) (segid  B  and resid    7 and name  HD2) 2.161 0.584 0.584 weight 1.000 ! spec=sumo...oesy, no=295, id=972, vol=6.211150e+00
    or (segid  B  and resid    7 and name   HA) (segid  B  and resid    7 and name  HD1)
assign (segid  B  and resid   31 and name   HN) (segid  B  and resid   31 and name  HD1) 2.829 1.000 1.000 weight 1.000 ! spec=sumo...oesy, no=296, id=241, vol=1.938790e+00
    or (segid  B  and resid   31 and name   HN) (segid  B  and resid   31 and name  HD2)
assign (segid  B  and resid   31 and name   HN) (segid  B  and resid   31 and name  HB2) 2.897 1.049 1.049 weight 1.000 ! spec=sumo...oesy, no=297, id=242, vol=1.681470e+00
assign (segid  B  and resid   16 and name   HA) (segid  B  and resid   16 and name  HB1) 2.603 0.847 0.847 weight 1.000 ! spec=sumo...oesy, no=298, id=973, vol=2.029410e+00
assign (segid  B  and resid   16 and name   HA) (segid  B  and resid   16 and name  HB2) 2.563 0.821 0.821 weight 1.000 ! spec=sumo...oesy, no=299, id=974, vol=2.230460e+00
assign (segid  B  and resid   16 and name   HA) (segid  B  and resid   34 and name  HB1) 2.820 0.994 0.994 weight 1.000 ! spec=sumo...oesy, no=300, id=975, vol=1.255850e+00
assign (segid  B  and resid   16 and name   HA) (segid  B  and resid   34 and name  HG1) 2.778 0.965 0.965 weight 1.000 ! spec=sumo...oesy, no=301, id=976, vol=1.374970e+00
assign (segid  B  and resid   31 and name   HN) (segid  B  and resid   30 and name   HA) 2.129 0.566 0.566 weight 1.000 ! spec=sumo...oesy, no=303, id=247, vol=1.068555e+01
assign (segid  B  and resid   31 and name   HN) (segid  B  and resid   20 and name   HA) 2.957 1.093 1.093 weight 1.000 ! spec=sumo...oesy, no=304, id=248, vol=1.487940e+00
assign (segid  B  and resid   31 and name   HN) (segid  B  and resid   31 and name  HB1) 2.636 0.868 0.868 weight 1.000 ! spec=sumo...oesy, no=305, id=249, vol=2.965600e+00
assign (segid  B  and resid   79 and name   HA) (segid  B  and resid   17 and name   HB) 2.339 0.684 0.684 weight 1.000 ! spec=sumo...oesy, no=307, id=978, vol=3.861680e+00
assign (segid  B  and resid   79 and name   HA) (segid  B  and resid   17 and name HD12) 2.696 0.908 0.908 weight 1.000 ! spec=sumo...oesy, no=310, id=981, vol=1.645750e+00
    or (segid  B  and resid   79 and name   HA) (segid  B  and resid   17 and name HD11)
    or (segid  B  and resid   79 and name   HA) (segid  B  and resid   17 and name HD13)
assign (segid  B  and resid   58 and name   HN) (segid  B  and resid   57 and name   HA) 2.187 0.598 0.598 weight 1.000 ! spec=sumo...oesy, no=311, id=253, vol=9.075620e+00
assign (segid  B  and resid   34 and name   HA) (segid  B  and resid   34 and name  HB1) 2.432 0.740 0.740 weight 1.000 ! spec=sumo...oesy, no=314, id=985, vol=3.051290e+00
assign (segid  B  and resid   34 and name   HA) (segid  B  and resid   34 and name  HG2) 2.550 0.813 0.813 weight 1.000 ! spec=sumo...oesy, no=315, id=986, vol=2.299030e+00
assign (segid  B  and resid   34 and name   HA) (segid  B  and resid   34 and name  HG1) 2.418 0.731 0.731 weight 1.000 ! spec=sumo...oesy, no=316, id=987, vol=3.162020e+00
assign (segid  B  and resid   11 and name   HA) (segid  B  and resid   11 and name  HE2) 3.064 1.174 1.174 weight 1.000 ! spec=sumo...oesy, no=317, id=988, vol=7.631900e-01
    or (segid  B  and resid   11 and name   HA) (segid  B  and resid   11 and name  HE1)
assign (segid  B  and resid   90 and name   HN) (segid  B  and resid   89 and name   HA) 2.107 0.555 0.555 weight 1.000 ! spec=sumo...oesy, no=322, id=262, vol=1.135678e+01
assign (segid  B  and resid   90 and name   HN) (segid  B  and resid   90 and name   HA) 2.706 0.915 0.915 weight 1.000 ! spec=sumo...oesy, no=323, id=263, vol=2.533980e+00
assign (segid  B  and resid   77 and name   HA) (segid  B  and resid   81 and name  HB1) 2.965 1.099 1.099 weight 1.000 ! spec=sumo...oesy, no=324, id=995, vol=9.308200e-01
assign (segid  B  and resid   77 and name   HA) (segid  B  and resid   77 and name  HB2) 2.344 0.687 0.687 weight 1.000 ! spec=sumo...oesy, no=325, id=996, vol=3.812340e+00
assign (segid  B  and resid   59 and name  HD1) (segid  B  and resid   59 and name   HA) 2.506 0.785 0.785 weight 1.000 ! spec=sumo...oesy, no=326, id=997, vol=2.551480e+00
    or (segid  B  and resid   59 and name  HD2) (segid  B  and resid   59 and name   HA)
assign (segid  B  and resid   37 and name   HN) (segid  B  and resid   35 and name   HN) 3.358 1.409 1.409 weight 1.000 ! spec=sumo...oesy, no=327, id=265, vol=6.935000e-01
assign (segid  B  and resid   59 and name   HA) (segid  B  and resid   59 and name  HB2) 2.365 0.699 0.699 weight 1.000 ! spec=sumo...oesy, no=328, id=999, vol=3.613530e+00
assign (segid  B  and resid   59 and name   HA) (segid  B  and resid   85 and name HG12) 3.010 1.133 1.133 weight 1.000 ! spec=sumo...oesy, no=329, id=1000, vol=8.494200e-01
    or (segid  B  and resid   59 and name   HA) (segid  B  and resid   85 and name HG11)
    or (segid  B  and resid   59 and name   HA) (segid  B  and resid   85 and name HG13)
assign (segid  B  and resid   37 and name   HN) (segid  B  and resid   36 and name   HA) 3.093 1.196 1.196 weight 1.000 ! spec=sumo...oesy, no=330, id=267, vol=1.135400e+00
assign (segid  B  and resid   37 and name   HN) (segid  B  and resid   37 and name   HA) 2.775 0.962 0.962 weight 1.000 ! spec=sumo...oesy, no=331, id=268, vol=2.177550e+00
assign (segid  B  and resid   37 and name   HN) (segid  B  and resid   37 and name   HB) 2.344 0.687 0.687 weight 1.000 ! spec=sumo...oesy, no=332, id=269, vol=6.000820e+00
assign (segid  B  and resid   53 and name   HA) (segid  B  and resid   53 and name  HB1) 2.595 0.842 0.842 weight 1.000 ! spec=sumo...oesy, no=334, id=1005, vol=2.068630e+00
assign (segid  B  and resid   53 and name   HA) (segid  B  and resid   53 and name  HB2) 2.648 0.876 0.876 weight 1.000 ! spec=sumo...oesy, no=335, id=1006, vol=1.832700e+00
assign (segid  B  and resid   11 and name  HZ2) (segid  B  and resid   11 and name  HB1) 3.220 1.296 1.296 weight 1.000 ! spec=sumo...oesy, no=341, id=275, vol=8.917200e-01
    or (segid  B  and resid   11 and name  HZ1) (segid  B  and resid   11 and name  HB1)
    or (segid  B  and resid   11 and name  HZ3) (segid  B  and resid   11 and name  HB1)
assign (segid  B  and resid   11 and name   HA) (segid  B  and resid   11 and name  HD2) 2.350 0.690 0.690 weight 1.000 ! spec=sumo...oesy, no=342, id=1012, vol=3.750550e+00
    or (segid  B  and resid   11 and name   HA) (segid  B  and resid   11 and name  HD1)
assign (segid  B  and resid   11 and name   HA) (segid  B  and resid   11 and name  HG2) 2.299 0.660 0.660 weight 1.000 ! spec=sumo...oesy, no=343, id=1013, vol=4.283310e+00
assign (segid  B  and resid   32 and name   HA) (segid  B  and resid   32 and name  HG1) 2.438 0.743 0.743 weight 1.000 ! spec=sumo...oesy, no=345, id=1015, vol=3.007680e+00
assign (segid  B  and resid   11 and name  HZ2) (segid  B  and resid   11 and name   HN) 2.797 0.978 0.978 weight 1.000 ! spec=sumo...oesy, no=346, id=277, vol=2.074520e+00
    or (segid  B  and resid   11 and name  HZ1) (segid  B  and resid   11 and name   HN)
    or (segid  B  and resid   11 and name  HZ3) (segid  B  and resid   11 and name   HN)
assign (segid  B  and resid   61 and name  HD1) (segid  B  and resid   61 and name   HA) 2.138 0.571 0.571 weight 1.000 ! spec=sumo...oesy, no=348, id=1018, vol=6.615390e+00
    or (segid  B  and resid   61 and name  HD2) (segid  B  and resid   61 and name   HA)
assign (segid  B  and resid   61 and name   HA) (segid  B  and resid   61 and name  HB1) 2.326 0.676 0.676 weight 1.000 ! spec=sumo...oesy, no=349, id=1019, vol=3.988180e+00
assign (segid  B  and resid   61 and name   HA) (segid  B  and resid   61 and name  HB2) 2.404 0.722 0.722 weight 1.000 ! spec=sumo...oesy, no=350, id=1020, vol=3.275930e+00
assign (segid  B  and resid   37 and name   HN) (segid  B  and resid   71 and name   HB) 3.388 1.435 1.435 weight 1.000 ! spec=sumo...oesy, no=351, id=280, vol=6.570700e-01
assign (segid  B  and resid   81 and name   HA) (segid  B  and resid   81 and name  HB1) 2.530 0.800 0.800 weight 1.000 ! spec=sumo...oesy, no=352, id=1022, vol=2.407220e+00
assign (segid  B  and resid   81 and name   HA) (segid  B  and resid   81 and name  HB2) 2.447 0.749 0.749 weight 1.000 ! spec=sumo...oesy, no=353, id=1023, vol=2.941890e+00
assign (segid  B  and resid   24 and name   HN) (segid  B  and resid   23 and name  HA1) 2.795 0.977 0.977 weight 1.000 ! spec=sumo...oesy, no=355, id=284, vol=2.083890e+00
assign (segid  B  and resid   24 and name   HN) (segid  B  and resid   23 and name  HA2) 2.765 0.956 0.956 weight 1.000 ! spec=sumo...oesy, no=356, id=285, vol=2.223720e+00
assign (segid  B  and resid   24 and name   HN) (segid  B  and resid   24 and name  HB1) 3.014 1.136 1.136 weight 1.000 ! spec=sumo...oesy, no=357, id=286, vol=1.324930e+00
assign (segid  B  and resid   89 and name   HA) (segid  B  and resid   89 and name  HB2) 2.351 0.691 0.691 weight 1.000 ! spec=sumo...oesy, no=359, id=1029, vol=3.746520e+00
assign (segid  B  and resid   81 and name   HN) (segid  B  and resid   80 and name   HN) 2.566 0.823 0.823 weight 1.000 ! spec=sumo...oesy, no=360, id=288, vol=3.478960e+00
assign (segid  B  and resid   81 and name   HN) (segid  B  and resid   19 and name   HA) 3.301 1.362 1.362 weight 1.000 ! spec=sumo...oesy, no=363, id=290, vol=7.684000e-01
assign (segid  B  and resid   81 and name   HN) (segid  B  and resid   81 and name   HA) 2.602 0.846 0.846 weight 1.000 ! spec=sumo...oesy, no=364, id=291, vol=3.202970e+00
assign (segid  B  and resid   81 and name   HN) (segid  B  and resid   79 and name   HA) 2.890 1.044 1.044 weight 1.000 ! spec=sumo...oesy, no=365, id=292, vol=1.704490e+00
assign (segid  B  and resid   31 and name  HD1) (segid  B  and resid   30 and name   HA) 2.845 1.012 1.012 weight 1.000 ! spec=sumo...oesy, no=366, id=1036, vol=1.192100e+00
    or (segid  B  and resid   31 and name  HD2) (segid  B  and resid   30 and name   HA)
assign (segid  B  and resid   30 and name   HA) (segid  B  and resid   20 and name   HA) 2.102 0.552 0.552 weight 1.000 ! spec=sumo...oesy, no=367, id=1037, vol=7.321980e+00
assign (segid  B  and resid   81 and name   HN) (segid  B  and resid   19 and name HD22) 2.600 0.845 0.845 weight 1.000 ! spec=sumo...oesy, no=368, id=295, vol=3.218100e+00
    or (segid  B  and resid   81 and name   HN) (segid  B  and resid   19 and name HD21)
    or (segid  B  and resid   81 and name   HN) (segid  B  and resid   19 and name HD23)
assign (segid  B  and resid   30 and name   HA) (segid  B  and resid   30 and name  HB2) 2.275 0.647 0.647 weight 1.000 ! spec=sumo...oesy, no=369, id=1038, vol=4.554980e+00
assign (segid  B  and resid   20 and name   HA) (segid  B  and resid   20 and name  HB1) 2.549 0.812 0.812 weight 1.000 ! spec=sumo...oesy, no=371, id=1040, vol=2.305890e+00
assign (segid  B  and resid   20 and name   HA) (segid  B  and resid   20 and name  HB2) 2.321 0.673 0.673 weight 1.000 ! spec=sumo...oesy, no=372, id=1041, vol=4.046040e+00
assign (segid  B  and resid   20 and name   HA) (segid  B  and resid   20 and name  HG1) 2.308 0.666 0.666 weight 1.000 ! spec=sumo...oesy, no=373, id=1042, vol=4.176190e+00
assign (segid  B  and resid   20 and name   HA) (segid  B  and resid   30 and name  HG2) 2.740 0.939 0.939 weight 1.000 ! spec=sumo...oesy, no=374, id=1043, vol=1.492030e+00
assign (segid  B  and resid   20 and name   HA) (segid  B  and resid   28 and name HG22) 2.704 0.914 0.914 weight 1.000 ! spec=sumo...oesy, no=375, id=1044, vol=1.617930e+00
    or (segid  B  and resid   20 and name   HA) (segid  B  and resid   28 and name HG21)
    or (segid  B  and resid   20 and name   HA) (segid  B  and resid   28 and name HG23)
assign (segid  B  and resid   64 and name   HN) (segid  B  and resid   64 and name  HB1) 2.682 0.899 0.899 weight 1.000 ! spec=sumo...oesy, no=377, id=304, vol=2.670720e+00
assign (segid  B  and resid   36 and name   HA) (segid  B  and resid   36 and name  HB1) 2.329 0.678 0.678 weight 1.000 ! spec=sumo...oesy, no=378, id=1047, vol=3.960570e+00
assign (segid  B  and resid   11 and name  HZ2) (segid  B  and resid   11 and name  HB2) 3.212 1.289 1.289 weight 1.000 ! spec=sumo...oesy, no=379, id=306, vol=9.056200e-01
    or (segid  B  and resid   11 and name  HZ1) (segid  B  and resid   11 and name  HB2)
    or (segid  B  and resid   11 and name  HZ3) (segid  B  and resid   11 and name  HB2)
assign (segid  B  and resid   11 and name  HZ2) (segid  B  and resid    9 and name  HA2) 2.288 0.654 0.654 weight 1.000 ! spec=sumo...oesy, no=380, id=307, vol=6.933770e+00
    or (segid  B  and resid   11 and name  HZ1) (segid  B  and resid    9 and name  HA2)
    or (segid  B  and resid   11 and name  HZ3) (segid  B  and resid    9 and name  HA2)
assign (segid  B  and resid   70 and name   HA) (segid  B  and resid   70 and name  HB2) 2.339 0.684 0.684 weight 1.000 ! spec=sumo...oesy, no=381, id=1049, vol=3.860920e+00
assign (segid  B  and resid   70 and name   HA) (segid  B  and resid   70 and name  HB1) 2.190 0.599 0.599 weight 1.000 ! spec=sumo...oesy, no=382, id=1050, vol=5.734130e+00
assign (segid  B  and resid   87 and name   HA) (segid  B  and resid   58 and name  HG1) 2.552 0.814 0.814 weight 1.000 ! spec=sumo...oesy, no=384, id=1052, vol=2.289680e+00
assign (segid  B  and resid   11 and name  HZ2) (segid  B  and resid   15 and name  HB2) 3.404 1.449 1.449 weight 1.000 ! spec=sumo...oesy, no=385, id=312, vol=6.387100e-01
    or (segid  B  and resid   11 and name  HZ1) (segid  B  and resid   15 and name  HB2)
    or (segid  B  and resid   11 and name  HZ3) (segid  B  and resid   15 and name  HB2)
assign (segid  B  and resid   87 and name   HA) (segid  B  and resid   87 and name  HB1) 2.794 0.976 0.976 weight 1.000 ! spec=sumo...oesy, no=386, id=1054, vol=1.326960e+00
assign (segid  B  and resid   61 and name   HN) (segid  B  and resid   60 and name   HA) 2.280 0.650 0.650 weight 1.000 ! spec=sumo...oesy, no=387, id=314, vol=7.079320e+00
assign (segid  B  and resid    5 and name   HA) (segid  B  and resid   32 and name  HG1) 2.664 0.887 0.887 weight 1.000 ! spec=sumo...oesy, no=388, id=1056, vol=1.767740e+00
assign (segid  B  and resid   45 and name   HA) (segid  B  and resid   48 and name  HG1) 2.854 1.018 1.018 weight 1.000 ! spec=sumo...oesy, no=390, id=1058, vol=1.170000e+00
assign (segid  B  and resid   45 and name   HA) (segid  B  and resid   45 and name  HB2) 1.809 0.409 0.409 weight 1.000 ! spec=sumo...oesy, no=392, id=1060, vol=1.800920e+01
    or (segid  B  and resid   45 and name   HA) (segid  B  and resid   45 and name  HB1)
    or (segid  B  and resid   45 and name   HA) (segid  B  and resid   45 and name  HB3)
assign (segid  B  and resid   24 and name   HN) (segid  B  and resid   24 and name  HG1) 2.731 0.932 0.932 weight 1.000 ! spec=sumo...oesy, no=393, id=319, vol=2.395250e+00
assign (segid  B  and resid   60 and name   HA) (segid  B  and resid   60 and name  HB1) 2.360 0.696 0.696 weight 1.000 ! spec=sumo...oesy, no=394, id=1062, vol=3.658640e+00
assign (segid  B  and resid   60 and name   HA) (segid  B  and resid   60 and name  HB2) 2.302 0.663 0.663 weight 1.000 ! spec=sumo...oesy, no=395, id=1063, vol=4.240780e+00
assign (segid  B  and resid   61 and name   HN) (segid  B  and resid   61 and name  HD1) 3.304 1.365 1.365 weight 1.000 ! spec=sumo...oesy, no=397, id=322, vol=7.639000e-01
    or (segid  B  and resid   61 and name   HN) (segid  B  and resid   61 and name  HD2)
assign (segid  B  and resid   60 and name   HA) (segid  B  and resid   66 and name HD12) 2.877 1.035 1.035 weight 1.000 ! spec=sumo...oesy, no=398, id=1066, vol=1.113450e+00
    or (segid  B  and resid   60 and name   HA) (segid  B  and resid   66 and name HD11)
    or (segid  B  and resid   60 and name   HA) (segid  B  and resid   66 and name HD13)
assign (segid  B  and resid   61 and name   HN) (segid  B  and resid   66 and name HG22) 2.841 1.009 1.009 weight 1.000 ! spec=sumo...oesy, no=399, id=324, vol=1.889650e+00
    or (segid  B  and resid   61 and name   HN) (segid  B  and resid   66 and name HG21)
    or (segid  B  and resid   61 and name   HN) (segid  B  and resid   66 and name HG23)
assign (segid  B  and resid   61 and name   HN) (segid  B  and resid   66 and name HD12) 3.099 1.200 1.200 weight 1.000 ! spec=sumo...oesy, no=400, id=325, vol=1.123100e+00
    or (segid  B  and resid   61 and name   HN) (segid  B  and resid   66 and name HD11)
    or (segid  B  and resid   61 and name   HN) (segid  B  and resid   66 and name HD13)
assign (segid  B  and resid   75 and name   HA) (segid  B  and resid   75 and name  HB1) 2.112 0.557 0.557 weight 1.000 ! spec=sumo...oesy, no=403, id=1071, vol=7.126050e+00
assign (segid  B  and resid   75 and name   HA) (segid  B  and resid   75 and name  HB2) 2.463 0.758 0.758 weight 1.000 ! spec=sumo...oesy, no=404, id=1072, vol=2.833390e+00
assign (segid  B  and resid   20 and name   HN) (segid  B  and resid   20 and name  HB1) 2.714 0.921 0.921 weight 1.000 ! spec=sumo...oesy, no=405, id=329, vol=2.488570e+00
assign (segid  B  and resid   75 and name   HA) (segid  B  and resid   75 and name HD12) 2.895 1.048 1.048 weight 1.000 ! spec=sumo...oesy, no=406, id=1074, vol=1.073060e+00
    or (segid  B  and resid   75 and name   HA) (segid  B  and resid   75 and name HD11)
    or (segid  B  and resid   75 and name   HA) (segid  B  and resid   75 and name HD13)
assign (segid  B  and resid   50 and name   HA) (segid  B  and resid   50 and name  HB1) 2.124 0.564 0.564 weight 1.000 ! spec=sumo...oesy, no=407, id=1075, vol=6.883250e+00
assign (segid  B  and resid   20 and name   HN) (segid  B  and resid   19 and name HD22) 2.776 0.963 0.963 weight 1.000 ! spec=sumo...oesy, no=408, id=332, vol=2.172810e+00
    or (segid  B  and resid   20 and name   HN) (segid  B  and resid   19 and name HD21)
    or (segid  B  and resid   20 and name   HN) (segid  B  and resid   19 and name HD23)
assign (segid  B  and resid   50 and name   HA) (segid  B  and resid   50 and name  HB2) 2.205 0.608 0.608 weight 1.000 ! spec=sumo...oesy, no=409, id=1077, vol=5.495400e+00
assign (segid  B  and resid   73 and name   HA) (segid  B  and resid   73 and name  HB2) 1.859 0.432 0.432 weight 1.000 ! spec=sumo...oesy, no=413, id=1080, vol=1.528831e+01
    or (segid  B  and resid   73 and name   HA) (segid  B  and resid   73 and name  HB1)
    or (segid  B  and resid   73 and name   HA) (segid  B  and resid   73 and name  HB3)
assign (segid  B  and resid   62 and name   HA) (segid  B  and resid   62 and name  HB1) 2.106 0.554 0.554 weight 1.000 ! spec=sumo...oesy, no=414, id=1081, vol=7.245730e+00
assign (segid  B  and resid   59 and name   HN) (segid  B  and resid   59 and name  HB1) 2.668 0.890 0.890 weight 1.000 ! spec=sumo...oesy, no=415, id=336, vol=2.758400e+00
assign (segid  B  and resid   59 and name   HN) (segid  B  and resid   58 and name   HN) 3.393 1.439 1.439 weight 1.000 ! spec=sumo...oesy, no=416, id=337, vol=6.514900e-01
assign (segid  B  and resid   84 and name   HA) (segid  B  and resid   22 and name  HB2) 2.220 0.616 0.616 weight 1.000 ! spec=sumo...oesy, no=417, id=1084, vol=5.278720e+00
    or (segid  B  and resid   84 and name   HA) (segid  B  and resid   22 and name  HB1)
    or (segid  B  and resid   84 and name   HA) (segid  B  and resid   22 and name  HB3)
assign (segid  B  and resid   84 and name   HA) (segid  B  and resid   82 and name HG21) 2.648 0.876 0.876 weight 1.000 ! spec=sumo...oesy, no=418, id=1085, vol=1.834350e+00
    or (segid  B  and resid   84 and name   HA) (segid  B  and resid   82 and name HG22)
    or (segid  B  and resid   84 and name   HA) (segid  B  and resid   82 and name HG23)
assign (segid  B  and resid   84 and name   HA) (segid  B  and resid   21 and name HG12) 2.989 1.117 1.117 weight 1.000 ! spec=sumo...oesy, no=419, id=1086, vol=8.859100e-01
    or (segid  B  and resid   84 and name   HA) (segid  B  and resid   21 and name HG11)
    or (segid  B  and resid   84 and name   HA) (segid  B  and resid   21 and name HG13)
assign (segid  B  and resid    5 and name   HA) (segid  B  and resid    6 and name  HD1) 2.111 0.557 0.557 weight 1.000 ! spec=sumo...oesy, no=422, id=1089, vol=7.129940e+00
assign (segid  B  and resid    5 and name   HA) (segid  B  and resid    6 and name  HD2) 2.210 0.610 0.610 weight 1.000 ! spec=sumo...oesy, no=423, id=1090, vol=5.425790e+00
assign (segid  B  and resid   68 and name   HN) (segid  B  and resid   67 and name  HB2) 2.992 1.119 1.119 weight 1.000 ! spec=sumo...oesy, no=424, id=344, vol=1.386240e+00
assign (segid  B  and resid   59 and name   HN) (segid  B  and resid   59 and name  HD1) 2.643 0.873 0.873 weight 1.000 ! spec=sumo...oesy, no=426, id=346, vol=2.914010e+00
    or (segid  B  and resid   59 and name   HN) (segid  B  and resid   59 and name  HD2)
assign (segid  B  and resid   84 and name   HA) (segid  B  and resid   83 and name HG22) 3.040 1.155 1.155 weight 1.000 ! spec=sumo...oesy, no=427, id=1094, vol=8.006500e-01
    or (segid  B  and resid   84 and name   HA) (segid  B  and resid   83 and name HG21)
    or (segid  B  and resid   84 and name   HA) (segid  B  and resid   83 and name HG23)
assign (segid  B  and resid   59 and name   HN) (segid  B  and resid   58 and name  HD1) 3.394 1.440 1.440 weight 1.000 ! spec=sumo...oesy, no=428, id=348, vol=6.500300e-01
assign (segid  B  and resid   59 and name   HN) (segid  B  and resid   59 and name  HB2) 2.925 1.069 1.069 weight 1.000 ! spec=sumo...oesy, no=429, id=349, vol=1.587690e+00
assign (segid  B  and resid   59 and name   HN) (segid  B  and resid   58 and name  HB1) 2.735 0.935 0.935 weight 1.000 ! spec=sumo...oesy, no=430, id=350, vol=2.374300e+00
assign (segid  B  and resid   59 and name   HN) (segid  B  and resid   43 and name  HE2) 2.895 1.048 1.048 weight 1.000 ! spec=sumo...oesy, no=431, id=351, vol=1.687860e+00
    or (segid  B  and resid   59 and name   HN) (segid  B  and resid   43 and name  HE1)
    or (segid  B  and resid   59 and name   HN) (segid  B  and resid   43 and name  HE3)
assign (segid  B  and resid   59 and name   HN) (segid  B  and resid   58 and name  HB2) 2.972 1.104 1.104 weight 1.000 ! spec=sumo...oesy, no=432, id=352, vol=1.442000e+00
assign (segid  B  and resid   58 and name   HA) (segid  B  and resid   58 and name  HD1) 2.539 0.806 0.806 weight 1.000 ! spec=sumo...oesy, no=434, id=1096, vol=2.360730e+00
assign (segid  B  and resid   14 and name   HN) (segid  B  and resid   14 and name  HB1) 3.217 1.294 1.294 weight 1.000 ! spec=sumo...oesy, no=435, id=354, vol=8.968000e-01
assign (segid  B  and resid   14 and name   HN) (segid  B  and resid   14 and name  HB2) 3.079 1.185 1.185 weight 1.000 ! spec=sumo...oesy, no=436, id=355, vol=1.166630e+00
assign (segid  B  and resid   59 and name  HD1) (segid  B  and resid   58 and name   HA) 2.655 0.881 0.881 weight 1.000 ! spec=sumo...oesy, no=437, id=1099, vol=1.803710e+00
    or (segid  B  and resid   59 and name  HD2) (segid  B  and resid   58 and name   HA)
assign (segid  B  and resid   78 and name   HA) (segid  B  and resid   78 and name  HB2) 2.349 0.690 0.690 weight 1.000 ! spec=sumo...oesy, no=438, id=1100, vol=3.758630e+00
assign (segid  B  and resid   74 and name   HN) (segid  B  and resid   74 and name  HB1) 2.487 0.773 0.773 weight 1.000 ! spec=sumo...oesy, no=439, id=357, vol=4.199080e+00
assign (segid  B  and resid   78 and name   HA) (segid  B  and resid   78 and name  HG1) 2.565 0.823 0.823 weight 1.000 ! spec=sumo...oesy, no=440, id=1101, vol=2.216030e+00
assign (segid  B  and resid   78 and name   HA) (segid  B  and resid   78 and name  HG2) 2.331 0.679 0.679 weight 1.000 ! spec=sumo...oesy, no=441, id=1102, vol=3.933580e+00
assign (segid  B  and resid   78 and name   HA) (segid  B  and resid   78 and name  HB1) 2.187 0.598 0.598 weight 1.000 ! spec=sumo...oesy, no=442, id=1103, vol=5.781640e+00
assign (segid  B  and resid   78 and name   HA) (segid  B  and resid   17 and name HG22) 2.770 0.959 0.959 weight 1.000 ! spec=sumo...oesy, no=443, id=1104, vol=1.399040e+00
    or (segid  B  and resid   78 and name   HA) (segid  B  and resid   17 and name HG21)
    or (segid  B  and resid   78 and name   HA) (segid  B  and resid   17 and name HG23)
assign (segid  B  and resid   19 and name   HA) (segid  B  and resid   19 and name  HB2) 2.303 0.663 0.663 weight 1.000 ! spec=sumo...oesy, no=447, id=1108, vol=4.239820e+00
assign (segid  B  and resid   46 and name   HN) (segid  B  and resid   46 and name   HA) 2.713 0.920 0.920 weight 1.000 ! spec=sumo...oesy, no=448, id=365, vol=2.492400e+00
assign (segid  B  and resid   46 and name   HN) (segid  B  and resid   46 and name  HB1) 2.505 0.784 0.784 weight 1.000 ! spec=sumo...oesy, no=449, id=366, vol=4.021460e+00
assign (segid  B  and resid   19 and name   HA) (segid  B  and resid   80 and name   HA) 2.967 1.100 1.100 weight 1.000 ! spec=sumo...oesy, no=450, id=1111, vol=9.265300e-01
assign (segid  B  and resid   46 and name   HN) (segid  B  and resid   45 and name  HB2) 2.448 0.749 0.749 weight 1.000 ! spec=sumo...oesy, no=451, id=368, vol=4.616190e+00
    or (segid  B  and resid   46 and name   HN) (segid  B  and resid   45 and name  HB1)
    or (segid  B  and resid   46 and name   HN) (segid  B  and resid   45 and name  HB3)
assign (segid  B  and resid   14 and name   HA) (segid  B  and resid   14 and name  HB1) 2.186 0.597 0.597 weight 1.000 ! spec=sumo...oesy, no=452, id=1113, vol=5.792220e+00
assign (segid  B  and resid   14 and name   HA) (segid  B  and resid   14 and name  HB2) 2.128 0.566 0.566 weight 1.000 ! spec=sumo...oesy, no=453, id=1114, vol=6.813430e+00
assign (segid  B  and resid   14 and name   HA) (segid  B  and resid   34 and name  HD1) 2.860 1.023 1.023 weight 1.000 ! spec=sumo...oesy, no=454, id=1115, vol=1.153960e+00
assign (segid  B  and resid   74 and name   HN) (segid  B  and resid   75 and name   HN) 2.443 0.746 0.746 weight 1.000 ! spec=sumo...oesy, no=455, id=370, vol=4.672140e+00
assign (segid  B  and resid   25 and name   HA) (segid  B  and resid   25 and name  HB2) 2.026 0.513 0.513 weight 1.000 ! spec=sumo...oesy, no=460, id=1118, vol=9.134490e+00
assign (segid  B  and resid   18 and name   HA) (segid  B  and resid   18 and name  HB1) 2.349 0.690 0.690 weight 1.000 ! spec=sumo...oesy, no=461, id=1119, vol=3.757750e+00
assign (segid  B  and resid   18 and name   HA) (segid  B  and resid   18 and name  HB2) 2.265 0.641 0.641 weight 1.000 ! spec=sumo...oesy, no=462, id=1120, vol=4.677910e+00
assign (segid  B  and resid   41 and name   HN) (segid  B  and resid   39 and name   HA) 3.312 1.371 1.371 weight 1.000 ! spec=sumo...oesy, no=464, id=378, vol=7.533600e-01
assign (segid  B  and resid   64 and name   HA) (segid  B  and resid   65 and name  HD1) 2.208 0.609 0.609 weight 1.000 ! spec=sumo...oesy, no=465, id=1123, vol=5.453880e+00
assign (segid  B  and resid   64 and name   HA) (segid  B  and resid   64 and name  HG2) 2.539 0.806 0.806 weight 1.000 ! spec=sumo...oesy, no=466, id=1124, vol=2.357650e+00
assign (segid  B  and resid   64 and name   HA) (segid  B  and resid   64 and name  HB1) 2.244 0.629 0.629 weight 1.000 ! spec=sumo...oesy, no=467, id=1125, vol=4.954450e+00
assign (segid  B  and resid   64 and name   HA) (segid  B  and resid   64 and name  HB2) 2.427 0.736 0.736 weight 1.000 ! spec=sumo...oesy, no=468, id=1126, vol=3.094120e+00
assign (segid  B  and resid   49 and name   HN) (segid  B  and resid   49 and name  HB1) 2.336 0.682 0.682 weight 1.000 ! spec=sumo...oesy, no=469, id=382, vol=6.112630e+00
assign (segid  B  and resid   49 and name   HN) (segid  B  and resid   49 and name  HG1) 2.664 0.887 0.887 weight 1.000 ! spec=sumo...oesy, no=470, id=383, vol=2.780900e+00
assign (segid  B  and resid   66 and name   HN) (segid  B  and resid   65 and name  HB2) 2.883 1.039 1.039 weight 1.000 ! spec=sumo...oesy, no=472, id=385, vol=1.731930e+00
assign (segid  B  and resid   66 and name   HN) (segid  B  and resid   60 and name  HG2) 3.361 1.412 1.412 weight 1.000 ! spec=sumo...oesy, no=473, id=386, vol=6.898700e-01
assign (segid  B  and resid   66 and name   HN) (segid  B  and resid   67 and name   HN) 3.264 1.331 1.331 weight 1.000 ! spec=sumo...oesy, no=474, id=387, vol=8.225100e-01
assign (segid  B  and resid   66 and name   HN) (segid  B  and resid   66 and name   HA) 2.793 0.975 0.975 weight 1.000 ! spec=sumo...oesy, no=476, id=388, vol=2.092240e+00
assign (segid  B  and resid   66 and name   HN) (segid  B  and resid   65 and name  HB1) 2.937 1.078 1.078 weight 1.000 ! spec=sumo...oesy, no=477, id=389, vol=1.548460e+00
assign (segid  B  and resid   18 and name   HA) (segid  B  and resid   32 and name  HG1) 2.847 1.013 1.013 weight 1.000 ! spec=sumo...oesy, no=478, id=1130, vol=1.185440e+00
assign (segid  B  and resid   66 and name   HN) (segid  B  and resid   66 and name HG22) 2.597 0.843 0.843 weight 1.000 ! spec=sumo...oesy, no=479, id=391, vol=3.237690e+00
    or (segid  B  and resid   66 and name   HN) (segid  B  and resid   66 and name HG21)
    or (segid  B  and resid   66 and name   HN) (segid  B  and resid   66 and name HG23)
assign (segid  B  and resid   67 and name   HA) (segid  B  and resid   67 and name  HB1) 2.080 0.541 0.541 weight 1.000 ! spec=sumo...oesy, no=480, id=1132, vol=7.799990e+00
assign (segid  B  and resid   67 and name   HA) (segid  B  and resid   43 and name  HE2) 2.670 0.891 0.891 weight 1.000 ! spec=sumo...oesy, no=482, id=1134, vol=1.745060e+00
    or (segid  B  and resid   67 and name   HA) (segid  B  and resid   43 and name  HE1)
    or (segid  B  and resid   67 and name   HA) (segid  B  and resid   43 and name  HE3)
assign (segid  B  and resid   66 and name   HN) (segid  B  and resid   66 and name HG11) 2.766 0.956 0.956 weight 1.000 ! spec=sumo...oesy, no=483, id=395, vol=2.219900e+00
assign (segid  B  and resid   41 and name   HN) (segid  B  and resid   41 and name   HA) 2.414 0.729 0.729 weight 1.000 ! spec=sumo...oesy, no=485, id=396, vol=5.018890e+00
assign (segid  B  and resid   41 and name   HN) (segid  B  and resid   38 and name  HB2) 3.257 1.326 1.326 weight 1.000 ! spec=sumo...oesy, no=486, id=397, vol=8.329800e-01
assign (segid  B  and resid   41 and name   HN) (segid  B  and resid   41 and name  HB1) 2.427 0.736 0.736 weight 1.000 ! spec=sumo...oesy, no=487, id=398, vol=4.862440e+00
assign (segid  B  and resid   41 and name   HN) (segid  B  and resid   41 and name  HD2) 2.577 0.830 0.830 weight 1.000 ! spec=sumo...oesy, no=488, id=399, vol=3.397500e+00
assign (segid  B  and resid   72 and name  HD2) (segid  B  and resid   72 and name  HD1) 2.301 0.662 0.662 weight 1.000 ! spec=sumo...oesy, no=491, id=1137, vol=4.252450e+00
assign (segid  B  and resid   43 and name   HN) (segid  B  and resid   43 and name   HA) 2.969 1.102 1.102 weight 1.000 ! spec=sumo...oesy, no=494, id=402, vol=1.451310e+00
assign (segid  B  and resid   22 and name   HA) (segid  B  and resid   28 and name HG22) 2.600 0.845 0.845 weight 1.000 ! spec=sumo...oesy, no=495, id=1141, vol=2.045400e+00
    or (segid  B  and resid   22 and name   HA) (segid  B  and resid   28 and name HG21)
    or (segid  B  and resid   22 and name   HA) (segid  B  and resid   28 and name HG23)
assign (segid  B  and resid   43 and name   HN) (segid  B  and resid   42 and name HD22) 2.996 1.122 1.122 weight 1.000 ! spec=sumo...oesy, no=496, id=404, vol=1.374090e+00
    or (segid  B  and resid   43 and name   HN) (segid  B  and resid   42 and name HD21)
    or (segid  B  and resid   43 and name   HN) (segid  B  and resid   42 and name HD23)
assign (segid  B  and resid   52 and name   HN) (segid  B  and resid   51 and name  HA2) 2.594 0.841 0.841 weight 1.000 ! spec=sumo...oesy, no=499, id=406, vol=3.264810e+00
assign (segid  B  and resid   52 and name   HN) (segid  B  and resid   52 and name   HG) 2.398 0.719 0.719 weight 1.000 ! spec=sumo...oesy, no=500, id=407, vol=5.223600e+00
assign (segid  B  and resid   43 and name   HN) (segid  B  and resid   42 and name  HB1) 2.905 1.055 1.055 weight 1.000 ! spec=sumo...oesy, no=505, id=410, vol=1.655200e+00
assign (segid  B  and resid   36 and name   HA) (segid  B  and resid   36 and name  HD2) 2.758 0.951 0.951 weight 1.000 ! spec=sumo...oesy, no=506, id=1143, vol=1.436100e+00
assign (segid  B  and resid   36 and name  HD2) (segid  B  and resid   36 and name  HB2) 2.881 1.038 1.038 weight 1.000 ! spec=sumo...oesy, no=507, id=1144, vol=1.104890e+00
assign (segid  B  and resid   52 and name   HN) (segid  B  and resid   53 and name   HN) 3.350 1.402 1.402 weight 1.000 ! spec=sumo...oesy, no=508, id=413, vol=7.038400e-01
assign (segid  B  and resid   52 and name   HN) (segid  B  and resid   47 and name   HA) 2.830 1.001 1.001 weight 1.000 ! spec=sumo...oesy, no=509, id=414, vol=1.935980e+00
assign (segid  B  and resid   10 and name   HN) (segid  B  and resid    8 and name   HA) 3.410 1.453 1.453 weight 1.000 ! spec=sumo...oesy, no=511, id=416, vol=6.324000e-01
assign (segid  B  and resid   10 and name   HN) (segid  B  and resid   10 and name   HA) 2.562 0.821 0.821 weight 1.000 ! spec=sumo...oesy, no=513, id=417, vol=3.512500e+00
assign (segid  B  and resid   10 and name   HN) (segid  B  and resid    9 and name  HA2) 2.081 0.541 0.541 weight 1.000 ! spec=sumo...oesy, no=514, id=418, vol=1.222975e+01
assign (segid  B  and resid   10 and name   HN) (segid  B  and resid   10 and name   HB) 2.336 0.682 0.682 weight 1.000 ! spec=sumo...oesy, no=515, id=419, vol=6.122060e+00
assign (segid  B  and resid   49 and name   HN) (segid  B  and resid   48 and name   HN) 2.522 0.795 0.795 weight 1.000 ! spec=sumo...oesy, no=518, id=422, vol=3.865890e+00
assign (segid  B  and resid   48 and name   HN) (segid  B  and resid   47 and name   HA) 3.198 1.278 1.278 weight 1.000 ! spec=sumo...oesy, no=519, id=423, vol=9.293900e-01
assign (segid  B  and resid   48 and name   HN) (segid  B  and resid   47 and name  HB2) 2.693 0.906 0.906 weight 1.000 ! spec=sumo...oesy, no=520, id=424, vol=2.608020e+00
assign (segid  B  and resid   48 and name   HN) (segid  B  and resid   48 and name  HB2) 2.313 0.669 0.669 weight 1.000 ! spec=sumo...oesy, no=522, id=426, vol=6.494990e+00
assign (segid  B  and resid   63 and name  HA1) (segid  B  and resid   63 and name  HA2) 1.976 0.488 0.488 weight 1.000 ! spec=sumo...oesy, no=524, id=1146, vol=1.062245e+01
assign (segid  B  and resid   48 and name   HN) (segid  B  and resid   48 and name   HA) 2.444 0.747 0.747 weight 1.000 ! spec=sumo...oesy, no=525, id=428, vol=4.660800e+00
assign (segid  B  and resid   48 and name   HN) (segid  B  and resid   48 and name  HG1) 2.640 0.871 0.871 weight 1.000 ! spec=sumo...oesy, no=526, id=429, vol=2.937340e+00
assign (segid  B  and resid   48 and name   HN) (segid  B  and resid   46 and name   HN) 3.380 1.428 1.428 weight 1.000 ! spec=sumo...oesy, no=528, id=431, vol=6.669200e-01
assign (segid  B  and resid   44 and name   HN) (segid  B  and resid   54 and name  HG2) 3.324 1.381 1.381 weight 1.000 ! spec=sumo...oesy, no=533, id=436, vol=7.366600e-01
assign (segid  B  and resid   85 and name   HN) (segid  B  and resid   22 and name   HN) 3.223 1.299 1.299 weight 1.000 ! spec=sumo...oesy, no=537, id=440, vol=8.867000e-01
assign (segid  B  and resid   85 and name   HN) (segid  B  and resid   84 and name   HA) 2.088 0.545 0.545 weight 1.000 ! spec=sumo...oesy, no=539, id=442, vol=1.200857e+01
assign (segid  B  and resid   85 and name   HN) (segid  B  and resid   23 and name  HA1) 3.208 1.286 1.286 weight 1.000 ! spec=sumo...oesy, no=540, id=443, vol=9.124600e-01
assign (segid  B  and resid   85 and name   HN) (segid  B  and resid   85 and name   HB) 2.555 0.816 0.816 weight 1.000 ! spec=sumo...oesy, no=542, id=445, vol=3.570540e+00
assign (segid  B  and resid   85 and name   HN) (segid  B  and resid   85 and name HG12) 2.833 1.003 1.003 weight 1.000 ! spec=sumo...oesy, no=543, id=446, vol=1.921910e+00
    or (segid  B  and resid   85 and name   HN) (segid  B  and resid   85 and name HG11)
    or (segid  B  and resid   85 and name   HN) (segid  B  and resid   85 and name HG13)
assign (segid  B  and resid   85 and name   HN) (segid  B  and resid   85 and name HG22) 2.587 0.837 0.837 weight 1.000 ! spec=sumo...oesy, no=544, id=447, vol=3.316200e+00
    or (segid  B  and resid   85 and name   HN) (segid  B  and resid   85 and name HG21)
    or (segid  B  and resid   85 and name   HN) (segid  B  and resid   85 and name HG23)
assign (segid  B  and resid   79 and name   HN) (segid  B  and resid   79 and name  HB2) 2.084 0.543 0.543 weight 1.000 ! spec=sumo...oesy, no=548, id=451, vol=1.211750e+01
assign (segid  B  and resid   79 and name   HN) (segid  B  and resid   78 and name  HG1) 3.133 1.227 1.227 weight 1.000 ! spec=sumo...oesy, no=549, id=452, vol=1.050540e+00
assign (segid  B  and resid   79 and name   HN) (segid  B  and resid   78 and name  HG2) 3.131 1.226 1.226 weight 1.000 ! spec=sumo...oesy, no=550, id=453, vol=1.054550e+00
assign (segid  B  and resid   79 and name   HN) (segid  B  and resid   78 and name  HB1) 2.451 0.751 0.751 weight 1.000 ! spec=sumo...oesy, no=551, id=454, vol=4.589400e+00
assign (segid  B  and resid   79 and name   HN) (segid  B  and resid   78 and name  HB2) 2.700 0.911 0.911 weight 1.000 ! spec=sumo...oesy, no=552, id=455, vol=2.566620e+00
assign (segid  B  and resid   79 and name   HN) (segid  B  and resid   17 and name HG22) 3.043 1.157 1.157 weight 1.000 ! spec=sumo...oesy, no=553, id=456, vol=1.252120e+00
    or (segid  B  and resid   79 and name   HN) (segid  B  and resid   17 and name HG21)
    or (segid  B  and resid   79 and name   HN) (segid  B  and resid   17 and name HG23)
assign (segid  B  and resid   79 and name   HN) (segid  B  and resid   17 and name HD12) 3.257 1.326 1.326 weight 1.000 ! spec=sumo...oesy, no=554, id=457, vol=8.333500e-01
    or (segid  B  and resid   79 and name   HN) (segid  B  and resid   17 and name HD11)
    or (segid  B  and resid   79 and name   HN) (segid  B  and resid   17 and name HD13)
assign (segid  B  and resid   79 and name   HN) (segid  B  and resid   17 and name   HB) 3.411 1.454 1.454 weight 1.000 ! spec=sumo...oesy, no=555, id=458, vol=6.315400e-01
assign (segid  B  and resid   62 and name  HB1) (segid  B  and resid   62 and name  HB2) 1.792 0.402 0.402 weight 1.000 ! spec=sumo...oesy, no=556, id=1152, vol=1.904785e+01
assign (segid  B  and resid   14 and name  HB1) (segid  B  and resid   14 and name  HB2) 1.833 0.420 0.420 weight 1.000 ! spec=sumo...oesy, no=558, id=1154, vol=1.664478e+01
assign (segid  B  and resid   35 and name   HN) (segid  B  and resid   35 and name   HA) 2.806 0.984 0.984 weight 1.000 ! spec=sumo...oesy, no=559, id=462, vol=2.035480e+00
assign (segid  B  and resid   35 and name   HN) (segid  B  and resid   34 and name  HG1) 3.241 1.313 1.313 weight 1.000 ! spec=sumo...oesy, no=562, id=465, vol=8.578100e-01
assign (segid  B  and resid   59 and name   HZ) (segid  B  and resid   46 and name  HB1) 2.896 1.048 1.048 weight 1.000 ! spec=sumo...oesy, no=563, id=1157, vol=1.071960e+00
assign (segid  B  and resid   46 and name  HB2) (segid  B  and resid   59 and name   HZ) 2.780 0.966 0.966 weight 1.000 ! spec=sumo...oesy, no=567, id=1161, vol=1.369670e+00
assign (segid  B  and resid   46 and name  HD1) (segid  B  and resid   46 and name  HB2) 2.345 0.688 0.688 weight 1.000 ! spec=sumo...oesy, no=568, id=1162, vol=3.797340e+00
    or (segid  B  and resid   46 and name  HD2) (segid  B  and resid   46 and name  HB2)
assign (segid  B  and resid   17 and name   HN) (segid  B  and resid   16 and name   HA) 2.352 0.691 0.691 weight 1.000 ! spec=sumo...oesy, no=569, id=469, vol=5.875560e+00
assign (segid  B  and resid   46 and name  HB1) (segid  B  and resid   46 and name  HB2) 2.190 0.600 0.600 weight 1.000 ! spec=sumo...oesy, no=570, id=1164, vol=5.724760e+00
assign (segid  B  and resid   17 and name   HN) (segid  B  and resid   16 and name  HB1) 2.994 1.121 1.121 weight 1.000 ! spec=sumo...oesy, no=571, id=471, vol=1.378850e+00
assign (segid  B  and resid   17 and name   HN) (segid  B  and resid   16 and name  HB2) 2.811 0.988 0.988 weight 1.000 ! spec=sumo...oesy, no=572, id=472, vol=2.012750e+00
assign (segid  B  and resid   17 and name   HN) (segid  B  and resid   17 and name HG12) 2.943 1.083 1.083 weight 1.000 ! spec=sumo...oesy, no=573, id=473, vol=1.529960e+00
assign (segid  B  and resid   17 and name   HN) (segid  B  and resid   17 and name HG11) 2.811 0.988 0.988 weight 1.000 ! spec=sumo...oesy, no=574, id=474, vol=2.015600e+00
assign (segid  B  and resid   17 and name   HN) (segid  B  and resid   17 and name HG22) 2.692 0.906 0.906 weight 1.000 ! spec=sumo...oesy, no=575, id=475, vol=2.610110e+00
    or (segid  B  and resid   17 and name   HN) (segid  B  and resid   17 and name HG21)
    or (segid  B  and resid   17 and name   HN) (segid  B  and resid   17 and name HG23)
assign (segid  B  and resid   17 and name   HN) (segid  B  and resid   17 and name HD12) 3.243 1.315 1.315 weight 1.000 ! spec=sumo...oesy, no=576, id=476, vol=8.541400e-01
    or (segid  B  and resid   17 and name   HN) (segid  B  and resid   17 and name HD11)
    or (segid  B  and resid   17 and name   HN) (segid  B  and resid   17 and name HD13)
assign (segid  B  and resid   48 and name   HA) (segid  B  and resid   48 and name  HG1) 2.480 0.769 0.769 weight 1.000 ! spec=sumo...oesy, no=577, id=1166, vol=2.718320e+00
assign (segid  B  and resid   56 and name  HG2) (segid  B  and resid   56 and name   HA) 2.253 0.635 0.635 weight 1.000 ! spec=sumo...oesy, no=579, id=1167, vol=4.827030e+00
assign (segid  B  and resid   16 and name   HN) (segid  B  and resid   16 and name  HB1) 2.640 0.871 0.871 weight 1.000 ! spec=sumo...oesy, no=580, id=479, vol=2.933860e+00
assign (segid  B  and resid   47 and name   HN) (segid  B  and resid   57 and name HD12) 3.387 1.434 1.434 weight 1.000 ! spec=sumo...oesy, no=584, id=483, vol=6.586700e-01
    or (segid  B  and resid   47 and name   HN) (segid  B  and resid   57 and name HD11)
    or (segid  B  and resid   47 and name   HN) (segid  B  and resid   57 and name HD13)
assign (segid  B  and resid   46 and name   HN) (segid  B  and resid   47 and name   HN) 2.530 0.800 0.800 weight 1.000 ! spec=sumo...oesy, no=585, id=484, vol=3.791750e+00
assign (segid  B  and resid   47 and name   HN) (segid  B  and resid   46 and name   HA) 2.949 1.087 1.087 weight 1.000 ! spec=sumo...oesy, no=587, id=485, vol=1.511150e+00
assign (segid  B  and resid   47 and name   HN) (segid  B  and resid   47 and name   HA) 2.653 0.880 0.880 weight 1.000 ! spec=sumo...oesy, no=588, id=486, vol=2.850730e+00
assign (segid  B  and resid   47 and name   HN) (segid  B  and resid   46 and name  HB1) 2.609 0.851 0.851 weight 1.000 ! spec=sumo...oesy, no=589, id=487, vol=3.150820e+00
assign (segid  B  and resid   64 and name  HG1) (segid  B  and resid   64 and name   HA) 2.631 0.865 0.865 weight 1.000 ! spec=sumo...oesy, no=590, id=1174, vol=1.906070e+00
assign (segid  B  and resid   47 and name   HN) (segid  B  and resid   47 and name  HB2) 2.466 0.760 0.760 weight 1.000 ! spec=sumo...oesy, no=591, id=489, vol=4.424650e+00
assign (segid  B  and resid   54 and name   HA) (segid  B  and resid   54 and name  HB1) 2.373 0.704 0.704 weight 1.000 ! spec=sumo...oesy, no=592, id=1175, vol=3.540290e+00
assign (segid  B  and resid   44 and name   HA) (segid  B  and resid   54 and name  HB1) 2.853 1.017 1.017 weight 1.000 ! spec=sumo...oesy, no=594, id=1177, vol=1.171490e+00
assign (segid  B  and resid   25 and name   HN) (segid  B  and resid   25 and name   HA) 2.495 0.778 0.778 weight 1.000 ! spec=sumo...oesy, no=596, id=493, vol=4.124490e+00
assign (segid  B  and resid   64 and name  HG1) (segid  B  and resid   65 and name  HD1) 2.978 1.108 1.108 weight 1.000 ! spec=sumo...oesy, no=597, id=1180, vol=9.061600e-01
assign (segid  B  and resid   25 and name   HN) (segid  B  and resid   24 and name  HB1) 3.082 1.187 1.187 weight 1.000 ! spec=sumo...oesy, no=598, id=495, vol=1.160050e+00
assign (segid  B  and resid   25 and name   HN) (segid  B  and resid   24 and name  HB2) 2.948 1.087 1.087 weight 1.000 ! spec=sumo...oesy, no=599, id=496, vol=1.513070e+00
assign (segid  B  and resid   73 and name   HN) (segid  B  and resid   71 and name   HB) 2.948 1.086 1.086 weight 1.000 ! spec=sumo...oesy, no=600, id=497, vol=1.514840e+00
assign (segid  B  and resid   16 and name  HB1) (segid  B  and resid   32 and name  HG1) 3.101 1.202 1.202 weight 1.000 ! spec=sumo...oesy, no=601, id=1183, vol=7.100100e-01
assign (segid  B  and resid   75 and name   HN) (segid  B  and resid   72 and name   HA) 3.249 1.320 1.320 weight 1.000 ! spec=sumo...oesy, no=602, id=499, vol=8.443900e-01
assign (segid  B  and resid   75 and name   HN) (segid  B  and resid   76 and name   HA) 3.065 1.174 1.174 weight 1.000 ! spec=sumo...oesy, no=603, id=500, vol=1.199840e+00
assign (segid  B  and resid   16 and name  HB1) (segid  B  and resid   16 and name  HB2) 2.072 0.537 0.537 weight 1.000 ! spec=sumo...oesy, no=604, id=1186, vol=7.978140e+00
assign (segid  B  and resid   16 and name  HB2) (segid  B  and resid   32 and name  HG1) 3.076 1.183 1.183 weight 1.000 ! spec=sumo...oesy, no=606, id=1188, vol=7.455200e-01
assign (segid  B  and resid   16 and name  HB2) (segid  B  and resid   32 and name  HG2) 3.069 1.177 1.177 weight 1.000 ! spec=sumo...oesy, no=607, id=1189, vol=7.561500e-01
assign (segid  B  and resid   75 and name   HN) (segid  B  and resid   75 and name   HA) 2.677 0.896 0.896 weight 1.000 ! spec=sumo...oesy, no=608, id=504, vol=2.702800e+00
assign (segid  B  and resid   75 and name   HN) (segid  B  and resid   75 and name   HG) 2.311 0.668 0.668 weight 1.000 ! spec=sumo...oesy, no=612, id=508, vol=6.517270e+00
assign (segid  B  and resid   75 and name   HN) (segid  B  and resid   75 and name  HB2) 2.584 0.835 0.835 weight 1.000 ! spec=sumo...oesy, no=613, id=509, vol=3.340140e+00
assign (segid  B  and resid   36 and name  HB1) (segid  B  and resid   36 and name  HB2) 2.076 0.539 0.539 weight 1.000 ! spec=sumo...oesy, no=614, id=1191, vol=7.888520e+00
assign (segid  B  and resid   36 and name  HB1) (segid  B  and resid   73 and name  HB2) 2.954 1.091 1.091 weight 1.000 ! spec=sumo...oesy, no=615, id=1192, vol=9.501400e-01
    or (segid  B  and resid   36 and name  HB1) (segid  B  and resid   73 and name  HB1)
    or (segid  B  and resid   36 and name  HB1) (segid  B  and resid   73 and name  HB3)
assign (segid  B  and resid   36 and name  HB2) (segid  B  and resid   36 and name  HD1) 2.978 1.109 1.109 weight 1.000 ! spec=sumo...oesy, no=617, id=1193, vol=9.058000e-01
assign (segid  B  and resid   25 and name   HN) (segid  B  and resid   24 and name   HA) 2.784 0.969 0.969 weight 1.000 ! spec=sumo...oesy, no=618, id=513, vol=2.135610e+00
assign (segid  B  and resid   25 and name   HN) (segid  B  and resid   23 and name  HA2) 2.854 1.018 1.018 weight 1.000 ! spec=sumo...oesy, no=619, id=514, vol=1.840100e+00
assign (segid  B  and resid   36 and name  HB1) (segid  B  and resid   14 and name  HB2) 3.088 1.192 1.192 weight 1.000 ! spec=sumo...oesy, no=620, id=1196, vol=7.288300e-01
assign (segid  B  and resid   73 and name   HN) (segid  B  and resid   75 and name   HN) 3.192 1.274 1.274 weight 1.000 ! spec=sumo...oesy, no=622, id=517, vol=9.396000e-01
assign (segid  B  and resid   73 and name   HN) (segid  B  and resid   71 and name   HA) 3.404 1.449 1.449 weight 1.000 ! spec=sumo...oesy, no=623, id=518, vol=6.385900e-01
assign (segid  B  and resid   73 and name   HN) (segid  B  and resid   72 and name   HA) 3.310 1.370 1.370 weight 1.000 ! spec=sumo...oesy, no=624, id=519, vol=7.552800e-01
assign (segid  B  and resid   47 and name  HB1) (segid  B  and resid   44 and name   HA) 2.740 0.939 0.939 weight 1.000 ! spec=sumo...oesy, no=625, id=1197, vol=1.492480e+00
assign (segid  B  and resid   47 and name  HB1) (segid  B  and resid   47 and name   HA) 2.454 0.753 0.753 weight 1.000 ! spec=sumo...oesy, no=626, id=1198, vol=2.894130e+00
assign (segid  B  and resid   73 and name   HN) (segid  B  and resid   36 and name   HA) 3.254 1.323 1.323 weight 1.000 ! spec=sumo...oesy, no=627, id=522, vol=8.377300e-01
assign (segid  B  and resid   47 and name  HB2) (segid  B  and resid   47 and name   HA) 2.589 0.838 0.838 weight 1.000 ! spec=sumo...oesy, no=628, id=1199, vol=2.100200e+00
assign (segid  B  and resid   73 and name   HN) (segid  B  and resid   72 and name  HB2) 2.947 1.086 1.086 weight 1.000 ! spec=sumo...oesy, no=630, id=525, vol=1.517260e+00
assign (segid  B  and resid   80 and name  HB1) (segid  B  and resid   80 and name   HA) 2.479 0.768 0.768 weight 1.000 ! spec=sumo...oesy, no=631, id=1201, vol=2.721920e+00
assign (segid  B  and resid   80 and name  HB1) (segid  B  and resid   80 and name  HB2) 1.949 0.475 0.475 weight 1.000 ! spec=sumo...oesy, no=633, id=1202, vol=1.153574e+01
assign (segid  B  and resid   80 and name  HB1) (segid  B  and resid   80 and name  HG2) 2.350 0.690 0.690 weight 1.000 ! spec=sumo...oesy, no=634, id=1203, vol=3.751900e+00
assign (segid  B  and resid   27 and name   HN) (segid  B  and resid   25 and name   HN) 3.063 1.172 1.172 weight 1.000 ! spec=sumo...oesy, no=635, id=529, vol=1.204570e+00
assign (segid  B  and resid   27 and name   HN) (segid  B  and resid   26 and name  HA2) 2.803 0.982 0.982 weight 1.000 ! spec=sumo...oesy, no=638, id=532, vol=2.050780e+00
assign (segid  B  and resid   27 and name   HN) (segid  B  and resid   23 and name   HN) 3.155 1.244 1.244 weight 1.000 ! spec=sumo...oesy, no=639, id=533, vol=1.008770e+00
assign (segid  B  and resid   28 and name   HN) (segid  B  and resid   27 and name   HN) 3.037 1.153 1.153 weight 1.000 ! spec=sumo...oesy, no=640, id=534, vol=1.266630e+00
assign (segid  B  and resid   77 and name   HN) (segid  B  and resid   77 and name  HB1) 2.840 1.008 1.008 weight 1.000 ! spec=sumo...oesy, no=642, id=536, vol=1.896190e+00
assign (segid  B  and resid   77 and name   HN) (segid  B  and resid   73 and name   HA) 3.383 1.430 1.430 weight 1.000 ! spec=sumo...oesy, no=643, id=537, vol=6.633000e-01
assign (segid  B  and resid   75 and name   HN) (segid  B  and resid   77 and name   HN) 3.198 1.279 1.279 weight 1.000 ! spec=sumo...oesy, no=645, id=539, vol=9.285200e-01
assign (segid  B  and resid   77 and name   HN) (segid  B  and resid   77 and name   HA) 2.687 0.902 0.902 weight 1.000 ! spec=sumo...oesy, no=646, id=540, vol=2.642820e+00
assign (segid  B  and resid   77 and name   HN) (segid  B  and resid   76 and name   HA) 2.589 0.838 0.838 weight 1.000 ! spec=sumo...oesy, no=647, id=541, vol=3.297660e+00
assign (segid  B  and resid   80 and name   HN) (segid  B  and resid   79 and name   HA) 2.453 0.752 0.752 weight 1.000 ! spec=sumo...oesy, no=652, id=545, vol=4.557140e+00
assign (segid  B  and resid   80 and name   HN) (segid  B  and resid   80 and name   HA) 2.437 0.742 0.742 weight 1.000 ! spec=sumo...oesy, no=653, id=546, vol=4.747470e+00
assign (segid  B  and resid   80 and name   HN) (segid  B  and resid   80 and name  HG2) 3.265 1.333 1.333 weight 1.000 ! spec=sumo...oesy, no=657, id=550, vol=8.199500e-01
assign (segid  B  and resid   80 and name   HN) (segid  B  and resid   17 and name   HB) 3.247 1.318 1.318 weight 1.000 ! spec=sumo...oesy, no=658, id=551, vol=8.481200e-01
assign (segid  B  and resid   80 and name   HN) (segid  B  and resid   19 and name HD22) 3.288 1.352 1.352 weight 1.000 ! spec=sumo...oesy, no=660, id=553, vol=7.861300e-01
    or (segid  B  and resid   80 and name   HN) (segid  B  and resid   19 and name HD21)
    or (segid  B  and resid   80 and name   HN) (segid  B  and resid   19 and name HD23)
assign (segid  B  and resid   67 and name HD21) (segid  B  and resid   67 and name  HB1) 3.241 1.313 1.313 weight 1.000 ! spec=sumo...oesy, no=661, id=554, vol=8.575800e-01
assign (segid  B  and resid   67 and name HD21) (segid  B  and resid   67 and name  HB2) 2.847 1.013 1.013 weight 1.000 ! spec=sumo...oesy, no=664, id=556, vol=1.868560e+00
assign (segid  B  and resid   67 and name HD22) (segid  B  and resid   67 and name  HB1) 3.365 1.415 1.415 weight 1.000 ! spec=sumo...oesy, no=665, id=557, vol=6.846100e-01
assign (segid  B  and resid   67 and name HD22) (segid  B  and resid   67 and name  HB2) 2.857 1.020 1.020 weight 1.000 ! spec=sumo...oesy, no=666, id=558, vol=1.829480e+00
assign (segid  B  and resid   67 and name HD21) (segid  B  and resid   67 and name HD22) 1.887 0.445 0.445 weight 1.000 ! spec=sumo...oesy, no=667, id=559, vol=2.203226e+01
assign (segid  B  and resid   59 and name   HZ) (segid  B  and resid   43 and name   HA) 2.628 0.863 0.863 weight 1.000 ! spec=sumo...oesy, no=669, id=1204, vol=1.919930e+00
assign (segid  B  and resid   39 and name   HN) (segid  B  and resid   40 and name   HN) 2.723 0.927 0.927 weight 1.000 ! spec=sumo...oesy, no=670, id=561, vol=2.437800e+00
assign (segid  B  and resid   41 and name   HN) (segid  B  and resid   40 and name   HN) 2.811 0.988 0.988 weight 1.000 ! spec=sumo...oesy, no=672, id=562, vol=2.012700e+00
assign (segid  B  and resid   40 and name   HN) (segid  B  and resid   40 and name  HB2) 3.320 1.378 1.378 weight 1.000 ! spec=sumo...oesy, no=673, id=563, vol=7.424300e-01
assign (segid  B  and resid   43 and name   HA) (segid  B  and resid   43 and name  HE2) 2.980 1.110 1.110 weight 1.000 ! spec=sumo...oesy, no=674, id=1208, vol=9.017700e-01
    or (segid  B  and resid   43 and name   HA) (segid  B  and resid   43 and name  HE1)
    or (segid  B  and resid   43 and name   HA) (segid  B  and resid   43 and name  HE3)
assign (segid  B  and resid   43 and name   HA) (segid  B  and resid   43 and name  HG2) 2.529 0.799 0.799 weight 1.000 ! spec=sumo...oesy, no=676, id=1210, vol=2.414720e+00
assign (segid  B  and resid   40 and name   HN) (segid  B  and resid   38 and name  HB2) 2.584 0.835 0.835 weight 1.000 ! spec=sumo...oesy, no=677, id=567, vol=3.338730e+00
assign (segid  B  and resid   43 and name   HA) (segid  B  and resid   42 and name HD22) 2.485 0.772 0.772 weight 1.000 ! spec=sumo...oesy, no=679, id=1213, vol=2.682000e+00
    or (segid  B  and resid   43 and name   HA) (segid  B  and resid   42 and name HD21)
    or (segid  B  and resid   43 and name   HA) (segid  B  and resid   42 and name HD23)
assign (segid  B  and resid   56 and name   HN) (segid  B  and resid   55 and name  HB2) 3.217 1.293 1.293 weight 1.000 ! spec=sumo...oesy, no=681, id=571, vol=8.975600e-01
assign (segid  B  and resid   56 and name   HN) (segid  B  and resid   57 and name HG22) 3.331 1.387 1.387 weight 1.000 ! spec=sumo...oesy, no=682, id=572, vol=7.272900e-01
    or (segid  B  and resid   56 and name   HN) (segid  B  and resid   57 and name HG21)
    or (segid  B  and resid   56 and name   HN) (segid  B  and resid   57 and name HG23)
assign (segid  B  and resid   56 and name   HN) (segid  B  and resid   55 and name   HN) 2.708 0.916 0.916 weight 1.000 ! spec=sumo...oesy, no=683, id=573, vol=2.522810e+00
assign (segid  B  and resid   56 and name   HN) (segid  B  and resid   56 and name   HA) 2.599 0.844 0.844 weight 1.000 ! spec=sumo...oesy, no=685, id=574, vol=3.228550e+00
assign (segid  B  and resid   56 and name   HN) (segid  B  and resid   55 and name   HA) 2.786 0.970 0.970 weight 1.000 ! spec=sumo...oesy, no=686, id=575, vol=2.125820e+00
assign (segid  B  and resid   56 and name   HN) (segid  B  and resid   56 and name  HB2) 2.584 0.835 0.835 weight 1.000 ! spec=sumo...oesy, no=688, id=577, vol=3.339360e+00
assign (segid  B  and resid   56 and name   HN) (segid  B  and resid   55 and name  HB1) 3.162 1.250 1.250 weight 1.000 ! spec=sumo...oesy, no=689, id=578, vol=9.947000e-01
assign (segid  B  and resid   56 and name   HN) (segid  B  and resid   53 and name  HB2) 3.236 1.309 1.309 weight 1.000 ! spec=sumo...oesy, no=691, id=580, vol=8.659300e-01
assign (segid  B  and resid   56 and name   HN) (segid  B  and resid   55 and name  HG1) 3.065 1.174 1.174 weight 1.000 ! spec=sumo...oesy, no=692, id=581, vol=1.198990e+00
assign (segid  B  and resid   56 and name   HN) (segid  B  and resid   57 and name HG12) 3.004 1.128 1.128 weight 1.000 ! spec=sumo...oesy, no=693, id=582, vol=1.352310e+00
assign (segid  B  and resid   12 and name   HN) (segid  B  and resid   13 and name   HN) 3.253 1.323 1.323 weight 1.000 ! spec=sumo...oesy, no=694, id=583, vol=8.390600e-01
assign (segid  B  and resid   12 and name   HN) (segid  B  and resid   10 and name   HA) 3.132 1.226 1.226 weight 1.000 ! spec=sumo...oesy, no=697, id=585, vol=1.053570e+00
assign (segid  B  and resid   12 and name   HN) (segid  B  and resid   11 and name  HB1) 3.020 1.140 1.140 weight 1.000 ! spec=sumo...oesy, no=698, id=586, vol=1.310260e+00
assign (segid  B  and resid   12 and name   HN) (segid  B  and resid   12 and name HG21) 2.899 1.050 1.050 weight 1.000 ! spec=sumo...oesy, no=699, id=587, vol=1.676260e+00
    or (segid  B  and resid   12 and name   HN) (segid  B  and resid   12 and name HG22)
    or (segid  B  and resid   12 and name   HN) (segid  B  and resid   12 and name HG23)
assign (segid  B  and resid   12 and name   HN) (segid  B  and resid   10 and name HG22) 3.367 1.417 1.417 weight 1.000 ! spec=sumo...oesy, no=700, id=588, vol=6.827600e-01
    or (segid  B  and resid   12 and name   HN) (segid  B  and resid   10 and name HG21)
    or (segid  B  and resid   12 and name   HN) (segid  B  and resid   10 and name HG23)
assign (segid  B  and resid   56 and name   HN) (segid  B  and resid   57 and name   HN) 2.230 0.622 0.622 weight 1.000 ! spec=sumo...oesy, no=703, id=591, vol=8.084280e+00
assign (segid  B  and resid   57 and name   HN) (segid  B  and resid   57 and name   HA) 2.665 0.888 0.888 weight 1.000 ! spec=sumo...oesy, no=705, id=592, vol=2.777320e+00
assign (segid  B  and resid   57 and name   HN) (segid  B  and resid   56 and name   HA) 2.677 0.896 0.896 weight 1.000 ! spec=sumo...oesy, no=706, id=593, vol=2.699660e+00
assign (segid  B  and resid   57 and name   HN) (segid  B  and resid   56 and name  HB2) 2.952 1.089 1.089 weight 1.000 ! spec=sumo...oesy, no=708, id=595, vol=1.502790e+00
assign (segid  B  and resid   57 and name   HN) (segid  B  and resid   57 and name HG12) 2.318 0.671 0.671 weight 1.000 ! spec=sumo...oesy, no=710, id=597, vol=6.414260e+00
assign (segid  B  and resid   57 and name   HN) (segid  B  and resid   57 and name HG22) 2.672 0.893 0.893 weight 1.000 ! spec=sumo...oesy, no=711, id=598, vol=2.729500e+00
    or (segid  B  and resid   57 and name   HN) (segid  B  and resid   57 and name HG21)
    or (segid  B  and resid   57 and name   HN) (segid  B  and resid   57 and name HG23)
assign (segid  B  and resid   53 and name   HN) (segid  B  and resid   53 and name  HB1) 2.583 0.834 0.834 weight 1.000 ! spec=sumo...oesy, no=715, id=599, vol=3.345690e+00
assign (segid  B  and resid   53 and name   HN) (segid  B  and resid   87 and name HE21) 3.201 1.281 1.281 weight 1.000 ! spec=sumo...oesy, no=717, id=601, vol=9.241400e-01
assign (segid  B  and resid   53 and name   HN) (segid  B  and resid   56 and name  HB2) 3.228 1.302 1.302 weight 1.000 ! spec=sumo...oesy, no=718, id=602, vol=8.791600e-01
assign (segid  B  and resid   53 and name   HN) (segid  B  and resid   52 and name  HB1) 2.589 0.838 0.838 weight 1.000 ! spec=sumo...oesy, no=719, id=603, vol=3.303200e+00
assign (segid  B  and resid   18 and name HD21) (segid  B  and resid   18 and name  HB1) 2.836 1.006 1.006 weight 1.000 ! spec=sumo...oesy, no=724, id=607, vol=1.908640e+00
assign (segid  B  and resid   18 and name HD21) (segid  B  and resid   18 and name  HB2) 3.163 1.251 1.251 weight 1.000 ! spec=sumo...oesy, no=725, id=608, vol=9.924600e-01
assign (segid  B  and resid   18 and name HD21) (segid  B  and resid   18 and name HD22) 1.880 0.442 0.442 weight 1.000 ! spec=sumo...oesy, no=726, id=609, vol=2.254781e+01
assign (segid  B  and resid   18 and name HD22) (segid  B  and resid   18 and name  HB1) 2.863 1.025 1.025 weight 1.000 ! spec=sumo...oesy, no=728, id=610, vol=1.805490e+00
assign (segid  B  and resid   18 and name HD22) (segid  B  and resid   18 and name  HB2) 3.096 1.198 1.198 weight 1.000 ! spec=sumo...oesy, no=729, id=611, vol=1.128980e+00
assign (segid  B  and resid   55 and name   HN) (segid  B  and resid   53 and name  HB2) 3.358 1.410 1.410 weight 1.000 ! spec=sumo...oesy, no=731, id=612, vol=6.929200e-01
assign (segid  B  and resid   31 and name  HB2) (segid  B  and resid   31 and name   HA) 2.424 0.735 0.735 weight 1.000 ! spec=sumo...oesy, no=733, id=1218, vol=3.112320e+00
assign (segid  B  and resid   31 and name  HB2) (segid  B  and resid   31 and name  HB1) 1.953 0.477 0.477 weight 1.000 ! spec=sumo...oesy, no=734, id=1219, vol=1.138766e+01
assign (segid  B  and resid   55 and name   HN) (segid  B  and resid   57 and name   HN) 3.311 1.371 1.371 weight 1.000 ! spec=sumo...oesy, no=736, id=616, vol=7.539500e-01
assign (segid  B  and resid   55 and name   HN) (segid  B  and resid   55 and name   HA) 2.527 0.798 0.798 weight 1.000 ! spec=sumo...oesy, no=737, id=617, vol=3.817370e+00
assign (segid  B  and resid   31 and name  HD1) (segid  B  and resid   31 and name  HB1) 2.280 0.650 0.650 weight 1.000 ! spec=sumo...oesy, no=738, id=1221, vol=4.492420e+00
    or (segid  B  and resid   31 and name  HD2) (segid  B  and resid   31 and name  HB1)
assign (segid  B  and resid   31 and name  HB1) (segid  B  and resid   31 and name   HA) 2.505 0.784 0.784 weight 1.000 ! spec=sumo...oesy, no=739, id=1222, vol=2.559410e+00
assign (segid  B  and resid   76 and name   HN) (segid  B  and resid   75 and name HD22) 3.398 1.443 1.443 weight 1.000 ! spec=sumo...oesy, no=740, id=620, vol=6.458900e-01
    or (segid  B  and resid   76 and name   HN) (segid  B  and resid   75 and name HD21)
    or (segid  B  and resid   76 and name   HN) (segid  B  and resid   75 and name HD23)
assign (segid  B  and resid   84 and name   HA) (segid  B  and resid   84 and name  HB1) 2.129 0.566 0.566 weight 1.000 ! spec=sumo...oesy, no=745, id=1228, vol=6.792980e+00
assign (segid  B  and resid   76 and name   HN) (segid  B  and resid   76 and name  HB1) 2.991 1.118 1.118 weight 1.000 ! spec=sumo...oesy, no=746, id=621, vol=1.389630e+00
assign (segid  B  and resid   84 and name  HB1) (segid  B  and resid   60 and name  HB1) 2.666 0.889 0.889 weight 1.000 ! spec=sumo...oesy, no=747, id=1229, vol=1.757700e+00
assign (segid  B  and resid   31 and name  HB1) (segid  B  and resid   19 and name  HB1) 2.609 0.851 0.851 weight 1.000 ! spec=sumo...oesy, no=748, id=1230, vol=2.005070e+00
assign (segid  B  and resid   76 and name   HN) (segid  B  and resid   75 and name   HA) 2.879 1.036 1.036 weight 1.000 ! spec=sumo...oesy, no=749, id=623, vol=1.745600e+00
assign (segid  B  and resid   76 and name   HN) (segid  B  and resid   73 and name   HA) 2.897 1.049 1.049 weight 1.000 ! spec=sumo...oesy, no=750, id=624, vol=1.681120e+00
assign (segid  B  and resid   76 and name   HN) (segid  B  and resid   76 and name   HA) 2.193 0.601 0.601 weight 1.000 ! spec=sumo...oesy, no=751, id=625, vol=8.924660e+00
assign (segid  B  and resid   76 and name   HN) (segid  B  and resid   75 and name  HB2) 3.151 1.241 1.241 weight 1.000 ! spec=sumo...oesy, no=754, id=628, vol=1.014990e+00
assign (segid  B  and resid   76 and name   HN) (segid  B  and resid   73 and name  HB2) 3.257 1.326 1.326 weight 1.000 ! spec=sumo...oesy, no=755, id=629, vol=8.334300e-01
    or (segid  B  and resid   76 and name   HN) (segid  B  and resid   73 and name  HB1)
    or (segid  B  and resid   76 and name   HN) (segid  B  and resid   73 and name  HB3)
assign (segid  B  and resid   55 and name  HD1) (segid  B  and resid   53 and name  HB2) 3.030 1.148 1.148 weight 1.000 ! spec=sumo...oesy, no=756, id=1234, vol=8.157100e-01
assign (segid  B  and resid   82 and name   HN) (segid  B  and resid   82 and name   HA) 2.957 1.093 1.093 weight 1.000 ! spec=sumo...oesy, no=759, id=632, vol=1.485700e+00
assign (segid  B  and resid   82 and name   HN) (segid  B  and resid   81 and name   HA) 2.195 0.602 0.602 weight 1.000 ! spec=sumo...oesy, no=760, id=633, vol=8.893650e+00
assign (segid  B  and resid   82 and name   HN) (segid  B  and resid   82 and name   HB) 2.412 0.727 0.727 weight 1.000 ! spec=sumo...oesy, no=761, id=634, vol=5.046960e+00
assign (segid  B  and resid   82 and name   HN) (segid  B  and resid   81 and name  HB1) 2.995 1.122 1.122 weight 1.000 ! spec=sumo...oesy, no=762, id=635, vol=1.376340e+00
assign (segid  B  and resid   82 and name   HN) (segid  B  and resid   82 and name HG21) 2.899 1.050 1.050 weight 1.000 ! spec=sumo...oesy, no=764, id=637, vol=1.675080e+00
    or (segid  B  and resid   82 and name   HN) (segid  B  and resid   82 and name HG22)
    or (segid  B  and resid   82 and name   HN) (segid  B  and resid   82 and name HG23)
assign (segid  B  and resid   81 and name   HN) (segid  B  and resid   82 and name   HN) 3.163 1.250 1.250 weight 1.000 ! spec=sumo...oesy, no=765, id=638, vol=9.929400e-01
assign (segid  B  and resid   60 and name  HD2) (segid  B  and resid   60 and name  HB1) 2.510 0.788 0.788 weight 1.000 ! spec=sumo...oesy, no=767, id=1241, vol=2.526720e+00
assign (segid  B  and resid   60 and name  HD2) (segid  B  and resid   60 and name  HG1) 2.329 0.678 0.678 weight 1.000 ! spec=sumo...oesy, no=768, id=1242, vol=3.958580e+00
assign (segid  B  and resid   60 and name  HD2) (segid  B  and resid   60 and name  HG2) 2.445 0.747 0.747 weight 1.000 ! spec=sumo...oesy, no=769, id=1243, vol=2.957860e+00
assign (segid  B  and resid   58 and name  HD1) (segid  B  and resid   58 and name  HB2) 2.895 1.048 1.048 weight 1.000 ! spec=sumo...oesy, no=777, id=1249, vol=1.073320e+00
assign (segid  B  and resid   49 and name  HD1) (segid  B  and resid   46 and name  HD1) 2.821 0.994 0.994 weight 1.000 ! spec=sumo...oesy, no=781, id=1253, vol=1.254970e+00
    or (segid  B  and resid   49 and name  HD1) (segid  B  and resid   46 and name  HD2)
assign (segid  B  and resid   49 and name  HD1) (segid  B  and resid   46 and name   HA) 2.584 0.835 0.835 weight 1.000 ! spec=sumo...oesy, no=782, id=1254, vol=2.120850e+00
assign (segid  B  and resid   49 and name   HN) (segid  B  and resid   50 and name   HN) 2.428 0.737 0.737 weight 1.000 ! spec=sumo...oesy, no=783, id=643, vol=4.847700e+00
assign (segid  B  and resid   49 and name  HD1) (segid  B  and resid   29 and name HG22) 2.724 0.927 0.927 weight 1.000 ! spec=sumo...oesy, no=784, id=1256, vol=1.547540e+00
    or (segid  B  and resid   49 and name  HD1) (segid  B  and resid   29 and name HG21)
    or (segid  B  and resid   49 and name  HD1) (segid  B  and resid   29 and name HG23)
assign (segid  B  and resid   49 and name  HD1) (segid  B  and resid   29 and name HG12) 2.530 0.800 0.800 weight 1.000 ! spec=sumo...oesy, no=785, id=1257, vol=2.407490e+00
    or (segid  B  and resid   49 and name  HD1) (segid  B  and resid   29 and name HG11)
    or (segid  B  and resid   49 and name  HD1) (segid  B  and resid   29 and name HG13)
assign (segid  B  and resid   35 and name  HD1) (segid  B  and resid   17 and name HD12) 2.921 1.067 1.067 weight 1.000 ! spec=sumo...oesy, no=787, id=1259, vol=1.016500e+00
    or (segid  B  and resid   35 and name  HD1) (segid  B  and resid   17 and name HD11)
    or (segid  B  and resid   35 and name  HD1) (segid  B  and resid   17 and name HD13)
assign (segid  B  and resid   58 and name   HA) (segid  B  and resid   58 and name  HD2) 2.670 0.891 0.891 weight 1.000 ! spec=sumo...oesy, no=788, id=1260, vol=1.741970e+00
assign (segid  B  and resid   49 and name  HD2) (segid  B  and resid   49 and name  HB2) 2.565 0.822 0.822 weight 1.000 ! spec=sumo...oesy, no=789, id=1261, vol=2.219170e+00
assign (segid  B  and resid   49 and name  HD2) (segid  B  and resid   46 and name  HD1) 2.812 0.989 0.989 weight 1.000 ! spec=sumo...oesy, no=790, id=1262, vol=1.277010e+00
    or (segid  B  and resid   49 and name  HD2) (segid  B  and resid   46 and name  HD2)
assign (segid  B  and resid   50 and name   HN) (segid  B  and resid   52 and name HD12) 3.106 1.206 1.206 weight 1.000 ! spec=sumo...oesy, no=791, id=650, vol=1.106250e+00
    or (segid  B  and resid   50 and name   HN) (segid  B  and resid   52 and name HD11)
    or (segid  B  and resid   50 and name   HN) (segid  B  and resid   52 and name HD13)
assign (segid  B  and resid   50 and name   HN) (segid  B  and resid   47 and name   HA) 3.295 1.357 1.357 weight 1.000 ! spec=sumo...oesy, no=792, id=651, vol=7.762000e-01
assign (segid  B  and resid   49 and name  HD2) (segid  B  and resid   29 and name HG22) 2.564 0.822 0.822 weight 1.000 ! spec=sumo...oesy, no=793, id=1265, vol=2.224710e+00
    or (segid  B  and resid   49 and name  HD2) (segid  B  and resid   29 and name HG21)
    or (segid  B  and resid   49 and name  HD2) (segid  B  and resid   29 and name HG23)
assign (segid  B  and resid   14 and name HD21) (segid  B  and resid   14 and name  HB1) 3.036 1.152 1.152 weight 1.000 ! spec=sumo...oesy, no=794, id=652, vol=1.269060e+00
assign (segid  B  and resid   14 and name HD21) (segid  B  and resid   14 and name  HB2) 3.109 1.208 1.208 weight 1.000 ! spec=sumo...oesy, no=795, id=653, vol=1.100120e+00
assign (segid  B  and resid   49 and name  HD1) (segid  B  and resid   45 and name  HB2) 2.615 0.855 0.855 weight 1.000 ! spec=sumo...oesy, no=798, id=1269, vol=1.974560e+00
    or (segid  B  and resid   49 and name  HD1) (segid  B  and resid   45 and name  HB1)
    or (segid  B  and resid   49 and name  HD1) (segid  B  and resid   45 and name  HB3)
assign (segid  B  and resid   35 and name  HD1) (segid  B  and resid   35 and name  HG1) 2.262 0.640 0.640 weight 1.000 ! spec=sumo...oesy, no=803, id=1271, vol=4.714410e+00
assign (segid  B  and resid   44 and name  HE2) (segid  B  and resid   44 and name   HA) 2.717 0.923 0.923 weight 1.000 ! spec=sumo...oesy, no=805, id=1272, vol=1.571330e+00
assign (segid  B  and resid   41 and name  HE1) (segid  B  and resid   38 and name  HD1) 3.001 1.126 1.126 weight 1.000 ! spec=sumo...oesy, no=811, id=1277, vol=8.647000e-01
assign (segid  B  and resid   64 and name HE22) (segid  B  and resid   64 and name  HG2) 2.764 0.955 0.955 weight 1.000 ! spec=sumo...oesy, no=812, id=658, vol=2.231650e+00
assign (segid  B  and resid   64 and name HE22) (segid  B  and resid   64 and name HE21) 1.589 0.316 0.316 weight 1.000 ! spec=sumo...oesy, no=813, id=659, vol=6.168570e+01
assign (segid  B  and resid   86 and name   HA) (segid  B  and resid   86 and name  HB1) 2.368 0.701 0.701 weight 1.000 ! spec=sumo...oesy, no=814, id=1280, vol=3.581860e+00
assign (segid  B  and resid   61 and name  HD1) (segid  B  and resid   61 and name  HB1) 2.363 0.698 0.698 weight 1.000 ! spec=sumo...oesy, no=815, id=1281, vol=3.629330e+00
    or (segid  B  and resid   61 and name  HD2) (segid  B  and resid   61 and name  HB1)
assign (segid  B  and resid   44 and name  HE1) (segid  B  and resid   44 and name   HA) 2.553 0.815 0.815 weight 1.000 ! spec=sumo...oesy, no=820, id=1286, vol=2.281860e+00
assign (segid  B  and resid   20 and name  HE1) (segid  B  and resid   20 and name  HB1) 2.800 0.980 0.980 weight 1.000 ! spec=sumo...oesy, no=826, id=1292, vol=1.310410e+00
assign (segid  B  and resid   37 and name   HN) (segid  B  and resid   36 and name   HN) 2.477 0.767 0.767 weight 1.000 ! spec=sumo...oesy, no=829, id=666, vol=4.300460e+00
assign (segid  B  and resid   36 and name   HN) (segid  B  and resid   36 and name  HB1) 2.826 0.998 0.998 weight 1.000 ! spec=sumo...oesy, no=830, id=667, vol=1.952400e+00
assign (segid  B  and resid   35 and name   HN) (segid  B  and resid   36 and name   HN) 2.837 1.006 1.006 weight 1.000 ! spec=sumo...oesy, no=832, id=669, vol=1.905530e+00
assign (segid  B  and resid   20 and name  HE2) (segid  B  and resid   80 and name   HA) 2.504 0.784 0.784 weight 1.000 ! spec=sumo...oesy, no=834, id=1299, vol=2.562900e+00
assign (segid  B  and resid   20 and name  HE2) (segid  B  and resid   20 and name  HB1) 3.037 1.153 1.153 weight 1.000 ! spec=sumo...oesy, no=835, id=1300, vol=8.053000e-01
assign (segid  B  and resid   34 and name  HE2) (segid  B  and resid   34 and name  HB2) 2.956 1.092 1.092 weight 1.000 ! spec=sumo...oesy, no=836, id=1301, vol=9.471800e-01
assign (segid  B  and resid   61 and name  HD1) (segid  B  and resid   61 and name  HB2) 2.392 0.715 0.715 weight 1.000 ! spec=sumo...oesy, no=837, id=1302, vol=3.372290e+00
    or (segid  B  and resid   61 and name  HD2) (segid  B  and resid   61 and name  HB2)
assign (segid  B  and resid   36 and name   HN) (segid  B  and resid   35 and name   HA) 3.354 1.406 1.406 weight 1.000 ! spec=sumo...oesy, no=838, id=674, vol=6.981000e-01
assign (segid  B  and resid   86 and name   HA) (segid  B  and resid   86 and name  HB2) 2.462 0.757 0.757 weight 1.000 ! spec=sumo...oesy, no=841, id=1306, vol=2.839450e+00
assign (segid  B  and resid   86 and name  HB2) (segid  B  and resid   86 and name  HB1) 1.869 0.436 0.436 weight 1.000 ! spec=sumo...oesy, no=842, id=1307, vol=1.484030e+01
assign (segid  B  and resid   30 and name HE21) (segid  B  and resid   30 and name HE22) 1.743 0.380 0.380 weight 1.000 ! spec=sumo...oesy, no=845, id=679, vol=3.545951e+01
assign (segid  B  and resid   79 and name  HB1) (segid  B  and resid   79 and name   HA) 2.210 0.611 0.611 weight 1.000 ! spec=sumo...oesy, no=846, id=1311, vol=5.422610e+00
assign (segid  B  and resid   70 and name  HB2) (segid  B  and resid   70 and name  HB1) 2.127 0.565 0.565 weight 1.000 ! spec=sumo...oesy, no=850, id=1314, vol=6.825260e+00
assign (segid  B  and resid   59 and name  HB1) (segid  B  and resid   66 and name HD12) 2.637 0.870 0.870 weight 1.000 ! spec=sumo...oesy, no=856, id=1319, vol=1.876960e+00
    or (segid  B  and resid   59 and name  HB1) (segid  B  and resid   66 and name HD11)
    or (segid  B  and resid   59 and name  HB1) (segid  B  and resid   66 and name HD13)
assign (segid  B  and resid   59 and name   HA) (segid  B  and resid   59 and name  HB1) 2.649 0.877 0.877 weight 1.000 ! spec=sumo...oesy, no=857, id=1320, vol=1.829620e+00
assign (segid  B  and resid    9 and name   HN) (segid  B  and resid    8 and name   HA) 2.402 0.721 0.721 weight 1.000 ! spec=sumo...oesy, no=867, id=689, vol=5.175050e+00
assign (segid  B  and resid    9 and name   HN) (segid  B  and resid    9 and name  HA2) 2.395 0.717 0.717 weight 1.000 ! spec=sumo...oesy, no=868, id=690, vol=5.263240e+00
assign (segid  B  and resid   22 and name   HN) (segid  B  and resid   83 and name   HN) 3.281 1.346 1.346 weight 1.000 ! spec=sumo...oesy, no=869, id=691, vol=7.969500e-01
assign (segid  B  and resid   10 and name   HN) (segid  B  and resid    9 and name   HN) 3.324 1.381 1.381 weight 1.000 ! spec=sumo...oesy, no=872, id=693, vol=7.366400e-01
assign (segid  B  and resid   67 and name   HA) (segid  B  and resid   67 and name  HB2) 2.351 0.691 0.691 weight 1.000 ! spec=sumo...oesy, no=874, id=1337, vol=3.738930e+00
assign (segid  B  and resid   22 and name   HN) (segid  B  and resid   21 and name   HA) 2.250 0.633 0.633 weight 1.000 ! spec=sumo...oesy, no=875, id=695, vol=7.658020e+00
assign (segid  B  and resid   22 and name   HN) (segid  B  and resid   83 and name   HB) 3.272 1.339 1.339 weight 1.000 ! spec=sumo...oesy, no=876, id=696, vol=8.093600e-01
assign (segid  B  and resid   22 and name   HN) (segid  B  and resid   22 and name  HB2) 2.414 0.729 0.729 weight 1.000 ! spec=sumo...oesy, no=877, id=697, vol=5.018360e+00
    or (segid  B  and resid   22 and name   HN) (segid  B  and resid   22 and name  HB1)
    or (segid  B  and resid   22 and name   HN) (segid  B  and resid   22 and name  HB3)
assign (segid  B  and resid   22 and name   HN) (segid  B  and resid   82 and name HG21) 2.836 1.006 1.006 weight 1.000 ! spec=sumo...oesy, no=878, id=698, vol=1.909520e+00
    or (segid  B  and resid   22 and name   HN) (segid  B  and resid   82 and name HG22)
    or (segid  B  and resid   22 and name   HN) (segid  B  and resid   82 and name HG23)
assign (segid  B  and resid   25 and name   HA) (segid  B  and resid   25 and name  HB1) 2.317 0.671 0.671 weight 1.000 ! spec=sumo...oesy, no=879, id=1338, vol=4.085340e+00
assign (segid  B  and resid   25 and name  HB1) (segid  B  and resid   25 and name  HB2) 2.020 0.510 0.510 weight 1.000 ! spec=sumo...oesy, no=880, id=1339, vol=9.287010e+00
assign (segid  B  and resid   22 and name   HN) (segid  B  and resid   21 and name HG12) 2.691 0.905 0.905 weight 1.000 ! spec=sumo...oesy, no=881, id=701, vol=2.618770e+00
    or (segid  B  and resid   22 and name   HN) (segid  B  and resid   21 and name HG11)
    or (segid  B  and resid   22 and name   HN) (segid  B  and resid   21 and name HG13)
assign (segid  B  and resid   23 and name   HN) (segid  B  and resid   22 and name   HA) 2.114 0.559 0.559 weight 1.000 ! spec=sumo...oesy, no=883, id=702, vol=1.112194e+01
assign (segid  B  and resid   23 and name   HN) (segid  B  and resid   28 and name   HA) 2.925 1.070 1.070 weight 1.000 ! spec=sumo...oesy, no=884, id=703, vol=1.586400e+00
assign (segid  B  and resid   23 and name   HN) (segid  B  and resid   23 and name  HA1) 2.676 0.895 0.895 weight 1.000 ! spec=sumo...oesy, no=885, id=704, vol=2.707470e+00
assign (segid  B  and resid   23 and name   HN) (segid  B  and resid   23 and name  HA2) 2.444 0.747 0.747 weight 1.000 ! spec=sumo...oesy, no=886, id=705, vol=4.661250e+00
assign (segid  B  and resid   18 and name  HB2) (segid  B  and resid   80 and name  HG2) 2.824 0.997 0.997 weight 1.000 ! spec=sumo...oesy, no=887, id=1345, vol=1.246420e+00
assign (segid  B  and resid   51 and name   HN) (segid  B  and resid   50 and name   HA) 2.949 1.087 1.087 weight 1.000 ! spec=sumo...oesy, no=890, id=708, vol=1.512550e+00
assign (segid  B  and resid   52 and name   HN) (segid  B  and resid   51 and name   HN) 2.378 0.707 0.707 weight 1.000 ! spec=sumo...oesy, no=891, id=709, vol=5.494960e+00
assign (segid  B  and resid   51 and name   HN) (segid  B  and resid   51 and name  HA2) 2.151 0.578 0.578 weight 1.000 ! spec=sumo...oesy, no=893, id=710, vol=1.003381e+01
assign (segid  B  and resid   68 and name  HG1) (segid  B  and resid   68 and name   HA) 2.510 0.788 0.788 weight 1.000 ! spec=sumo...oesy, no=898, id=1348, vol=2.525390e+00
assign (segid  B  and resid   68 and name  HG1) (segid  B  and resid   43 and name  HE2) 3.089 1.193 1.193 weight 1.000 ! spec=sumo...oesy, no=899, id=1349, vol=7.266500e-01
    or (segid  B  and resid   68 and name  HG1) (segid  B  and resid   43 and name  HE1)
    or (segid  B  and resid   68 and name  HG1) (segid  B  and resid   43 and name  HE3)
assign (segid  B  and resid   68 and name  HG1) (segid  B  and resid   69 and name HG21) 2.757 0.950 0.950 weight 1.000 ! spec=sumo...oesy, no=900, id=1350, vol=1.438630e+00
    or (segid  B  and resid   68 and name  HG1) (segid  B  and resid   69 and name HG22)
    or (segid  B  and resid   68 and name  HG1) (segid  B  and resid   69 and name HG23)
assign (segid  B  and resid   68 and name  HG2) (segid  B  and resid   68 and name   HA) 2.433 0.740 0.740 weight 1.000 ! spec=sumo...oesy, no=902, id=1352, vol=3.049460e+00
assign (segid  B  and resid   68 and name  HG2) (segid  B  and resid   43 and name  HE2) 2.977 1.108 1.108 weight 1.000 ! spec=sumo...oesy, no=903, id=1353, vol=9.068700e-01
    or (segid  B  and resid   68 and name  HG2) (segid  B  and resid   43 and name  HE1)
    or (segid  B  and resid   68 and name  HG2) (segid  B  and resid   43 and name  HE3)
assign (segid  B  and resid   48 and name   HA) (segid  B  and resid   48 and name  HG2) 2.282 0.651 0.651 weight 1.000 ! spec=sumo...oesy, no=905, id=1355, vol=4.472350e+00
assign (segid  B  and resid   62 and name   HN) (segid  B  and resid   61 and name  HD1) 2.816 0.991 0.991 weight 1.000 ! spec=sumo...oesy, no=907, id=720, vol=1.994510e+00
    or (segid  B  and resid   62 and name   HN) (segid  B  and resid   61 and name  HD2)
assign (segid  B  and resid   80 and name  HG1) (segid  B  and resid   80 and name   HA) 2.495 0.778 0.778 weight 1.000 ! spec=sumo...oesy, no=908, id=1358, vol=2.618050e+00
assign (segid  B  and resid   62 and name   HN) (segid  B  and resid   62 and name   HA) 2.189 0.599 0.599 weight 1.000 ! spec=sumo...oesy, no=909, id=722, vol=9.042600e+00
assign (segid  B  and resid   62 and name   HN) (segid  B  and resid   62 and name  HB2) 2.787 0.971 0.971 weight 1.000 ! spec=sumo...oesy, no=910, id=723, vol=2.119300e+00
assign (segid  B  and resid   50 and name HE21) (segid  B  and resid   50 and name  HB1) 3.120 1.216 1.216 weight 1.000 ! spec=sumo...oesy, no=912, id=724, vol=1.078620e+00
assign (segid  B  and resid   50 and name HE21) (segid  B  and resid   29 and name HG22) 3.336 1.391 1.391 weight 1.000 ! spec=sumo...oesy, no=913, id=725, vol=7.211600e-01
    or (segid  B  and resid   50 and name HE21) (segid  B  and resid   29 and name HG21)
    or (segid  B  and resid   50 and name HE21) (segid  B  and resid   29 and name HG23)
assign (segid  B  and resid   56 and name  HG1) (segid  B  and resid   53 and name  HB1) 2.863 1.025 1.025 weight 1.000 ! spec=sumo...oesy, no=915, id=1363, vol=1.146620e+00
assign (segid  B  and resid   56 and name  HG1) (segid  B  and resid   53 and name  HB2) 2.749 0.945 0.945 weight 1.000 ! spec=sumo...oesy, no=916, id=1364, vol=1.464160e+00
assign (segid  B  and resid   50 and name HE22) (segid  B  and resid   29 and name HG22) 3.237 1.310 1.310 weight 1.000 ! spec=sumo...oesy, no=917, id=728, vol=8.641500e-01
    or (segid  B  and resid   50 and name HE22) (segid  B  and resid   29 and name HG21)
    or (segid  B  and resid   50 and name HE22) (segid  B  and resid   29 and name HG23)
assign (segid  B  and resid   87 and name  HG1) (segid  B  and resid   87 and name   HA) 2.643 0.873 0.873 weight 1.000 ! spec=sumo...oesy, no=919, id=1367, vol=1.855250e+00
assign (segid  B  and resid   30 and name  HG1) (segid  B  and resid   30 and name   HA) 2.499 0.781 0.781 weight 1.000 ! spec=sumo...oesy, no=920, id=1368, vol=2.591680e+00
assign (segid  B  and resid   30 and name  HG2) (segid  B  and resid   30 and name   HA) 2.800 0.980 0.980 weight 1.000 ! spec=sumo...oesy, no=921, id=1369, vol=1.310480e+00
assign (segid  B  and resid   87 and name  HG2) (segid  B  and resid   87 and name   HA) 2.640 0.871 0.871 weight 1.000 ! spec=sumo...oesy, no=922, id=1370, vol=1.864900e+00
assign (segid  B  and resid   87 and name  HG2) (segid  B  and resid   58 and name  HD2) 3.092 1.195 1.195 weight 1.000 ! spec=sumo...oesy, no=923, id=1371, vol=7.225200e-01
assign (segid  B  and resid   71 and name   HN) (segid  B  and resid   75 and name   HG) 3.273 1.339 1.339 weight 1.000 ! spec=sumo...oesy, no=924, id=732, vol=8.082300e-01
assign (segid  B  and resid   88 and name  HG2) (segid  B  and resid   87 and name   HA) 3.009 1.132 1.132 weight 1.000 ! spec=sumo...oesy, no=925, id=1373, vol=8.512300e-01
assign (segid  B  and resid   30 and name  HG2) (segid  B  and resid   20 and name  HG1) 2.244 0.630 0.630 weight 1.000 ! spec=sumo...oesy, no=927, id=1374, vol=4.942800e+00
assign (segid  B  and resid   71 and name   HN) (segid  B  and resid   71 and name HG21) 2.614 0.854 0.854 weight 1.000 ! spec=sumo...oesy, no=928, id=735, vol=3.119170e+00
    or (segid  B  and resid   71 and name   HN) (segid  B  and resid   71 and name HG22)
    or (segid  B  and resid   71 and name   HN) (segid  B  and resid   71 and name HG23)
assign (segid  B  and resid   74 and name   HN) (segid  B  and resid   71 and name   HN) 3.093 1.196 1.196 weight 1.000 ! spec=sumo...oesy, no=929, id=736, vol=1.134570e+00
assign (segid  B  and resid   71 and name   HN) (segid  B  and resid   70 and name  HB2) 3.016 1.137 1.137 weight 1.000 ! spec=sumo...oesy, no=930, id=737, vol=1.320480e+00
assign (segid  B  and resid   25 and name   HN) (segid  B  and resid   26 and name   HN) 2.344 0.687 0.687 weight 1.000 ! spec=sumo...oesy, no=931, id=738, vol=5.995700e+00
assign (segid  B  and resid   26 and name   HN) (segid  B  and resid   25 and name   HA) 2.758 0.951 0.951 weight 1.000 ! spec=sumo...oesy, no=933, id=739, vol=2.258650e+00
assign (segid  B  and resid   26 and name   HN) (segid  B  and resid   26 and name  HA1) 2.341 0.685 0.685 weight 1.000 ! spec=sumo...oesy, no=934, id=740, vol=6.035850e+00
assign (segid  B  and resid   26 and name   HN) (segid  B  and resid   26 and name  HA2) 2.205 0.608 0.608 weight 1.000 ! spec=sumo...oesy, no=935, id=741, vol=8.657920e+00
assign (segid  B  and resid   26 and name   HN) (segid  B  and resid   25 and name  HB2) 3.310 1.370 1.370 weight 1.000 ! spec=sumo...oesy, no=936, id=742, vol=7.556100e-01
assign (segid  B  and resid   64 and name  HG2) (segid  B  and resid   65 and name  HD1) 2.682 0.899 0.899 weight 1.000 ! spec=sumo...oesy, no=937, id=1383, vol=1.698020e+00
assign (segid  B  and resid   38 and name  HB1) (segid  B  and resid   38 and name  HB2) 1.968 0.484 0.484 weight 1.000 ! spec=sumo...oesy, no=938, id=1384, vol=1.087563e+01
assign (segid  B  and resid   30 and name   HN) (segid  B  and resid   30 and name  HG1) 2.789 0.973 0.973 weight 1.000 ! spec=sumo...oesy, no=939, id=743, vol=2.110070e+00
assign (segid  B  and resid    6 and name  HB1) (segid  B  and resid    9 and name  HA2) 2.753 0.948 0.948 weight 1.000 ! spec=sumo...oesy, no=941, id=1387, vol=1.449950e+00
assign (segid  B  and resid   38 and name  HB1) (segid  B  and resid   71 and name HG21) 2.705 0.914 0.914 weight 1.000 ! spec=sumo...oesy, no=942, id=1388, vol=1.613670e+00
    or (segid  B  and resid   38 and name  HB1) (segid  B  and resid   71 and name HG22)
    or (segid  B  and resid   38 and name  HB1) (segid  B  and resid   71 and name HG23)
assign (segid  B  and resid   56 and name  HB2) (segid  B  and resid   53 and name  HB2) 3.058 1.169 1.169 weight 1.000 ! spec=sumo...oesy, no=951, id=1393, vol=7.721500e-01
assign (segid  B  and resid   45 and name   HA) (segid  B  and resid   48 and name  HB2) 2.397 0.718 0.718 weight 1.000 ! spec=sumo...oesy, no=957, id=1398, vol=3.334960e+00
assign (segid  B  and resid   74 and name  HB1) (segid  B  and resid   74 and name  HB2) 1.838 0.422 0.422 weight 1.000 ! spec=sumo...oesy, no=959, id=1400, vol=1.636675e+01
assign (segid  B  and resid   74 and name   HA) (segid  B  and resid   74 and name  HB1) 2.252 0.634 0.634 weight 1.000 ! spec=sumo...oesy, no=960, id=1401, vol=4.843900e+00
assign (segid  B  and resid   76 and name  HB1) (segid  B  and resid   76 and name   HA) 2.509 0.787 0.787 weight 1.000 ! spec=sumo...oesy, no=973, id=1414, vol=2.531380e+00
assign (segid  B  and resid   80 and name  HB2) (segid  B  and resid   80 and name   HA) 2.369 0.701 0.701 weight 1.000 ! spec=sumo...oesy, no=974, id=1415, vol=3.577180e+00
assign (segid  B  and resid   80 and name  HB2) (segid  B  and resid   20 and name  HE2) 2.830 1.001 1.001 weight 1.000 ! spec=sumo...oesy, no=975, id=1416, vol=1.230090e+00
assign (segid  B  and resid   61 and name  HD1) (segid  B  and resid   62 and name  HB2) 2.891 1.044 1.044 weight 1.000 ! spec=sumo...oesy, no=1074, id=1421, vol=1.083000e+00
    or (segid  B  and resid   61 and name  HD2) (segid  B  and resid   62 and name  HB2)
assign (segid  B  and resid   60 and name  HB1) (segid  B  and resid   60 and name  HD1) 2.524 0.796 0.796 weight 1.000 ! spec=sumo...oesy, no=1093, id=1423, vol=2.443100e+00
assign (segid  B  and resid   60 and name  HB1) (segid  B  and resid   60 and name  HG1) 2.444 0.746 0.746 weight 1.000 ! spec=sumo...oesy, no=1095, id=1425, vol=2.967480e+00
assign (segid  B  and resid   60 and name  HB2) (segid  B  and resid   65 and name   HA) 3.101 1.202 1.202 weight 1.000 ! spec=sumo...oesy, no=1097, id=1427, vol=7.102600e-01
assign (segid  B  and resid   60 and name  HB1) (segid  B  and resid   60 and name  HB2) 2.039 0.520 0.520 weight 1.000 ! spec=sumo...oesy, no=1098, id=1428, vol=8.790170e+00
assign (segid  B  and resid   77 and name  HB1) (segid  B  and resid   77 and name   HA) 2.538 0.805 0.805 weight 1.000 ! spec=sumo...oesy, no=1117, id=1438, vol=2.362360e+00
assign (segid  B  and resid   77 and name  HB1) (segid  B  and resid   77 and name  HB2) 2.262 0.640 0.640 weight 1.000 ! spec=sumo...oesy, no=1118, id=1439, vol=4.717800e+00
assign (segid  B  and resid   77 and name  HB2) (segid  B  and resid   17 and name HD12) 2.928 1.072 1.072 weight 1.000 ! spec=sumo...oesy, no=1124, id=1445, vol=1.001830e+00
    or (segid  B  and resid   77 and name  HB2) (segid  B  and resid   17 and name HD11)
    or (segid  B  and resid   77 and name  HB2) (segid  B  and resid   17 and name HD13)
assign (segid  B  and resid   77 and name  HB2) (segid  B  and resid   72 and name  HB1) 2.536 0.804 0.804 weight 1.000 ! spec=sumo...oesy, no=1125, id=1446, vol=2.373450e+00
assign (segid  B  and resid   20 and name  HB1) (segid  B  and resid   20 and name  HB2) 2.063 0.532 0.532 weight 1.000 ! spec=sumo...oesy, no=1129, id=1450, vol=8.188870e+00
assign (segid  B  and resid   20 and name  HB2) (segid  B  and resid   28 and name HG22) 2.433 0.740 0.740 weight 1.000 ! spec=sumo...oesy, no=1134, id=1455, vol=3.045380e+00
    or (segid  B  and resid   20 and name  HB2) (segid  B  and resid   28 and name HG21)
    or (segid  B  and resid   20 and name  HB2) (segid  B  and resid   28 and name HG23)
assign (segid  B  and resid   85 and name   HB) (segid  B  and resid   46 and name  HD1) 3.054 1.166 1.166 weight 1.000 ! spec=sumo...oesy, no=1135, id=1456, vol=7.785000e-01
    or (segid  B  and resid   85 and name   HB) (segid  B  and resid   46 and name  HD2)
assign (segid  B  and resid   85 and name   HA) (segid  B  and resid   85 and name   HB) 2.533 0.802 0.802 weight 1.000 ! spec=sumo...oesy, no=1136, id=1457, vol=2.390380e+00
assign (segid  B  and resid   85 and name   HB) (segid  B  and resid   23 and name  HA1) 2.840 1.008 1.008 weight 1.000 ! spec=sumo...oesy, no=1137, id=1458, vol=1.204580e+00
assign (segid  B  and resid   85 and name   HB) (segid  B  and resid   23 and name  HA2) 2.951 1.088 1.088 weight 1.000 ! spec=sumo...oesy, no=1138, id=1459, vol=9.572800e-01
assign (segid  B  and resid   32 and name  HB1) (segid  B  and resid   32 and name  HG2) 2.621 0.859 0.859 weight 1.000 ! spec=sumo...oesy, no=1144, id=1465, vol=1.948290e+00
assign (segid  B  and resid   18 and name   HA) (segid  B  and resid   32 and name  HB1) 3.148 1.239 1.239 weight 1.000 ! spec=sumo...oesy, no=1145, id=1466, vol=6.488800e-01
assign (segid  B  and resid   32 and name   HA) (segid  B  and resid   32 and name  HB1) 2.405 0.723 0.723 weight 1.000 ! spec=sumo...oesy, no=1146, id=1467, vol=3.265790e+00
assign (segid  B  and resid   32 and name  HB1) (segid  B  and resid   32 and name  HG1) 2.495 0.778 0.778 weight 1.000 ! spec=sumo...oesy, no=1147, id=1468, vol=2.618450e+00
assign (segid  B  and resid   32 and name   HA) (segid  B  and resid   32 and name  HB2) 2.410 0.726 0.726 weight 1.000 ! spec=sumo...oesy, no=1148, id=1469, vol=3.226030e+00
assign (segid  B  and resid   32 and name  HB2) (segid  B  and resid   32 and name  HG2) 2.609 0.851 0.851 weight 1.000 ! spec=sumo...oesy, no=1150, id=1471, vol=2.002810e+00
assign (segid  B  and resid   72 and name   HA) (segid  B  and resid   77 and name  HG1) 2.545 0.809 0.809 weight 1.000 ! spec=sumo...oesy, no=1152, id=1473, vol=2.326480e+00
assign (segid  B  and resid   77 and name  HG1) (segid  B  and resid   72 and name  HB1) 2.292 0.656 0.656 weight 1.000 ! spec=sumo...oesy, no=1153, id=1474, vol=4.363720e+00
assign (segid  B  and resid   11 and name   HA) (segid  B  and resid   11 and name  HB1) 2.304 0.664 0.664 weight 1.000 ! spec=sumo...oesy, no=1160, id=1475, vol=4.219310e+00
assign (segid  B  and resid   78 and name  HB2) (segid  B  and resid   78 and name  HG1) 2.350 0.691 0.691 weight 1.000 ! spec=sumo...oesy, no=1161, id=1476, vol=3.748230e+00
assign (segid  B  and resid   78 and name  HB2) (segid  B  and resid   78 and name  HG2) 2.453 0.752 0.752 weight 1.000 ! spec=sumo...oesy, no=1162, id=1477, vol=2.897810e+00
assign (segid  B  and resid   11 and name  HB1) (segid  B  and resid   11 and name  HG2) 2.415 0.729 0.729 weight 1.000 ! spec=sumo...oesy, no=1163, id=1478, vol=3.184960e+00
assign (segid  B  and resid    7 and name  HB2) (segid  B  and resid    7 and name   HA) 2.523 0.796 0.796 weight 1.000 ! spec=sumo...oesy, no=1164, id=1479, vol=2.450590e+00
assign (segid  B  and resid   11 and name  HB2) (segid  B  and resid   11 and name  HE2) 2.475 0.766 0.766 weight 1.000 ! spec=sumo...oesy, no=1167, id=1482, vol=2.749040e+00
    or (segid  B  and resid   11 and name  HB2) (segid  B  and resid   11 and name  HE1)
assign (segid  B  and resid   58 and name  HB1) (segid  B  and resid   58 and name  HB2) 1.939 0.470 0.470 weight 1.000 ! spec=sumo...oesy, no=1170, id=1485, vol=1.187795e+01
assign (segid  B  and resid   50 and name   HA) (segid  B  and resid   50 and name  HG2) 2.538 0.805 0.805 weight 1.000 ! spec=sumo...oesy, no=1175, id=1489, vol=2.361710e+00
assign (segid  B  and resid   46 and name  HD1) (segid  B  and resid   50 and name  HG2) 3.014 1.135 1.135 weight 1.000 ! spec=sumo...oesy, no=1179, id=1493, vol=8.435500e-01
    or (segid  B  and resid   46 and name  HD2) (segid  B  and resid   50 and name  HG2)
assign (segid  B  and resid   58 and name   HA) (segid  B  and resid   58 and name  HB2) 2.753 0.947 0.947 weight 1.000 ! spec=sumo...oesy, no=1182, id=1495, vol=1.452260e+00
assign (segid  B  and resid   58 and name  HD2) (segid  B  and resid   58 and name  HB2) 3.005 1.129 1.129 weight 1.000 ! spec=sumo...oesy, no=1185, id=1498, vol=8.583700e-01
assign (segid  B  and resid   58 and name  HB2) (segid  B  and resid   86 and name  HB2) 3.075 1.182 1.182 weight 1.000 ! spec=sumo...oesy, no=1188, id=1501, vol=7.475300e-01
assign (segid  B  and resid   46 and name  HD1) (segid  B  and resid   21 and name   HB) 2.739 0.938 0.938 weight 1.000 ! spec=sumo...oesy, no=1192, id=1503, vol=1.495230e+00
    or (segid  B  and resid   46 and name  HD2) (segid  B  and resid   21 and name   HB)
assign (segid  B  and resid   21 and name   HB) (segid  B  and resid   29 and name HG22) 2.762 0.954 0.954 weight 1.000 ! spec=sumo...oesy, no=1194, id=1505, vol=1.422000e+00
    or (segid  B  and resid   21 and name   HB) (segid  B  and resid   29 and name HG21)
    or (segid  B  and resid   21 and name   HB) (segid  B  and resid   29 and name HG23)
assign (segid  B  and resid   46 and name  HE1) (segid  B  and resid   21 and name   HB) 2.687 0.903 0.903 weight 1.000 ! spec=sumo...oesy, no=1197, id=1508, vol=1.677370e+00
    or (segid  B  and resid   46 and name  HE2) (segid  B  and resid   21 and name   HB)
assign (segid  B  and resid   44 and name  HE1) (segid  B  and resid   44 and name  HB2) 2.591 0.839 0.839 weight 1.000 ! spec=sumo...oesy, no=1201, id=1512, vol=2.088840e+00
assign (segid  B  and resid   11 and name  HE2) (segid  B  and resid   11 and name  HB1) 2.714 0.921 0.921 weight 1.000 ! spec=sumo...oesy, no=1205, id=1516, vol=1.579610e+00
    or (segid  B  and resid   11 and name  HE1) (segid  B  and resid   11 and name  HB1)
assign (segid  B  and resid    7 and name  HB2) (segid  B  and resid    7 and name  HE2) 2.915 1.062 1.062 weight 1.000 ! spec=sumo...oesy, no=1207, id=1518, vol=1.030790e+00
    or (segid  B  and resid    7 and name  HB2) (segid  B  and resid    7 and name  HE1)
assign (segid  B  and resid   65 and name   HA) (segid  B  and resid   65 and name  HB2) 2.545 0.809 0.809 weight 1.000 ! spec=sumo...oesy, no=1213, id=1521, vol=2.327940e+00
assign (segid  B  and resid   65 and name  HB1) (segid  B  and resid   65 and name  HB2) 1.899 0.451 0.451 weight 1.000 ! spec=sumo...oesy, no=1215, id=1523, vol=1.349071e+01
assign (segid  B  and resid   65 and name  HB2) (segid  B  and resid   65 and name  HD1) 2.687 0.903 0.903 weight 1.000 ! spec=sumo...oesy, no=1216, id=1524, vol=1.677180e+00
assign (segid  B  and resid    6 and name  HB2) (segid  B  and resid    6 and name  HD2) 2.583 0.834 0.834 weight 1.000 ! spec=sumo...oesy, no=1222, id=1530, vol=2.127420e+00
assign (segid  B  and resid    6 and name  HB1) (segid  B  and resid    6 and name  HB2) 1.782 0.397 0.397 weight 1.000 ! spec=sumo...oesy, no=1223, id=1531, vol=1.975899e+01
assign (segid  B  and resid   34 and name  HB1) (segid  B  and resid   34 and name  HG1) 2.631 0.865 0.865 weight 1.000 ! spec=sumo...oesy, no=1226, id=1534, vol=1.907030e+00
assign (segid  B  and resid   72 and name  HB2) (segid  B  and resid   17 and name HD12) 3.096 1.198 1.198 weight 1.000 ! spec=sumo...oesy, no=1227, id=1535, vol=7.175300e-01
    or (segid  B  and resid   72 and name  HB2) (segid  B  and resid   17 and name HD11)
    or (segid  B  and resid   72 and name  HB2) (segid  B  and resid   17 and name HD13)
assign (segid  B  and resid   72 and name  HB2) (segid  B  and resid   35 and name   HA) 2.501 0.782 0.782 weight 1.000 ! spec=sumo...oesy, no=1228, id=1536, vol=2.581040e+00
assign (segid  B  and resid    5 and name  HB2) (segid  B  and resid    6 and name  HD1) 3.099 1.201 1.201 weight 1.000 ! spec=sumo...oesy, no=1229, id=1537, vol=7.126300e-01
assign (segid  B  and resid   34 and name  HB2) (segid  B  and resid   34 and name  HG1) 2.720 0.925 0.925 weight 1.000 ! spec=sumo...oesy, no=1230, id=1538, vol=1.561670e+00
assign (segid  B  and resid   41 and name   HA) (segid  B  and resid   41 and name  HB2) 2.203 0.607 0.607 weight 1.000 ! spec=sumo...oesy, no=1231, id=1539, vol=5.524010e+00
assign (segid  B  and resid   30 and name  HB1) (segid  B  and resid   30 and name   HA) 2.390 0.714 0.714 weight 1.000 ! spec=sumo...oesy, no=1245, id=1543, vol=3.394050e+00
assign (segid  B  and resid    8 and name  HB1) (segid  B  and resid    8 and name  HB2) 2.028 0.514 0.514 weight 1.000 ! spec=sumo...oesy, no=1246, id=1544, vol=9.076620e+00
assign (segid  B  and resid   30 and name  HB2) (segid  B  and resid   20 and name   HA) 3.093 1.196 1.196 weight 1.000 ! spec=sumo...oesy, no=1249, id=1547, vol=7.212700e-01
assign (segid  B  and resid   68 and name  HB1) (segid  B  and resid   68 and name   HA) 2.433 0.740 0.740 weight 1.000 ! spec=sumo...oesy, no=1255, id=1552, vol=3.046010e+00
assign (segid  B  and resid   50 and name  HB1) (segid  B  and resid   52 and name HD22) 2.459 0.756 0.756 weight 1.000 ! spec=sumo...oesy, no=1256, id=1553, vol=2.856570e+00
    or (segid  B  and resid   50 and name  HB1) (segid  B  and resid   52 and name HD21)
    or (segid  B  and resid   50 and name  HB1) (segid  B  and resid   52 and name HD23)
assign (segid  B  and resid   68 and name  HB2) (segid  B  and resid   68 and name   HA) 2.437 0.742 0.742 weight 1.000 ! spec=sumo...oesy, no=1257, id=1554, vol=3.015020e+00
assign (segid  B  and resid   35 and name  HB1) (segid  B  and resid   35 and name   HA) 2.836 1.005 1.005 weight 1.000 ! spec=sumo...oesy, no=1259, id=1556, vol=1.214190e+00
assign (segid  B  and resid   35 and name  HB1) (segid  B  and resid   73 and name  HB2) 2.964 1.098 1.098 weight 1.000 ! spec=sumo...oesy, no=1260, id=1557, vol=9.327400e-01
    or (segid  B  and resid   35 and name  HB1) (segid  B  and resid   73 and name  HB1)
    or (segid  B  and resid   35 and name  HB1) (segid  B  and resid   73 and name  HB3)
assign (segid  B  and resid   11 and name  HD2) (segid  B  and resid   11 and name  HE2) 1.910 0.456 0.456 weight 1.000 ! spec=sumo...oesy, no=1262, id=1559, vol=1.300958e+01
    or (segid  B  and resid   11 and name  HD2) (segid  B  and resid   11 and name  HE1)
    or (segid  B  and resid   11 and name  HD1) (segid  B  and resid   11 and name  HE2)
    or (segid  B  and resid   11 and name  HD1) (segid  B  and resid   11 and name  HE1)
assign (segid  B  and resid   11 and name  HB2) (segid  B  and resid   11 and name  HD2) 2.156 0.581 0.581 weight 1.000 ! spec=sumo...oesy, no=1263, id=1560, vol=6.282230e+00
    or (segid  B  and resid   11 and name  HB2) (segid  B  and resid   11 and name  HD1)
assign (segid  B  and resid   50 and name  HB2) (segid  B  and resid   47 and name   HA) 3.085 1.190 1.190 weight 1.000 ! spec=sumo...oesy, no=1266, id=1562, vol=7.322200e-01
assign (segid  B  and resid   50 and name  HB2) (segid  B  and resid   50 and name  HB1) 2.097 0.550 0.550 weight 1.000 ! spec=sumo...oesy, no=1267, id=1563, vol=7.427750e+00
assign (segid  B  and resid   50 and name  HB2) (segid  B  and resid   52 and name HD12) 2.473 0.764 0.764 weight 1.000 ! spec=sumo...oesy, no=1269, id=1565, vol=2.763410e+00
    or (segid  B  and resid   50 and name  HB2) (segid  B  and resid   52 and name HD11)
    or (segid  B  and resid   50 and name  HB2) (segid  B  and resid   52 and name HD13)
assign (segid  B  and resid   46 and name  HD1) (segid  B  and resid   49 and name  HB1) 2.956 1.092 1.092 weight 1.000 ! spec=sumo...oesy, no=1273, id=1566, vol=9.469300e-01
    or (segid  B  and resid   46 and name  HD2) (segid  B  and resid   49 and name  HB1)
assign (segid  B  and resid   88 and name   HA) (segid  B  and resid   88 and name  HB2) 2.308 0.666 0.666 weight 1.000 ! spec=sumo...oesy, no=1280, id=1570, vol=4.183590e+00
assign (segid  B  and resid   87 and name   HA) (segid  B  and resid   87 and name  HB2) 2.452 0.751 0.751 weight 1.000 ! spec=sumo...oesy, no=1281, id=1571, vol=2.909980e+00
assign (segid  B  and resid   55 and name  HD2) (segid  B  and resid   55 and name  HB1) 2.266 0.642 0.642 weight 1.000 ! spec=sumo...oesy, no=1284, id=1574, vol=4.671400e+00
assign (segid  B  and resid    4 and name  HB2) (segid  B  and resid   32 and name  HE2) 2.856 1.020 1.020 weight 1.000 ! spec=sumo...oesy, no=1286, id=1576, vol=1.163960e+00
assign (segid  B  and resid   55 and name  HB1) (segid  B  and resid   55 and name  HB2) 2.361 0.697 0.697 weight 1.000 ! spec=sumo...oesy, no=1287, id=1577, vol=3.652200e+00
assign (segid  B  and resid   55 and name   HA) (segid  B  and resid   55 and name  HB2) 2.179 0.594 0.594 weight 1.000 ! spec=sumo...oesy, no=1296, id=1583, vol=5.898330e+00
assign (segid  B  and resid   55 and name  HD2) (segid  B  and resid   55 and name  HB2) 2.477 0.767 0.767 weight 1.000 ! spec=sumo...oesy, no=1297, id=1584, vol=2.735160e+00
assign (segid  B  and resid   35 and name  HB1) (segid  B  and resid   13 and name  HB1) 2.562 0.821 0.821 weight 1.000 ! spec=sumo...oesy, no=1299, id=1586, vol=2.231660e+00
assign (segid  B  and resid   35 and name  HG1) (segid  B  and resid   73 and name  HB2) 3.063 1.173 1.173 weight 1.000 ! spec=sumo...oesy, no=1301, id=1588, vol=7.646700e-01
    or (segid  B  and resid   35 and name  HG1) (segid  B  and resid   73 and name  HB1)
    or (segid  B  and resid   35 and name  HG1) (segid  B  and resid   73 and name  HB3)
assign (segid  B  and resid   44 and name  HD1) (segid  B  and resid   47 and name  HB1) 2.759 0.952 0.952 weight 1.000 ! spec=sumo...oesy, no=1304, id=1589, vol=1.431430e+00
assign (segid  B  and resid   44 and name  HD1) (segid  B  and resid   48 and name  HG1) 2.547 0.811 0.811 weight 1.000 ! spec=sumo...oesy, no=1305, id=1590, vol=2.315110e+00
assign (segid  B  and resid   44 and name   HA) (segid  B  and resid   44 and name  HD1) 2.341 0.685 0.685 weight 1.000 ! spec=sumo...oesy, no=1308, id=1593, vol=3.836830e+00
assign (segid  B  and resid   39 and name   HG) (segid  B  and resid   72 and name  HD1) 2.594 0.841 0.841 weight 1.000 ! spec=sumo...oesy, no=1317, id=1602, vol=2.075420e+00
assign (segid  B  and resid   35 and name  HG1) (segid  B  and resid   35 and name  HG2) 2.133 0.569 0.569 weight 1.000 ! spec=sumo...oesy, no=1322, id=1607, vol=6.700370e+00
assign (segid  B  and resid   35 and name  HG1) (segid  B  and resid   35 and name   HA) 2.718 0.923 0.923 weight 1.000 ! spec=sumo...oesy, no=1323, id=1608, vol=1.567190e+00
assign (segid  B  and resid   35 and name  HG1) (segid  B  and resid   17 and name HG22) 2.863 1.025 1.025 weight 1.000 ! spec=sumo...oesy, no=1324, id=1609, vol=1.147330e+00
    or (segid  B  and resid   35 and name  HG1) (segid  B  and resid   17 and name HG21)
    or (segid  B  and resid   35 and name  HG1) (segid  B  and resid   17 and name HG23)
assign (segid  B  and resid   35 and name  HG1) (segid  B  and resid   17 and name HD12) 3.098 1.200 1.200 weight 1.000 ! spec=sumo...oesy, no=1325, id=1610, vol=7.142300e-01
    or (segid  B  and resid   35 and name  HG1) (segid  B  and resid   17 and name HD11)
    or (segid  B  and resid   35 and name  HG1) (segid  B  and resid   17 and name HD13)
assign (segid  B  and resid   24 and name   HA) (segid  B  and resid   24 and name  HB2) 2.258 0.637 0.637 weight 1.000 ! spec=sumo...oesy, no=1328, id=1612, vol=4.767190e+00
assign (segid  B  and resid   38 and name  HG2) (segid  B  and resid   37 and name HG21) 2.999 1.124 1.124 weight 1.000 ! spec=sumo...oesy, no=1350, id=1628, vol=8.686900e-01
    or (segid  B  and resid   38 and name  HG2) (segid  B  and resid   37 and name HG22)
    or (segid  B  and resid   38 and name  HG2) (segid  B  and resid   37 and name HG23)
assign (segid  B  and resid    5 and name  HD1) (segid  B  and resid    4 and name  HB2) 2.728 0.930 0.930 weight 1.000 ! spec=sumo...oesy, no=1351, id=1629, vol=1.532410e+00
assign (segid  B  and resid   64 and name   HA) (segid  B  and resid   65 and name  HG1) 2.773 0.961 0.961 weight 1.000 ! spec=sumo...oesy, no=1364, id=1636, vol=1.389410e+00
assign (segid  B  and resid   65 and name   HA) (segid  B  and resid   65 and name  HG1) 2.779 0.965 0.965 weight 1.000 ! spec=sumo...oesy, no=1365, id=1637, vol=1.372990e+00
assign (segid  B  and resid   37 and name   HA) (segid  B  and resid   38 and name  HG2) 2.755 0.949 0.949 weight 1.000 ! spec=sumo...oesy, no=1366, id=1638, vol=1.443700e+00
assign (segid  B  and resid   55 and name  HG2) (segid  B  and resid   54 and name  HE2) 2.519 0.793 0.793 weight 1.000 ! spec=sumo...oesy, no=1370, id=1642, vol=2.475390e+00
    or (segid  B  and resid   55 and name  HG2) (segid  B  and resid   54 and name  HE1)
    or (segid  B  and resid   55 and name  HG2) (segid  B  and resid   54 and name  HE3)
assign (segid  B  and resid   60 and name  HB2) (segid  B  and resid   60 and name  HG1) 2.226 0.619 0.619 weight 1.000 ! spec=sumo...oesy, no=1374, id=1646, vol=5.192040e+00
assign (segid  B  and resid   60 and name   HA) (segid  B  and resid   60 and name  HG2) 2.539 0.806 0.806 weight 1.000 ! spec=sumo...oesy, no=1375, id=1647, vol=2.360540e+00
assign (segid  B  and resid   65 and name   HA) (segid  B  and resid   60 and name  HG2) 2.596 0.842 0.842 weight 1.000 ! spec=sumo...oesy, no=1376, id=1648, vol=2.065000e+00
assign (segid  B  and resid   60 and name  HG2) (segid  B  and resid   60 and name  HB1) 2.480 0.769 0.769 weight 1.000 ! spec=sumo...oesy, no=1379, id=1651, vol=2.714350e+00
assign (segid  B  and resid   75 and name   HG) (segid  B  and resid   75 and name HD22) 2.168 0.587 0.587 weight 1.000 ! spec=sumo...oesy, no=1392, id=1659, vol=6.091550e+00
    or (segid  B  and resid   75 and name   HG) (segid  B  and resid   75 and name HD21)
    or (segid  B  and resid   75 and name   HG) (segid  B  and resid   75 and name HD23)
assign (segid  B  and resid   70 and name  HB2) (segid  B  and resid   75 and name   HG) 2.824 0.997 0.997 weight 1.000 ! spec=sumo...oesy, no=1393, id=1660, vol=1.245660e+00
assign (segid  B  and resid   75 and name   HG) (segid  B  and resid   75 and name HD12) 2.207 0.609 0.609 weight 1.000 ! spec=sumo...oesy, no=1395, id=1662, vol=5.462080e+00
    or (segid  B  and resid   75 and name   HG) (segid  B  and resid   75 and name HD11)
    or (segid  B  and resid   75 and name   HG) (segid  B  and resid   75 and name HD13)
assign (segid  B  and resid   55 and name  HG1) (segid  B  and resid   56 and name  HG1) 2.649 0.877 0.877 weight 1.000 ! spec=sumo...oesy, no=1402, id=1669, vol=1.826860e+00
assign (segid  B  and resid   19 and name   HA) (segid  B  and resid   19 and name   HG) 2.827 0.999 0.999 weight 1.000 ! spec=sumo...oesy, no=1407, id=1672, vol=1.236940e+00
assign (segid  B  and resid   60 and name  HG1) (segid  B  and resid   65 and name   HA) 2.882 1.038 1.038 weight 1.000 ! spec=sumo...oesy, no=1408, id=1673, vol=1.102530e+00
assign (segid  B  and resid   31 and name  HD1) (segid  B  and resid   42 and name   HG) 2.435 0.741 0.741 weight 1.000 ! spec=sumo...oesy, no=1414, id=1678, vol=3.028430e+00
    or (segid  B  and resid   31 and name  HD2) (segid  B  and resid   42 and name   HG)
assign (segid  B  and resid   42 and name   HG) (segid  B  and resid   42 and name   HA) 2.488 0.774 0.774 weight 1.000 ! spec=sumo...oesy, no=1416, id=1680, vol=2.664580e+00
assign (segid  B  and resid   31 and name  HB2) (segid  B  and resid   42 and name   HG) 2.458 0.755 0.755 weight 1.000 ! spec=sumo...oesy, no=1417, id=1681, vol=2.867090e+00
assign (segid  B  and resid   31 and name  HB1) (segid  B  and resid   42 and name   HG) 2.375 0.705 0.705 weight 1.000 ! spec=sumo...oesy, no=1418, id=1682, vol=3.524870e+00
assign (segid  B  and resid   42 and name   HG) (segid  B  and resid   42 and name HD12) 1.885 0.444 0.444 weight 1.000 ! spec=sumo...oesy, no=1422, id=1685, vol=1.406453e+01
    or (segid  B  and resid   42 and name   HG) (segid  B  and resid   42 and name HD11)
    or (segid  B  and resid   42 and name   HG) (segid  B  and resid   42 and name HD13)
assign (segid  B  and resid   49 and name  HG1) (segid  B  and resid   46 and name  HD1) 3.132 1.227 1.227 weight 1.000 ! spec=sumo...oesy, no=1425, id=1687, vol=6.688100e-01
    or (segid  B  and resid   49 and name  HG1) (segid  B  and resid   46 and name  HD2)
assign (segid  B  and resid   58 and name  HD1) (segid  B  and resid   58 and name  HG1) 2.567 0.824 0.824 weight 1.000 ! spec=sumo...oesy, no=1430, id=1691, vol=2.207270e+00
assign (segid  B  and resid   58 and name   HA) (segid  B  and resid   58 and name  HG1) 2.911 1.059 1.059 weight 1.000 ! spec=sumo...oesy, no=1432, id=1692, vol=1.037830e+00
assign (segid  B  and resid   58 and name  HD2) (segid  B  and resid   58 and name  HG1) 2.467 0.761 0.761 weight 1.000 ! spec=sumo...oesy, no=1433, id=1693, vol=2.805330e+00
assign (segid  B  and resid   58 and name   HA) (segid  B  and resid   58 and name  HG2) 2.861 1.023 1.023 weight 1.000 ! spec=sumo...oesy, no=1434, id=1694, vol=1.152750e+00
assign (segid  B  and resid   58 and name  HD1) (segid  B  and resid   58 and name  HG2) 2.510 0.787 0.787 weight 1.000 ! spec=sumo...oesy, no=1435, id=1695, vol=2.526890e+00
assign (segid  B  and resid   58 and name  HD2) (segid  B  and resid   58 and name  HG2) 2.620 0.858 0.858 weight 1.000 ! spec=sumo...oesy, no=1436, id=1696, vol=1.951720e+00
assign (segid  B  and resid   33 and name HG11) (segid  B  and resid   37 and name   HB) 2.755 0.949 0.949 weight 1.000 ! spec=sumo...oesy, no=1438, id=1698, vol=1.444000e+00
assign (segid  B  and resid   33 and name HG12) (segid  B  and resid   33 and name HG11) 1.929 0.465 0.465 weight 1.000 ! spec=sumo...oesy, no=1439, id=1699, vol=1.227522e+01
assign (segid  B  and resid   33 and name HG11) (segid  B  and resid   33 and name HD12) 2.119 0.561 0.561 weight 1.000 ! spec=sumo...oesy, no=1440, id=1700, vol=6.974050e+00
    or (segid  B  and resid   33 and name HG11) (segid  B  and resid   33 and name HD11)
    or (segid  B  and resid   33 and name HG11) (segid  B  and resid   33 and name HD13)
assign (segid  B  and resid   33 and name HG12) (segid  B  and resid   33 and name HD12) 2.318 0.672 0.672 weight 1.000 ! spec=sumo...oesy, no=1448, id=1707, vol=4.073520e+00
    or (segid  B  and resid   33 and name HG12) (segid  B  and resid   33 and name HD11)
    or (segid  B  and resid   33 and name HG12) (segid  B  and resid   33 and name HD13)
assign (segid  B  and resid   66 and name   HA) (segid  B  and resid   66 and name HG12) 2.772 0.960 0.960 weight 1.000 ! spec=sumo...oesy, no=1451, id=1709, vol=1.393350e+00
assign (segid  B  and resid   66 and name HG12) (segid  B  and resid   66 and name HD12) 2.313 0.669 0.669 weight 1.000 ! spec=sumo...oesy, no=1452, id=1710, vol=4.127500e+00
    or (segid  B  and resid   66 and name HG12) (segid  B  and resid   66 and name HD11)
    or (segid  B  and resid   66 and name HG12) (segid  B  and resid   66 and name HD13)
assign (segid  B  and resid   66 and name HG12) (segid  B  and resid   59 and name  HB1) 2.855 1.019 1.019 weight 1.000 ! spec=sumo...oesy, no=1454, id=1712, vol=1.166560e+00
assign (segid  B  and resid   31 and name  HD1) (segid  B  and resid   42 and name HD12) 3.026 1.144 1.144 weight 1.000 ! spec=sumo...oesy, no=1456, id=1714, vol=8.236700e-01
    or (segid  B  and resid   31 and name  HD1) (segid  B  and resid   42 and name HD11)
    or (segid  B  and resid   31 and name  HD1) (segid  B  and resid   42 and name HD13)
    or (segid  B  and resid   31 and name  HD2) (segid  B  and resid   42 and name HD12)
    or (segid  B  and resid   31 and name  HD2) (segid  B  and resid   42 and name HD11)
    or (segid  B  and resid   31 and name  HD2) (segid  B  and resid   42 and name HD13)
assign (segid  B  and resid   42 and name HD12) (segid  B  and resid   42 and name HD22) 2.308 0.666 0.666 weight 1.000 ! spec=sumo...oesy, no=1458, id=1716, vol=4.182270e+00
    or (segid  B  and resid   42 and name HD12) (segid  B  and resid   42 and name HD21)
    or (segid  B  and resid   42 and name HD12) (segid  B  and resid   42 and name HD23)
    or (segid  B  and resid   42 and name HD11) (segid  B  and resid   42 and name HD22)
    or (segid  B  and resid   42 and name HD11) (segid  B  and resid   42 and name HD21)
    or (segid  B  and resid   42 and name HD11) (segid  B  and resid   42 and name HD23)
    or (segid  B  and resid   42 and name HD13) (segid  B  and resid   42 and name HD22)
    or (segid  B  and resid   42 and name HD13) (segid  B  and resid   42 and name HD21)
    or (segid  B  and resid   42 and name HD13) (segid  B  and resid   42 and name HD23)
assign (segid  B  and resid   42 and name HD12) (segid  B  and resid   42 and name  HB2) 2.647 0.876 0.876 weight 1.000 ! spec=sumo...oesy, no=1461, id=1718, vol=1.835350e+00
    or (segid  B  and resid   42 and name HD11) (segid  B  and resid   42 and name  HB2)
    or (segid  B  and resid   42 and name HD13) (segid  B  and resid   42 and name  HB2)
assign (segid  B  and resid   19 and name HD12) (segid  B  and resid   72 and name  HB1) 2.660 0.885 0.885 weight 1.000 ! spec=sumo...oesy, no=1464, id=1721, vol=1.783040e+00
    or (segid  B  and resid   19 and name HD11) (segid  B  and resid   72 and name  HB1)
    or (segid  B  and resid   19 and name HD13) (segid  B  and resid   72 and name  HB1)
assign (segid  B  and resid   19 and name HD12) (segid  B  and resid   19 and name  HB2) 2.111 0.557 0.557 weight 1.000 ! spec=sumo...oesy, no=1468, id=1725, vol=7.149550e+00
    or (segid  B  and resid   19 and name HD11) (segid  B  and resid   19 and name  HB2)
    or (segid  B  and resid   19 and name HD13) (segid  B  and resid   19 and name  HB2)
assign (segid  B  and resid   19 and name HD12) (segid  B  and resid   72 and name   HA) 3.034 1.151 1.151 weight 1.000 ! spec=sumo...oesy, no=1471, id=1727, vol=8.096800e-01
    or (segid  B  and resid   19 and name HD11) (segid  B  and resid   72 and name   HA)
    or (segid  B  and resid   19 and name HD13) (segid  B  and resid   72 and name   HA)
assign (segid  B  and resid   19 and name HD12) (segid  B  and resid   77 and name  HB1) 2.525 0.797 0.797 weight 1.000 ! spec=sumo...oesy, no=1473, id=1729, vol=2.435200e+00
    or (segid  B  and resid   19 and name HD11) (segid  B  and resid   77 and name  HB1)
    or (segid  B  and resid   19 and name HD13) (segid  B  and resid   77 and name  HB1)
assign (segid  B  and resid   71 and name   HA) (segid  B  and resid   39 and name HD12) 2.792 0.975 0.975 weight 1.000 ! spec=sumo...oesy, no=1474, id=1730, vol=1.332790e+00
    or (segid  B  and resid   71 and name   HA) (segid  B  and resid   39 and name HD11)
    or (segid  B  and resid   71 and name   HA) (segid  B  and resid   39 and name HD13)
assign (segid  B  and resid   72 and name   HA) (segid  B  and resid   39 and name HD12) 2.620 0.858 0.858 weight 1.000 ! spec=sumo...oesy, no=1475, id=1731, vol=1.954010e+00
    or (segid  B  and resid   72 and name   HA) (segid  B  and resid   39 and name HD11)
    or (segid  B  and resid   72 and name   HA) (segid  B  and resid   39 and name HD13)
assign (segid  B  and resid   39 and name HD12) (segid  B  and resid   70 and name  HB2) 2.419 0.732 0.732 weight 1.000 ! spec=sumo...oesy, no=1478, id=1734, vol=3.150000e+00
    or (segid  B  and resid   39 and name HD11) (segid  B  and resid   70 and name  HB2)
    or (segid  B  and resid   39 and name HD13) (segid  B  and resid   70 and name  HB2)
assign (segid  B  and resid   39 and name HD12) (segid  B  and resid   70 and name  HB1) 2.497 0.779 0.779 weight 1.000 ! spec=sumo...oesy, no=1479, id=1735, vol=2.606860e+00
    or (segid  B  and resid   39 and name HD11) (segid  B  and resid   70 and name  HB1)
    or (segid  B  and resid   39 and name HD13) (segid  B  and resid   70 and name  HB1)
assign (segid  B  and resid   39 and name HD12) (segid  B  and resid   72 and name  HG1) 2.845 1.012 1.012 weight 1.000 ! spec=sumo...oesy, no=1481, id=1737, vol=1.192000e+00
    or (segid  B  and resid   39 and name HD11) (segid  B  and resid   72 and name  HG1)
    or (segid  B  and resid   39 and name HD13) (segid  B  and resid   72 and name  HG1)
assign (segid  B  and resid   39 and name   HG) (segid  B  and resid   39 and name HD12) 1.994 0.497 0.497 weight 1.000 ! spec=sumo...oesy, no=1484, id=1740, vol=1.005058e+01
    or (segid  B  and resid   39 and name   HG) (segid  B  and resid   39 and name HD11)
    or (segid  B  and resid   39 and name   HG) (segid  B  and resid   39 and name HD13)
assign (segid  B  and resid   39 and name HD12) (segid  B  and resid   77 and name  HE2) 2.217 0.614 0.614 weight 1.000 ! spec=sumo...oesy, no=1486, id=1742, vol=5.318750e+00
    or (segid  B  and resid   39 and name HD12) (segid  B  and resid   77 and name  HE1)
    or (segid  B  and resid   39 and name HD12) (segid  B  and resid   77 and name  HE3)
    or (segid  B  and resid   39 and name HD11) (segid  B  and resid   77 and name  HE2)
    or (segid  B  and resid   39 and name HD11) (segid  B  and resid   77 and name  HE1)
    or (segid  B  and resid   39 and name HD11) (segid  B  and resid   77 and name  HE3)
    or (segid  B  and resid   39 and name HD13) (segid  B  and resid   77 and name  HE2)
    or (segid  B  and resid   39 and name HD13) (segid  B  and resid   77 and name  HE1)
    or (segid  B  and resid   39 and name HD13) (segid  B  and resid   77 and name  HE3)
assign (segid  B  and resid   39 and name HD12) (segid  B  and resid   66 and name   HA) 3.015 1.136 1.136 weight 1.000 ! spec=sumo...oesy, no=1490, id=1745, vol=8.408900e-01
    or (segid  B  and resid   39 and name HD11) (segid  B  and resid   66 and name   HA)
    or (segid  B  and resid   39 and name HD13) (segid  B  and resid   66 and name   HA)
assign (segid  B  and resid   34 and name  HG2) (segid  B  and resid   34 and name  HG1) 2.000 0.500 0.500 weight 1.000 ! spec=sumo...oesy, no=1494, id=1748, vol=9.873950e+00
assign (segid  B  and resid   52 and name HD12) (segid  B  and resid   50 and name HE22) 2.149 0.578 0.578 weight 1.000 ! spec=sumo...oesy, no=1497, id=1751, vol=6.406730e+00
    or (segid  B  and resid   52 and name HD11) (segid  B  and resid   50 and name HE22)
    or (segid  B  and resid   52 and name HD13) (segid  B  and resid   50 and name HE22)
assign (segid  B  and resid   52 and name HD12) (segid  B  and resid   47 and name   HA) 2.499 0.781 0.781 weight 1.000 ! spec=sumo...oesy, no=1500, id=1754, vol=2.594930e+00
    or (segid  B  and resid   52 and name HD11) (segid  B  and resid   47 and name   HA)
    or (segid  B  and resid   52 and name HD13) (segid  B  and resid   47 and name   HA)
assign (segid  B  and resid   50 and name  HB1) (segid  B  and resid   52 and name HD12) 2.315 0.670 0.670 weight 1.000 ! spec=sumo...oesy, no=1501, id=1755, vol=4.101360e+00
    or (segid  B  and resid   50 and name  HB1) (segid  B  and resid   52 and name HD11)
    or (segid  B  and resid   50 and name  HB1) (segid  B  and resid   52 and name HD13)
assign (segid  B  and resid   75 and name HD12) (segid  B  and resid   66 and name   HA) 2.461 0.757 0.757 weight 1.000 ! spec=sumo...oesy, no=1505, id=1759, vol=2.847000e+00
    or (segid  B  and resid   75 and name HD11) (segid  B  and resid   66 and name   HA)
    or (segid  B  and resid   75 and name HD13) (segid  B  and resid   66 and name   HA)
assign (segid  B  and resid   70 and name  HB2) (segid  B  and resid   75 and name HD12) 2.163 0.585 0.585 weight 1.000 ! spec=sumo...oesy, no=1507, id=1761, vol=6.163230e+00
    or (segid  B  and resid   70 and name  HB2) (segid  B  and resid   75 and name HD11)
    or (segid  B  and resid   70 and name  HB2) (segid  B  and resid   75 and name HD13)
assign (segid  B  and resid   75 and name HD12) (segid  B  and resid   70 and name  HB1) 2.239 0.627 0.627 weight 1.000 ! spec=sumo...oesy, no=1509, id=1763, vol=5.010590e+00
    or (segid  B  and resid   75 and name HD11) (segid  B  and resid   70 and name  HB1)
    or (segid  B  and resid   75 and name HD13) (segid  B  and resid   70 and name  HB1)
assign (segid  B  and resid   44 and name  HG1) (segid  B  and resid   48 and name  HG1) 2.979 1.109 1.109 weight 1.000 ! spec=sumo...oesy, no=1521, id=1774, vol=9.042200e-01
assign (segid  B  and resid   41 and name  HG1) (segid  B  and resid   41 and name   HA) 2.305 0.664 0.664 weight 1.000 ! spec=sumo...oesy, no=1524, id=1777, vol=4.207580e+00
assign (segid  B  and resid   20 and name  HG1) (segid  B  and resid   30 and name  HG1) 2.776 0.963 0.963 weight 1.000 ! spec=sumo...oesy, no=1531, id=1784, vol=1.379740e+00
assign (segid  B  and resid   20 and name  HB1) (segid  B  and resid   20 and name  HG2) 2.428 0.737 0.737 weight 1.000 ! spec=sumo...oesy, no=1539, id=1792, vol=3.083000e+00
assign (segid  B  and resid   54 and name   HA) (segid  B  and resid   57 and name HG12) 2.662 0.886 0.886 weight 1.000 ! spec=sumo...oesy, no=1541, id=1794, vol=1.776540e+00
assign (segid  B  and resid   44 and name  HG2) (segid  B  and resid   48 and name  HG2) 2.889 1.043 1.043 weight 1.000 ! spec=sumo...oesy, no=1549, id=1802, vol=1.086980e+00
assign (segid  B  and resid    5 and name  HG1) (segid  B  and resid   18 and name  HB1) 2.734 0.934 0.934 weight 1.000 ! spec=sumo...oesy, no=1550, id=1803, vol=1.514020e+00
assign (segid  B  and resid   44 and name  HG2) (segid  B  and resid   48 and name  HG1) 2.851 1.016 1.016 weight 1.000 ! spec=sumo...oesy, no=1551, id=1804, vol=1.176300e+00
assign (segid  B  and resid   11 and name  HG1) (segid  B  and resid   11 and name   HA) 2.606 0.849 0.849 weight 1.000 ! spec=sumo...oesy, no=1552, id=1805, vol=2.017920e+00
assign (segid  B  and resid   11 and name  HG1) (segid  B  and resid   11 and name  HE2) 2.486 0.772 0.772 weight 1.000 ! spec=sumo...oesy, no=1553, id=1806, vol=2.679550e+00
    or (segid  B  and resid   11 and name  HG1) (segid  B  and resid   11 and name  HE1)
assign (segid  B  and resid   11 and name  HG2) (segid  B  and resid   11 and name  HE2) 2.480 0.769 0.769 weight 1.000 ! spec=sumo...oesy, no=1557, id=1809, vol=2.713170e+00
    or (segid  B  and resid   11 and name  HG2) (segid  B  and resid   11 and name  HE1)
assign (segid  B  and resid   32 and name   HA) (segid  B  and resid   32 and name  HG2) 2.693 0.907 0.907 weight 1.000 ! spec=sumo...oesy, no=1560, id=1812, vol=1.655390e+00
assign (segid  B  and resid    7 and name  HG2) (segid  B  and resid    7 and name   HA) 3.074 1.181 1.181 weight 1.000 ! spec=sumo...oesy, no=1564, id=1816, vol=7.485900e-01
assign (segid  B  and resid   32 and name  HG2) (segid  B  and resid   16 and name  HB1) 2.967 1.100 1.100 weight 1.000 ! spec=sumo...oesy, no=1565, id=1817, vol=9.268400e-01
assign (segid  B  and resid   19 and name   HA) (segid  B  and resid   19 and name HD22) 1.959 0.480 0.480 weight 1.000 ! spec=sumo...oesy, no=1567, id=1818, vol=1.116971e+01
    or (segid  B  and resid   19 and name   HA) (segid  B  and resid   19 and name HD21)
    or (segid  B  and resid   19 and name   HA) (segid  B  and resid   19 and name HD23)
assign (segid  B  and resid   81 and name  HB1) (segid  B  and resid   19 and name HD22) 2.323 0.674 0.674 weight 1.000 ! spec=sumo...oesy, no=1568, id=1819, vol=4.022720e+00
    or (segid  B  and resid   81 and name  HB1) (segid  B  and resid   19 and name HD21)
    or (segid  B  and resid   81 and name  HB1) (segid  B  and resid   19 and name HD23)
assign (segid  B  and resid   20 and name  HB1) (segid  B  and resid   19 and name HD22) 3.104 1.204 1.204 weight 1.000 ! spec=sumo...oesy, no=1570, id=1821, vol=7.069100e-01
    or (segid  B  and resid   20 and name  HB1) (segid  B  and resid   19 and name HD21)
    or (segid  B  and resid   20 and name  HB1) (segid  B  and resid   19 and name HD23)
assign (segid  B  and resid   77 and name  HB1) (segid  B  and resid   19 and name HD22) 2.345 0.688 0.688 weight 1.000 ! spec=sumo...oesy, no=1571, id=1822, vol=3.797350e+00
    or (segid  B  and resid   77 and name  HB1) (segid  B  and resid   19 and name HD21)
    or (segid  B  and resid   77 and name  HB1) (segid  B  and resid   19 and name HD23)
assign (segid  B  and resid   81 and name  HB2) (segid  B  and resid   19 and name HD22) 2.454 0.753 0.753 weight 1.000 ! spec=sumo...oesy, no=1579, id=1830, vol=2.893870e+00
    or (segid  B  and resid   81 and name  HB2) (segid  B  and resid   19 and name HD21)
    or (segid  B  and resid   81 and name  HB2) (segid  B  and resid   19 and name HD23)
assign (segid  B  and resid   19 and name HD22) (segid  B  and resid   17 and name HD12) 2.211 0.611 0.611 weight 1.000 ! spec=sumo...oesy, no=1580, id=1831, vol=5.410520e+00
    or (segid  B  and resid   19 and name HD22) (segid  B  and resid   17 and name HD11)
    or (segid  B  and resid   19 and name HD22) (segid  B  and resid   17 and name HD13)
    or (segid  B  and resid   19 and name HD21) (segid  B  and resid   17 and name HD12)
    or (segid  B  and resid   19 and name HD21) (segid  B  and resid   17 and name HD11)
    or (segid  B  and resid   19 and name HD21) (segid  B  and resid   17 and name HD13)
    or (segid  B  and resid   19 and name HD23) (segid  B  and resid   17 and name HD12)
    or (segid  B  and resid   19 and name HD23) (segid  B  and resid   17 and name HD11)
    or (segid  B  and resid   19 and name HD23) (segid  B  and resid   17 and name HD13)
assign (segid  B  and resid   71 and name   HA) (segid  B  and resid   39 and name HD22) 2.899 1.050 1.050 weight 1.000 ! spec=sumo...oesy, no=1582, id=1832, vol=1.065230e+00
    or (segid  B  and resid   71 and name   HA) (segid  B  and resid   39 and name HD21)
    or (segid  B  and resid   71 and name   HA) (segid  B  and resid   39 and name HD23)
assign (segid  B  and resid   72 and name   HA) (segid  B  and resid   39 and name HD22) 2.826 0.998 0.998 weight 1.000 ! spec=sumo...oesy, no=1583, id=1833, vol=1.241470e+00
    or (segid  B  and resid   72 and name   HA) (segid  B  and resid   39 and name HD21)
    or (segid  B  and resid   72 and name   HA) (segid  B  and resid   39 and name HD23)
assign (segid  B  and resid   39 and name HD22) (segid  B  and resid   72 and name  HG1) 2.398 0.719 0.719 weight 1.000 ! spec=sumo...oesy, no=1587, id=1837, vol=3.319470e+00
    or (segid  B  and resid   39 and name HD21) (segid  B  and resid   72 and name  HG1)
    or (segid  B  and resid   39 and name HD23) (segid  B  and resid   72 and name  HG1)
assign (segid  B  and resid   39 and name   HG) (segid  B  and resid   39 and name HD22) 1.974 0.487 0.487 weight 1.000 ! spec=sumo...oesy, no=1590, id=1840, vol=1.066911e+01
    or (segid  B  and resid   39 and name   HG) (segid  B  and resid   39 and name HD21)
    or (segid  B  and resid   39 and name   HG) (segid  B  and resid   39 and name HD23)
assign (segid  B  and resid   39 and name HD22) (segid  B  and resid   42 and name  HB2) 2.459 0.756 0.756 weight 1.000 ! spec=sumo...oesy, no=1591, id=1841, vol=2.857130e+00
    or (segid  B  and resid   39 and name HD21) (segid  B  and resid   42 and name  HB2)
    or (segid  B  and resid   39 and name HD23) (segid  B  and resid   42 and name  HB2)
assign (segid  B  and resid   39 and name HD22) (segid  B  and resid   77 and name  HE2) 2.447 0.748 0.748 weight 1.000 ! spec=sumo...oesy, no=1592, id=1842, vol=2.943060e+00
    or (segid  B  and resid   39 and name HD22) (segid  B  and resid   77 and name  HE1)
    or (segid  B  and resid   39 and name HD22) (segid  B  and resid   77 and name  HE3)
    or (segid  B  and resid   39 and name HD21) (segid  B  and resid   77 and name  HE2)
    or (segid  B  and resid   39 and name HD21) (segid  B  and resid   77 and name  HE1)
    or (segid  B  and resid   39 and name HD21) (segid  B  and resid   77 and name  HE3)
    or (segid  B  and resid   39 and name HD23) (segid  B  and resid   77 and name  HE2)
    or (segid  B  and resid   39 and name HD23) (segid  B  and resid   77 and name  HE1)
    or (segid  B  and resid   39 and name HD23) (segid  B  and resid   77 and name  HE3)
assign (segid  B  and resid   39 and name HD22) (segid  B  and resid   42 and name HD12) 2.256 0.636 0.636 weight 1.000 ! spec=sumo...oesy, no=1595, id=1845, vol=4.795890e+00
    or (segid  B  and resid   39 and name HD22) (segid  B  and resid   42 and name HD11)
    or (segid  B  and resid   39 and name HD22) (segid  B  and resid   42 and name HD13)
    or (segid  B  and resid   39 and name HD21) (segid  B  and resid   42 and name HD12)
    or (segid  B  and resid   39 and name HD21) (segid  B  and resid   42 and name HD11)
    or (segid  B  and resid   39 and name HD21) (segid  B  and resid   42 and name HD13)
    or (segid  B  and resid   39 and name HD23) (segid  B  and resid   42 and name HD12)
    or (segid  B  and resid   39 and name HD23) (segid  B  and resid   42 and name HD11)
    or (segid  B  and resid   39 and name HD23) (segid  B  and resid   42 and name HD13)
assign (segid  B  and resid   39 and name HD22) (segid  B  and resid   42 and name HD22) 2.466 0.760 0.760 weight 1.000 ! spec=sumo...oesy, no=1597, id=1847, vol=2.811310e+00
    or (segid  B  and resid   39 and name HD22) (segid  B  and resid   42 and name HD21)
    or (segid  B  and resid   39 and name HD22) (segid  B  and resid   42 and name HD23)
    or (segid  B  and resid   39 and name HD21) (segid  B  and resid   42 and name HD22)
    or (segid  B  and resid   39 and name HD21) (segid  B  and resid   42 and name HD21)
    or (segid  B  and resid   39 and name HD21) (segid  B  and resid   42 and name HD23)
    or (segid  B  and resid   39 and name HD23) (segid  B  and resid   42 and name HD22)
    or (segid  B  and resid   39 and name HD23) (segid  B  and resid   42 and name HD21)
    or (segid  B  and resid   39 and name HD23) (segid  B  and resid   42 and name HD23)
assign (segid  B  and resid   31 and name  HD1) (segid  B  and resid   42 and name HD22) 2.472 0.764 0.764 weight 1.000 ! spec=sumo...oesy, no=1604, id=1848, vol=2.769850e+00
    or (segid  B  and resid   31 and name  HD1) (segid  B  and resid   42 and name HD21)
    or (segid  B  and resid   31 and name  HD1) (segid  B  and resid   42 and name HD23)
    or (segid  B  and resid   31 and name  HD2) (segid  B  and resid   42 and name HD22)
    or (segid  B  and resid   31 and name  HD2) (segid  B  and resid   42 and name HD21)
    or (segid  B  and resid   31 and name  HD2) (segid  B  and resid   42 and name HD23)
assign (segid  B  and resid   42 and name HD22) (segid  B  and resid   59 and name  HD1) 2.620 0.858 0.858 weight 1.000 ! spec=sumo...oesy, no=1605, id=1849, vol=1.954170e+00
    or (segid  B  and resid   42 and name HD22) (segid  B  and resid   59 and name  HD2)
    or (segid  B  and resid   42 and name HD21) (segid  B  and resid   59 and name  HD1)
    or (segid  B  and resid   42 and name HD21) (segid  B  and resid   59 and name  HD2)
    or (segid  B  and resid   42 and name HD23) (segid  B  and resid   59 and name  HD1)
    or (segid  B  and resid   42 and name HD23) (segid  B  and resid   59 and name  HD2)
assign (segid  B  and resid   59 and name  HE1) (segid  B  and resid   42 and name HD22) 2.646 0.875 0.875 weight 1.000 ! spec=sumo...oesy, no=1606, id=1850, vol=1.841310e+00
    or (segid  B  and resid   59 and name  HE1) (segid  B  and resid   42 and name HD21)
    or (segid  B  and resid   59 and name  HE1) (segid  B  and resid   42 and name HD23)
    or (segid  B  and resid   59 and name  HE2) (segid  B  and resid   42 and name HD22)
    or (segid  B  and resid   59 and name  HE2) (segid  B  and resid   42 and name HD21)
    or (segid  B  and resid   59 and name  HE2) (segid  B  and resid   42 and name HD23)
assign (segid  B  and resid   42 and name HD22) (segid  B  and resid   42 and name   HA) 2.518 0.792 0.792 weight 1.000 ! spec=sumo...oesy, no=1609, id=1853, vol=2.480940e+00
    or (segid  B  and resid   42 and name HD21) (segid  B  and resid   42 and name   HA)
    or (segid  B  and resid   42 and name HD23) (segid  B  and resid   42 and name   HA)
assign (segid  B  and resid   42 and name HD22) (segid  B  and resid   42 and name  HB1) 2.130 0.567 0.567 weight 1.000 ! spec=sumo...oesy, no=1616, id=1858, vol=6.772670e+00
    or (segid  B  and resid   42 and name HD21) (segid  B  and resid   42 and name  HB1)
    or (segid  B  and resid   42 and name HD23) (segid  B  and resid   42 and name  HB1)
assign (segid  B  and resid   42 and name HD22) (segid  B  and resid   83 and name HG22) 2.559 0.819 0.819 weight 1.000 ! spec=sumo...oesy, no=1619, id=1861, vol=2.247520e+00
    or (segid  B  and resid   42 and name HD22) (segid  B  and resid   83 and name HG21)
    or (segid  B  and resid   42 and name HD22) (segid  B  and resid   83 and name HG23)
    or (segid  B  and resid   42 and name HD21) (segid  B  and resid   83 and name HG22)
    or (segid  B  and resid   42 and name HD21) (segid  B  and resid   83 and name HG21)
    or (segid  B  and resid   42 and name HD21) (segid  B  and resid   83 and name HG23)
    or (segid  B  and resid   42 and name HD23) (segid  B  and resid   83 and name HG22)
    or (segid  B  and resid   42 and name HD23) (segid  B  and resid   83 and name HG21)
    or (segid  B  and resid   42 and name HD23) (segid  B  and resid   83 and name HG23)
assign (segid  B  and resid   42 and name HD22) (segid  B  and resid   42 and name   HG) 1.925 0.463 0.463 weight 1.000 ! spec=sumo...oesy, no=1622, id=1864, vol=1.241985e+01
    or (segid  B  and resid   42 and name HD21) (segid  B  and resid   42 and name   HG)
    or (segid  B  and resid   42 and name HD23) (segid  B  and resid   42 and name   HG)
assign (segid  B  and resid   52 and name HD22) (segid  B  and resid   24 and name  HG1) 3.142 1.234 1.234 weight 1.000 ! spec=sumo...oesy, no=1626, id=1865, vol=6.567500e-01
    or (segid  B  and resid   52 and name HD21) (segid  B  and resid   24 and name  HG1)
    or (segid  B  and resid   52 and name HD23) (segid  B  and resid   24 and name  HG1)
assign (segid  B  and resid   29 and name HG12) (segid  B  and resid   29 and name HG22) 1.759 0.387 0.387 weight 1.000 ! spec=sumo...oesy, no=1629, id=1868, vol=2.131977e+01
    or (segid  B  and resid   29 and name HG12) (segid  B  and resid   29 and name HG21)
    or (segid  B  and resid   29 and name HG12) (segid  B  and resid   29 and name HG23)
    or (segid  B  and resid   29 and name HG11) (segid  B  and resid   29 and name HG22)
    or (segid  B  and resid   29 and name HG11) (segid  B  and resid   29 and name HG21)
    or (segid  B  and resid   29 and name HG11) (segid  B  and resid   29 and name HG23)
    or (segid  B  and resid   29 and name HG13) (segid  B  and resid   29 and name HG22)
    or (segid  B  and resid   29 and name HG13) (segid  B  and resid   29 and name HG21)
    or (segid  B  and resid   29 and name HG13) (segid  B  and resid   29 and name HG23)
assign (segid  B  and resid   82 and name   HA) (segid  B  and resid   82 and name HG21) 1.935 0.468 0.468 weight 1.000 ! spec=sumo...oesy, no=1634, id=1869, vol=1.203859e+01
    or (segid  B  and resid   82 and name   HA) (segid  B  and resid   82 and name HG22)
    or (segid  B  and resid   82 and name   HA) (segid  B  and resid   82 and name HG23)
assign (segid  B  and resid   82 and name   HB) (segid  B  and resid   82 and name HG21) 1.764 0.389 0.389 weight 1.000 ! spec=sumo...oesy, no=1636, id=1871, vol=2.096004e+01
    or (segid  B  and resid   82 and name   HB) (segid  B  and resid   82 and name HG22)
    or (segid  B  and resid   82 and name   HB) (segid  B  and resid   82 and name HG23)
assign (segid  B  and resid   82 and name HG21) (segid  B  and resid   83 and name   HB) 2.971 1.103 1.103 weight 1.000 ! spec=sumo...oesy, no=1637, id=1872, vol=9.190900e-01
    or (segid  B  and resid   82 and name HG22) (segid  B  and resid   83 and name   HB)
    or (segid  B  and resid   82 and name HG23) (segid  B  and resid   83 and name   HB)
assign (segid  B  and resid   82 and name HG21) (segid  B  and resid   22 and name  HB2) 1.746 0.381 0.381 weight 1.000 ! spec=sumo...oesy, no=1639, id=1874, vol=2.233114e+01
    or (segid  B  and resid   82 and name HG21) (segid  B  and resid   22 and name  HB1)
    or (segid  B  and resid   82 and name HG21) (segid  B  and resid   22 and name  HB3)
    or (segid  B  and resid   82 and name HG22) (segid  B  and resid   22 and name  HB2)
    or (segid  B  and resid   82 and name HG22) (segid  B  and resid   22 and name  HB1)
    or (segid  B  and resid   82 and name HG22) (segid  B  and resid   22 and name  HB3)
    or (segid  B  and resid   82 and name HG23) (segid  B  and resid   22 and name  HB2)
    or (segid  B  and resid   82 and name HG23) (segid  B  and resid   22 and name  HB1)
    or (segid  B  and resid   82 and name HG23) (segid  B  and resid   22 and name  HB3)
assign (segid  B  and resid   82 and name HG21) (segid  B  and resid   20 and name  HE1) 2.923 1.068 1.068 weight 1.000 ! spec=sumo...oesy, no=1642, id=1877, vol=1.012920e+00
    or (segid  B  and resid   82 and name HG22) (segid  B  and resid   20 and name  HE1)
    or (segid  B  and resid   82 and name HG23) (segid  B  and resid   20 and name  HE1)
assign (segid  B  and resid   75 and name HD22) (segid  B  and resid   70 and name   HA) 3.021 1.141 1.141 weight 1.000 ! spec=sumo...oesy, no=1646, id=1880, vol=8.312800e-01
    or (segid  B  and resid   75 and name HD21) (segid  B  and resid   70 and name   HA)
    or (segid  B  and resid   75 and name HD23) (segid  B  and resid   70 and name   HA)
assign (segid  B  and resid   75 and name   HA) (segid  B  and resid   75 and name HD22) 1.798 0.404 0.404 weight 1.000 ! spec=sumo...oesy, no=1648, id=1882, vol=1.871620e+01
    or (segid  B  and resid   75 and name   HA) (segid  B  and resid   75 and name HD21)
    or (segid  B  and resid   75 and name   HA) (segid  B  and resid   75 and name HD23)
assign (segid  B  and resid   75 and name HD22) (segid  B  and resid   70 and name  HB2) 2.512 0.789 0.789 weight 1.000 ! spec=sumo...oesy, no=1649, id=1883, vol=2.512640e+00
    or (segid  B  and resid   75 and name HD21) (segid  B  and resid   70 and name  HB2)
    or (segid  B  and resid   75 and name HD23) (segid  B  and resid   70 and name  HB2)
assign (segid  B  and resid   75 and name HD22) (segid  B  and resid   70 and name  HB1) 2.220 0.616 0.616 weight 1.000 ! spec=sumo...oesy, no=1650, id=1884, vol=5.281150e+00
    or (segid  B  and resid   75 and name HD21) (segid  B  and resid   70 and name  HB1)
    or (segid  B  and resid   75 and name HD23) (segid  B  and resid   70 and name  HB1)
assign (segid  B  and resid   74 and name  HB2) (segid  B  and resid   75 and name HD22) 2.343 0.686 0.686 weight 1.000 ! spec=sumo...oesy, no=1651, id=1885, vol=3.815200e+00
    or (segid  B  and resid   74 and name  HB2) (segid  B  and resid   75 and name HD21)
    or (segid  B  and resid   74 and name  HB2) (segid  B  and resid   75 and name HD23)
assign (segid  B  and resid   52 and name HD22) (segid  B  and resid   87 and name HE21) 2.580 0.832 0.832 weight 1.000 ! spec=sumo...oesy, no=1654, id=1888, vol=2.141980e+00
    or (segid  B  and resid   52 and name HD21) (segid  B  and resid   87 and name HE21)
    or (segid  B  and resid   52 and name HD23) (segid  B  and resid   87 and name HE21)
assign (segid  B  and resid   52 and name HD22) (segid  B  and resid   52 and name   HA) 1.928 0.465 0.465 weight 1.000 ! spec=sumo...oesy, no=1655, id=1889, vol=1.231110e+01
    or (segid  B  and resid   52 and name HD21) (segid  B  and resid   52 and name   HA)
    or (segid  B  and resid   52 and name HD23) (segid  B  and resid   52 and name   HA)
assign (segid  B  and resid   52 and name HD22) (segid  B  and resid   50 and name HE22) 2.554 0.815 0.815 weight 1.000 ! spec=sumo...oesy, no=1660, id=1894, vol=2.277840e+00
    or (segid  B  and resid   52 and name HD21) (segid  B  and resid   50 and name HE22)
    or (segid  B  and resid   52 and name HD23) (segid  B  and resid   50 and name HE22)
assign (segid  B  and resid   49 and name  HD2) (segid  B  and resid   29 and name HG12) 2.390 0.714 0.714 weight 1.000 ! spec=sumo...oesy, no=1662, id=1896, vol=3.391680e+00
    or (segid  B  and resid   49 and name  HD2) (segid  B  and resid   29 and name HG11)
    or (segid  B  and resid   49 and name  HD2) (segid  B  and resid   29 and name HG13)
assign (segid  B  and resid   85 and name HG22) (segid  B  and resid   83 and name HG22) 2.577 0.830 0.830 weight 1.000 ! spec=sumo...oesy, no=1665, id=1898, vol=2.155360e+00
    or (segid  B  and resid   85 and name HG22) (segid  B  and resid   83 and name HG21)
    or (segid  B  and resid   85 and name HG22) (segid  B  and resid   83 and name HG23)
    or (segid  B  and resid   85 and name HG21) (segid  B  and resid   83 and name HG22)
    or (segid  B  and resid   85 and name HG21) (segid  B  and resid   83 and name HG21)
    or (segid  B  and resid   85 and name HG21) (segid  B  and resid   83 and name HG23)
    or (segid  B  and resid   85 and name HG23) (segid  B  and resid   83 and name HG22)
    or (segid  B  and resid   85 and name HG23) (segid  B  and resid   83 and name HG21)
    or (segid  B  and resid   85 and name HG23) (segid  B  and resid   83 and name HG23)
assign (segid  B  and resid   46 and name  HD1) (segid  B  and resid   21 and name HG12) 2.307 0.665 0.665 weight 1.000 ! spec=sumo...oesy, no=1670, id=1901, vol=4.190980e+00
    or (segid  B  and resid   46 and name  HD1) (segid  B  and resid   21 and name HG11)
    or (segid  B  and resid   46 and name  HD1) (segid  B  and resid   21 and name HG13)
    or (segid  B  and resid   46 and name  HD2) (segid  B  and resid   21 and name HG12)
    or (segid  B  and resid   46 and name  HD2) (segid  B  and resid   21 and name HG11)
    or (segid  B  and resid   46 and name  HD2) (segid  B  and resid   21 and name HG13)
assign (segid  B  and resid   59 and name  HE1) (segid  B  and resid   21 and name HG12) 2.407 0.724 0.724 weight 1.000 ! spec=sumo...oesy, no=1671, id=1902, vol=3.252270e+00
    or (segid  B  and resid   59 and name  HE1) (segid  B  and resid   21 and name HG11)
    or (segid  B  and resid   59 and name  HE1) (segid  B  and resid   21 and name HG13)
    or (segid  B  and resid   59 and name  HE2) (segid  B  and resid   21 and name HG12)
    or (segid  B  and resid   59 and name  HE2) (segid  B  and resid   21 and name HG11)
    or (segid  B  and resid   59 and name  HE2) (segid  B  and resid   21 and name HG13)
assign (segid  B  and resid   21 and name HG12) (segid  B  and resid   22 and name   HA) 3.129 1.224 1.224 weight 1.000 ! spec=sumo...oesy, no=1673, id=1904, vol=6.726900e-01
    or (segid  B  and resid   21 and name HG11) (segid  B  and resid   22 and name   HA)
    or (segid  B  and resid   21 and name HG13) (segid  B  and resid   22 and name   HA)
assign (segid  B  and resid   21 and name   HA) (segid  B  and resid   21 and name HG12) 2.060 0.531 0.531 weight 1.000 ! spec=sumo...oesy, no=1674, id=1905, vol=8.263530e+00
    or (segid  B  and resid   21 and name   HA) (segid  B  and resid   21 and name HG11)
    or (segid  B  and resid   21 and name   HA) (segid  B  and resid   21 and name HG13)
assign (segid  B  and resid   21 and name   HB) (segid  B  and resid   21 and name HG12) 1.957 0.479 0.479 weight 1.000 ! spec=sumo...oesy, no=1675, id=1906, vol=1.125974e+01
    or (segid  B  and resid   21 and name   HB) (segid  B  and resid   21 and name HG11)
    or (segid  B  and resid   21 and name   HB) (segid  B  and resid   21 and name HG13)
assign (segid  B  and resid   21 and name HG12) (segid  B  and resid   83 and name   HB) 2.623 0.860 0.860 weight 1.000 ! spec=sumo...oesy, no=1676, id=1907, vol=1.941260e+00
    or (segid  B  and resid   21 and name HG11) (segid  B  and resid   83 and name   HB)
    or (segid  B  and resid   21 and name HG13) (segid  B  and resid   83 and name   HB)
assign (segid  B  and resid   85 and name   HB) (segid  B  and resid   21 and name HG12) 2.533 0.802 0.802 weight 1.000 ! spec=sumo...oesy, no=1677, id=1908, vol=2.389770e+00
    or (segid  B  and resid   85 and name   HB) (segid  B  and resid   21 and name HG11)
    or (segid  B  and resid   85 and name   HB) (segid  B  and resid   21 and name HG13)
assign (segid  B  and resid   21 and name HG12) (segid  B  and resid   29 and name HG22) 2.614 0.854 0.854 weight 1.000 ! spec=sumo...oesy, no=1679, id=1910, vol=1.979660e+00
    or (segid  B  and resid   21 and name HG12) (segid  B  and resid   29 and name HG21)
    or (segid  B  and resid   21 and name HG12) (segid  B  and resid   29 and name HG23)
    or (segid  B  and resid   21 and name HG11) (segid  B  and resid   29 and name HG22)
    or (segid  B  and resid   21 and name HG11) (segid  B  and resid   29 and name HG21)
    or (segid  B  and resid   21 and name HG11) (segid  B  and resid   29 and name HG23)
    or (segid  B  and resid   21 and name HG13) (segid  B  and resid   29 and name HG22)
    or (segid  B  and resid   21 and name HG13) (segid  B  and resid   29 and name HG21)
    or (segid  B  and resid   21 and name HG13) (segid  B  and resid   29 and name HG23)
assign (segid  B  and resid   21 and name HG12) (segid  B  and resid   83 and name HG22) 2.430 0.738 0.738 weight 1.000 ! spec=sumo...oesy, no=1680, id=1911, vol=3.069460e+00
    or (segid  B  and resid   21 and name HG12) (segid  B  and resid   83 and name HG21)
    or (segid  B  and resid   21 and name HG12) (segid  B  and resid   83 and name HG23)
    or (segid  B  and resid   21 and name HG11) (segid  B  and resid   83 and name HG22)
    or (segid  B  and resid   21 and name HG11) (segid  B  and resid   83 and name HG21)
    or (segid  B  and resid   21 and name HG11) (segid  B  and resid   83 and name HG23)
    or (segid  B  and resid   21 and name HG13) (segid  B  and resid   83 and name HG22)
    or (segid  B  and resid   21 and name HG13) (segid  B  and resid   83 and name HG21)
    or (segid  B  and resid   21 and name HG13) (segid  B  and resid   83 and name HG23)
assign (segid  B  and resid   21 and name HG12) (segid  B  and resid   21 and name HG22) 1.790 0.401 0.401 weight 1.000 ! spec=sumo...oesy, no=1681, id=1912, vol=1.920313e+01
    or (segid  B  and resid   21 and name HG12) (segid  B  and resid   21 and name HG21)
    or (segid  B  and resid   21 and name HG12) (segid  B  and resid   21 and name HG23)
    or (segid  B  and resid   21 and name HG11) (segid  B  and resid   21 and name HG22)
    or (segid  B  and resid   21 and name HG11) (segid  B  and resid   21 and name HG21)
    or (segid  B  and resid   21 and name HG11) (segid  B  and resid   21 and name HG23)
    or (segid  B  and resid   21 and name HG13) (segid  B  and resid   21 and name HG22)
    or (segid  B  and resid   21 and name HG13) (segid  B  and resid   21 and name HG21)
    or (segid  B  and resid   21 and name HG13) (segid  B  and resid   21 and name HG23)
assign (segid  B  and resid   21 and name HG12) (segid  B  and resid   83 and name HD12) 2.939 1.080 1.080 weight 1.000 ! spec=sumo...oesy, no=1682, id=1913, vol=9.798500e-01
    or (segid  B  and resid   21 and name HG12) (segid  B  and resid   83 and name HD11)
    or (segid  B  and resid   21 and name HG12) (segid  B  and resid   83 and name HD13)
    or (segid  B  and resid   21 and name HG11) (segid  B  and resid   83 and name HD12)
    or (segid  B  and resid   21 and name HG11) (segid  B  and resid   83 and name HD11)
    or (segid  B  and resid   21 and name HG11) (segid  B  and resid   83 and name HD13)
    or (segid  B  and resid   21 and name HG13) (segid  B  and resid   83 and name HD12)
    or (segid  B  and resid   21 and name HG13) (segid  B  and resid   83 and name HD11)
    or (segid  B  and resid   21 and name HG13) (segid  B  and resid   83 and name HD13)
assign (segid  B  and resid   21 and name HG12) (segid  B  and resid   85 and name HG22) 1.940 0.470 0.470 weight 1.000 ! spec=sumo...oesy, no=1684, id=1915, vol=1.185584e+01
    or (segid  B  and resid   21 and name HG12) (segid  B  and resid   85 and name HG21)
    or (segid  B  and resid   21 and name HG12) (segid  B  and resid   85 and name HG23)
    or (segid  B  and resid   21 and name HG11) (segid  B  and resid   85 and name HG22)
    or (segid  B  and resid   21 and name HG11) (segid  B  and resid   85 and name HG21)
    or (segid  B  and resid   21 and name HG11) (segid  B  and resid   85 and name HG23)
    or (segid  B  and resid   21 and name HG13) (segid  B  and resid   85 and name HG22)
    or (segid  B  and resid   21 and name HG13) (segid  B  and resid   85 and name HG21)
    or (segid  B  and resid   21 and name HG13) (segid  B  and resid   85 and name HG23)
assign (segid  B  and resid   37 and name   HA) (segid  B  and resid   37 and name HG21) 2.197 0.604 0.604 weight 1.000 ! spec=sumo...oesy, no=1686, id=1916, vol=5.612020e+00
    or (segid  B  and resid   37 and name   HA) (segid  B  and resid   37 and name HG22)
    or (segid  B  and resid   37 and name   HA) (segid  B  and resid   37 and name HG23)
assign (segid  B  and resid   37 and name   HB) (segid  B  and resid   37 and name HG21) 1.914 0.458 0.458 weight 1.000 ! spec=sumo...oesy, no=1687, id=1917, vol=1.285181e+01
    or (segid  B  and resid   37 and name   HB) (segid  B  and resid   37 and name HG22)
    or (segid  B  and resid   37 and name   HB) (segid  B  and resid   37 and name HG23)
assign (segid  B  and resid   37 and name HG21) (segid  B  and resid   41 and name  HD1) 2.015 0.507 0.507 weight 1.000 ! spec=sumo...oesy, no=1691, id=1921, vol=9.441070e+00
    or (segid  B  and resid   37 and name HG22) (segid  B  and resid   41 and name  HD1)
    or (segid  B  and resid   37 and name HG23) (segid  B  and resid   41 and name  HD1)
assign (segid  B  and resid   37 and name HG21) (segid  B  and resid   33 and name HD12) 2.320 0.673 0.673 weight 1.000 ! spec=sumo...oesy, no=1692, id=1922, vol=4.047930e+00
    or (segid  B  and resid   37 and name HG21) (segid  B  and resid   33 and name HD11)
    or (segid  B  and resid   37 and name HG21) (segid  B  and resid   33 and name HD13)
    or (segid  B  and resid   37 and name HG22) (segid  B  and resid   33 and name HD12)
    or (segid  B  and resid   37 and name HG22) (segid  B  and resid   33 and name HD11)
    or (segid  B  and resid   37 and name HG22) (segid  B  and resid   33 and name HD13)
    or (segid  B  and resid   37 and name HG23) (segid  B  and resid   33 and name HD12)
    or (segid  B  and resid   37 and name HG23) (segid  B  and resid   33 and name HD11)
    or (segid  B  and resid   37 and name HG23) (segid  B  and resid   33 and name HD13)
assign (segid  B  and resid   90 and name HG21) (segid  B  and resid   88 and name  HB1) 2.677 0.896 0.896 weight 1.000 ! spec=sumo...oesy, no=1710, id=1928, vol=1.716480e+00
    or (segid  B  and resid   90 and name HG22) (segid  B  and resid   88 and name  HB1)
    or (segid  B  and resid   90 and name HG23) (segid  B  and resid   88 and name  HB1)
assign (segid  B  and resid   12 and name HG21) (segid  B  and resid   11 and name  HB1) 2.750 0.945 0.945 weight 1.000 ! spec=sumo...oesy, no=1711, id=1929, vol=1.460060e+00
    or (segid  B  and resid   12 and name HG22) (segid  B  and resid   11 and name  HB1)
    or (segid  B  and resid   12 and name HG23) (segid  B  and resid   11 and name  HB1)
assign (segid  B  and resid   12 and name HG21) (segid  B  and resid   11 and name  HB2) 2.741 0.939 0.939 weight 1.000 ! spec=sumo...oesy, no=1712, id=1930, vol=1.488390e+00
    or (segid  B  and resid   12 and name HG22) (segid  B  and resid   11 and name  HB2)
    or (segid  B  and resid   12 and name HG23) (segid  B  and resid   11 and name  HB2)
assign (segid  B  and resid   74 and name  HB1) (segid  B  and resid   75 and name HD22) 2.675 0.894 0.894 weight 1.000 ! spec=sumo...oesy, no=1716, id=1934, vol=1.724950e+00
    or (segid  B  and resid   74 and name  HB1) (segid  B  and resid   75 and name HD21)
    or (segid  B  and resid   74 and name  HB1) (segid  B  and resid   75 and name HD23)
assign (segid  B  and resid   28 and name   HA) (segid  B  and resid   28 and name HG22) 1.924 0.462 0.462 weight 1.000 ! spec=sumo...oesy, no=1720, id=1937, vol=1.247346e+01
    or (segid  B  and resid   28 and name   HA) (segid  B  and resid   28 and name HG21)
    or (segid  B  and resid   28 and name   HA) (segid  B  and resid   28 and name HG23)
assign (segid  B  and resid   28 and name HG22) (segid  B  and resid   29 and name   HA) 2.659 0.884 0.884 weight 1.000 ! spec=sumo...oesy, no=1721, id=1938, vol=1.786890e+00
    or (segid  B  and resid   28 and name HG21) (segid  B  and resid   29 and name   HA)
    or (segid  B  and resid   28 and name HG23) (segid  B  and resid   29 and name   HA)
assign (segid  B  and resid   20 and name  HE1) (segid  B  and resid   28 and name HG22) 2.477 0.767 0.767 weight 1.000 ! spec=sumo...oesy, no=1722, id=1939, vol=2.733740e+00
    or (segid  B  and resid   20 and name  HE1) (segid  B  and resid   28 and name HG21)
    or (segid  B  and resid   20 and name  HE1) (segid  B  and resid   28 and name HG23)
assign (segid  B  and resid   28 and name   HB) (segid  B  and resid   28 and name HG22) 1.741 0.379 0.379 weight 1.000 ! spec=sumo...oesy, no=1724, id=1941, vol=2.267856e+01
    or (segid  B  and resid   28 and name   HB) (segid  B  and resid   28 and name HG21)
    or (segid  B  and resid   28 and name   HB) (segid  B  and resid   28 and name HG23)
assign (segid  B  and resid   28 and name HG22) (segid  B  and resid   20 and name  HG1) 2.078 0.540 0.540 weight 1.000 ! spec=sumo...oesy, no=1726, id=1943, vol=7.838580e+00
    or (segid  B  and resid   28 and name HG21) (segid  B  and resid   20 and name  HG1)
    or (segid  B  and resid   28 and name HG23) (segid  B  and resid   20 and name  HG1)
assign (segid  B  and resid   31 and name  HB1) (segid  B  and resid   21 and name HG22) 3.008 1.131 1.131 weight 1.000 ! spec=sumo...oesy, no=1727, id=1944, vol=8.529100e-01
    or (segid  B  and resid   31 and name  HB1) (segid  B  and resid   21 and name HG21)
    or (segid  B  and resid   31 and name  HB1) (segid  B  and resid   21 and name HG23)
assign (segid  B  and resid   31 and name  HD1) (segid  B  and resid   21 and name HG22) 2.059 0.530 0.530 weight 1.000 ! spec=sumo...oesy, no=1729, id=1946, vol=8.301620e+00
    or (segid  B  and resid   31 and name  HD1) (segid  B  and resid   21 and name HG21)
    or (segid  B  and resid   31 and name  HD1) (segid  B  and resid   21 and name HG23)
    or (segid  B  and resid   31 and name  HD2) (segid  B  and resid   21 and name HG22)
    or (segid  B  and resid   31 and name  HD2) (segid  B  and resid   21 and name HG21)
    or (segid  B  and resid   31 and name  HD2) (segid  B  and resid   21 and name HG23)
assign (segid  B  and resid   59 and name  HE1) (segid  B  and resid   21 and name HG22) 2.925 1.069 1.069 weight 1.000 ! spec=sumo...oesy, no=1730, id=1947, vol=1.009240e+00
    or (segid  B  and resid   59 and name  HE1) (segid  B  and resid   21 and name HG21)
    or (segid  B  and resid   59 and name  HE1) (segid  B  and resid   21 and name HG23)
    or (segid  B  and resid   59 and name  HE2) (segid  B  and resid   21 and name HG22)
    or (segid  B  and resid   59 and name  HE2) (segid  B  and resid   21 and name HG21)
    or (segid  B  and resid   59 and name  HE2) (segid  B  and resid   21 and name HG23)
assign (segid  B  and resid   21 and name   HB) (segid  B  and resid   21 and name HG22) 1.949 0.475 0.475 weight 1.000 ! spec=sumo...oesy, no=1736, id=1953, vol=1.151906e+01
    or (segid  B  and resid   21 and name   HB) (segid  B  and resid   21 and name HG21)
    or (segid  B  and resid   21 and name   HB) (segid  B  and resid   21 and name HG23)
assign (segid  B  and resid   21 and name HG22) (segid  B  and resid   83 and name   HB) 2.265 0.641 0.641 weight 1.000 ! spec=sumo...oesy, no=1737, id=1954, vol=4.682750e+00
    or (segid  B  and resid   21 and name HG21) (segid  B  and resid   83 and name   HB)
    or (segid  B  and resid   21 and name HG23) (segid  B  and resid   83 and name   HB)
assign (segid  B  and resid   42 and name HD22) (segid  B  and resid   21 and name HG22) 2.175 0.591 0.591 weight 1.000 ! spec=sumo...oesy, no=1741, id=1958, vol=5.973730e+00
    or (segid  B  and resid   42 and name HD22) (segid  B  and resid   21 and name HG21)
    or (segid  B  and resid   42 and name HD22) (segid  B  and resid   21 and name HG23)
    or (segid  B  and resid   42 and name HD21) (segid  B  and resid   21 and name HG22)
    or (segid  B  and resid   42 and name HD21) (segid  B  and resid   21 and name HG21)
    or (segid  B  and resid   42 and name HD21) (segid  B  and resid   21 and name HG23)
    or (segid  B  and resid   42 and name HD23) (segid  B  and resid   21 and name HG22)
    or (segid  B  and resid   42 and name HD23) (segid  B  and resid   21 and name HG21)
    or (segid  B  and resid   42 and name HD23) (segid  B  and resid   21 and name HG23)
assign (segid  B  and resid   46 and name  HD1) (segid  B  and resid   85 and name HG12) 2.468 0.761 0.761 weight 1.000 ! spec=sumo...oesy, no=1743, id=1960, vol=2.797150e+00
    or (segid  B  and resid   46 and name  HD1) (segid  B  and resid   85 and name HG11)
    or (segid  B  and resid   46 and name  HD1) (segid  B  and resid   85 and name HG13)
    or (segid  B  and resid   46 and name  HD2) (segid  B  and resid   85 and name HG12)
    or (segid  B  and resid   46 and name  HD2) (segid  B  and resid   85 and name HG11)
    or (segid  B  and resid   46 and name  HD2) (segid  B  and resid   85 and name HG13)
assign (segid  B  and resid   59 and name  HE1) (segid  B  and resid   85 and name HG12) 2.752 0.947 0.947 weight 1.000 ! spec=sumo...oesy, no=1744, id=1961, vol=1.453970e+00
    or (segid  B  and resid   59 and name  HE1) (segid  B  and resid   85 and name HG11)
    or (segid  B  and resid   59 and name  HE1) (segid  B  and resid   85 and name HG13)
    or (segid  B  and resid   59 and name  HE2) (segid  B  and resid   85 and name HG12)
    or (segid  B  and resid   59 and name  HE2) (segid  B  and resid   85 and name HG11)
    or (segid  B  and resid   59 and name  HE2) (segid  B  and resid   85 and name HG13)
assign (segid  B  and resid   85 and name HG12) (segid  B  and resid   50 and name HE22) 2.322 0.674 0.674 weight 1.000 ! spec=sumo...oesy, no=1745, id=1962, vol=4.030050e+00
    or (segid  B  and resid   85 and name HG11) (segid  B  and resid   50 and name HE22)
    or (segid  B  and resid   85 and name HG13) (segid  B  and resid   50 and name HE22)
assign (segid  B  and resid   85 and name HG12) (segid  B  and resid   57 and name   HA) 2.816 0.991 0.991 weight 1.000 ! spec=sumo...oesy, no=1747, id=1964, vol=1.267690e+00
    or (segid  B  and resid   85 and name HG11) (segid  B  and resid   57 and name   HA)
    or (segid  B  and resid   85 and name HG13) (segid  B  and resid   57 and name   HA)
assign (segid  B  and resid   85 and name   HA) (segid  B  and resid   85 and name HG12) 2.289 0.655 0.655 weight 1.000 ! spec=sumo...oesy, no=1748, id=1965, vol=4.387740e+00
    or (segid  B  and resid   85 and name   HA) (segid  B  and resid   85 and name HG11)
    or (segid  B  and resid   85 and name   HA) (segid  B  and resid   85 and name HG13)
assign (segid  B  and resid   85 and name HG12) (segid  B  and resid   23 and name  HA1) 2.823 0.996 0.996 weight 1.000 ! spec=sumo...oesy, no=1749, id=1966, vol=1.248010e+00
    or (segid  B  and resid   85 and name HG11) (segid  B  and resid   23 and name  HA1)
    or (segid  B  and resid   85 and name HG13) (segid  B  and resid   23 and name  HA1)
assign (segid  B  and resid   85 and name HG12) (segid  B  and resid   24 and name  HG1) 2.913 1.061 1.061 weight 1.000 ! spec=sumo...oesy, no=1750, id=1967, vol=1.033110e+00
    or (segid  B  and resid   85 and name HG11) (segid  B  and resid   24 and name  HG1)
    or (segid  B  and resid   85 and name HG13) (segid  B  and resid   24 and name  HG1)
assign (segid  B  and resid   85 and name HG12) (segid  B  and resid   87 and name  HB1) 2.782 0.967 0.967 weight 1.000 ! spec=sumo...oesy, no=1751, id=1968, vol=1.363150e+00
    or (segid  B  and resid   85 and name HG11) (segid  B  and resid   87 and name  HB1)
    or (segid  B  and resid   85 and name HG13) (segid  B  and resid   87 and name  HB1)
assign (segid  B  and resid   85 and name HG12) (segid  B  and resid   87 and name  HB2) 2.993 1.119 1.119 weight 1.000 ! spec=sumo...oesy, no=1752, id=1969, vol=8.795900e-01
    or (segid  B  and resid   85 and name HG11) (segid  B  and resid   87 and name  HB2)
    or (segid  B  and resid   85 and name HG13) (segid  B  and resid   87 and name  HB2)
assign (segid  B  and resid   85 and name HG12) (segid  B  and resid   57 and name   HB) 2.236 0.625 0.625 weight 1.000 ! spec=sumo...oesy, no=1753, id=1970, vol=5.052420e+00
    or (segid  B  and resid   85 and name HG11) (segid  B  and resid   57 and name   HB)
    or (segid  B  and resid   85 and name HG13) (segid  B  and resid   57 and name   HB)
assign (segid  B  and resid   85 and name   HB) (segid  B  and resid   85 and name HG12) 2.063 0.532 0.532 weight 1.000 ! spec=sumo...oesy, no=1754, id=1971, vol=8.202900e+00
    or (segid  B  and resid   85 and name   HB) (segid  B  and resid   85 and name HG11)
    or (segid  B  and resid   85 and name   HB) (segid  B  and resid   85 and name HG13)
assign (segid  B  and resid   85 and name HG12) (segid  B  and resid   57 and name HD12) 2.119 0.561 0.561 weight 1.000 ! spec=sumo...oesy, no=1758, id=1974, vol=6.985540e+00
    or (segid  B  and resid   85 and name HG12) (segid  B  and resid   57 and name HD11)
    or (segid  B  and resid   85 and name HG12) (segid  B  and resid   57 and name HD13)
    or (segid  B  and resid   85 and name HG11) (segid  B  and resid   57 and name HD12)
    or (segid  B  and resid   85 and name HG11) (segid  B  and resid   57 and name HD11)
    or (segid  B  and resid   85 and name HG11) (segid  B  and resid   57 and name HD13)
    or (segid  B  and resid   85 and name HG13) (segid  B  and resid   57 and name HD12)
    or (segid  B  and resid   85 and name HG13) (segid  B  and resid   57 and name HD11)
    or (segid  B  and resid   85 and name HG13) (segid  B  and resid   57 and name HD13)
assign (segid  B  and resid   85 and name HG12) (segid  B  and resid   46 and name  HE1) 3.111 1.210 1.210 weight 1.000 ! spec=sumo...oesy, no=1760, id=1976, vol=6.966500e-01
    or (segid  B  and resid   85 and name HG12) (segid  B  and resid   46 and name  HE2)
    or (segid  B  and resid   85 and name HG11) (segid  B  and resid   46 and name  HE1)
    or (segid  B  and resid   85 and name HG11) (segid  B  and resid   46 and name  HE2)
    or (segid  B  and resid   85 and name HG13) (segid  B  and resid   46 and name  HE1)
    or (segid  B  and resid   85 and name HG13) (segid  B  and resid   46 and name  HE2)
assign (segid  B  and resid   52 and name HD12) (segid  B  and resid   85 and name HG12) 2.310 0.667 0.667 weight 1.000 ! spec=sumo...oesy, no=1761, id=1977, vol=4.154580e+00
    or (segid  B  and resid   52 and name HD12) (segid  B  and resid   85 and name HG11)
    or (segid  B  and resid   52 and name HD12) (segid  B  and resid   85 and name HG13)
    or (segid  B  and resid   52 and name HD11) (segid  B  and resid   85 and name HG12)
    or (segid  B  and resid   52 and name HD11) (segid  B  and resid   85 and name HG11)
    or (segid  B  and resid   52 and name HD11) (segid  B  and resid   85 and name HG13)
    or (segid  B  and resid   52 and name HD13) (segid  B  and resid   85 and name HG12)
    or (segid  B  and resid   52 and name HD13) (segid  B  and resid   85 and name HG11)
    or (segid  B  and resid   52 and name HD13) (segid  B  and resid   85 and name HG13)
assign (segid  B  and resid   85 and name HG22) (segid  B  and resid   46 and name  HD1) 2.265 0.641 0.641 weight 1.000 ! spec=sumo...oesy, no=1765, id=1980, vol=4.679060e+00
    or (segid  B  and resid   85 and name HG22) (segid  B  and resid   46 and name  HD2)
    or (segid  B  and resid   85 and name HG21) (segid  B  and resid   46 and name  HD1)
    or (segid  B  and resid   85 and name HG21) (segid  B  and resid   46 and name  HD2)
    or (segid  B  and resid   85 and name HG23) (segid  B  and resid   46 and name  HD1)
    or (segid  B  and resid   85 and name HG23) (segid  B  and resid   46 and name  HD2)
assign (segid  B  and resid   59 and name  HE1) (segid  B  and resid   85 and name HG22) 2.414 0.728 0.728 weight 1.000 ! spec=sumo...oesy, no=1766, id=1981, vol=3.193170e+00
    or (segid  B  and resid   59 and name  HE1) (segid  B  and resid   85 and name HG21)
    or (segid  B  and resid   59 and name  HE1) (segid  B  and resid   85 and name HG23)
    or (segid  B  and resid   59 and name  HE2) (segid  B  and resid   85 and name HG22)
    or (segid  B  and resid   59 and name  HE2) (segid  B  and resid   85 and name HG21)
    or (segid  B  and resid   59 and name  HE2) (segid  B  and resid   85 and name HG23)
assign (segid  B  and resid   59 and name   HA) (segid  B  and resid   85 and name HG22) 2.542 0.808 0.808 weight 1.000 ! spec=sumo...oesy, no=1768, id=1983, vol=2.339680e+00
    or (segid  B  and resid   59 and name   HA) (segid  B  and resid   85 and name HG21)
    or (segid  B  and resid   59 and name   HA) (segid  B  and resid   85 and name HG23)
assign (segid  B  and resid   21 and name   HA) (segid  B  and resid   85 and name HG22) 2.825 0.998 0.998 weight 1.000 ! spec=sumo...oesy, no=1769, id=1984, vol=1.243060e+00
    or (segid  B  and resid   21 and name   HA) (segid  B  and resid   85 and name HG21)
    or (segid  B  and resid   21 and name   HA) (segid  B  and resid   85 and name HG23)
assign (segid  B  and resid   85 and name   HA) (segid  B  and resid   85 and name HG22) 2.271 0.645 0.645 weight 1.000 ! spec=sumo...oesy, no=1770, id=1985, vol=4.604300e+00
    or (segid  B  and resid   85 and name   HA) (segid  B  and resid   85 and name HG21)
    or (segid  B  and resid   85 and name   HA) (segid  B  and resid   85 and name HG23)
assign (segid  B  and resid   85 and name HG22) (segid  B  and resid   23 and name  HA1) 2.797 0.978 0.978 weight 1.000 ! spec=sumo...oesy, no=1771, id=1986, vol=1.320780e+00
    or (segid  B  and resid   85 and name HG21) (segid  B  and resid   23 and name  HA1)
    or (segid  B  and resid   85 and name HG23) (segid  B  and resid   23 and name  HA1)
assign (segid  B  and resid   85 and name HG22) (segid  B  and resid   23 and name  HA2) 2.952 1.089 1.089 weight 1.000 ! spec=sumo...oesy, no=1772, id=1987, vol=9.544200e-01
    or (segid  B  and resid   85 and name HG21) (segid  B  and resid   23 and name  HA2)
    or (segid  B  and resid   85 and name HG23) (segid  B  and resid   23 and name  HA2)
assign (segid  B  and resid   85 and name HG22) (segid  B  and resid   21 and name   HB) 2.719 0.924 0.924 weight 1.000 ! spec=sumo...oesy, no=1774, id=1989, vol=1.563720e+00
    or (segid  B  and resid   85 and name HG21) (segid  B  and resid   21 and name   HB)
    or (segid  B  and resid   85 and name HG23) (segid  B  and resid   21 and name   HB)
assign (segid  B  and resid   85 and name HG22) (segid  B  and resid   57 and name   HB) 2.513 0.789 0.789 weight 1.000 ! spec=sumo...oesy, no=1775, id=1990, vol=2.508940e+00
    or (segid  B  and resid   85 and name HG21) (segid  B  and resid   57 and name   HB)
    or (segid  B  and resid   85 and name HG23) (segid  B  and resid   57 and name   HB)
assign (segid  B  and resid   85 and name   HB) (segid  B  and resid   85 and name HG22) 2.052 0.526 0.526 weight 1.000 ! spec=sumo...oesy, no=1776, id=1991, vol=8.461260e+00
    or (segid  B  and resid   85 and name   HB) (segid  B  and resid   85 and name HG21)
    or (segid  B  and resid   85 and name   HB) (segid  B  and resid   85 and name HG23)
assign (segid  B  and resid   85 and name HG22) (segid  B  and resid   57 and name HG11) 2.666 0.888 0.888 weight 1.000 ! spec=sumo...oesy, no=1777, id=1992, vol=1.761650e+00
    or (segid  B  and resid   85 and name HG21) (segid  B  and resid   57 and name HG11)
    or (segid  B  and resid   85 and name HG23) (segid  B  and resid   57 and name HG11)
assign (segid  B  and resid   28 and name   HA) (segid  B  and resid   22 and name  HB2) 2.491 0.776 0.776 weight 1.000 ! spec=sumo...oesy, no=1782, id=1996, vol=2.645410e+00
    or (segid  B  and resid   28 and name   HA) (segid  B  and resid   22 and name  HB1)
    or (segid  B  and resid   28 and name   HA) (segid  B  and resid   22 and name  HB3)
assign (segid  B  and resid   41 and name  HE1) (segid  B  and resid   37 and name HG21) 2.644 0.874 0.874 weight 1.000 ! spec=sumo...oesy, no=1783, id=1997, vol=1.848150e+00
    or (segid  B  and resid   41 and name  HE1) (segid  B  and resid   37 and name HG22)
    or (segid  B  and resid   41 and name  HE1) (segid  B  and resid   37 and name HG23)
assign (segid  B  and resid   29 and name HG22) (segid  B  and resid   46 and name   HA) 3.066 1.175 1.175 weight 1.000 ! spec=sumo...oesy, no=1787, id=2001, vol=7.609000e-01
    or (segid  B  and resid   29 and name HG21) (segid  B  and resid   46 and name   HA)
    or (segid  B  and resid   29 and name HG23) (segid  B  and resid   46 and name   HA)
assign (segid  B  and resid   46 and name  HE1) (segid  B  and resid   29 and name HG22) 2.580 0.832 0.832 weight 1.000 ! spec=sumo...oesy, no=1788, id=2002, vol=2.142440e+00
    or (segid  B  and resid   46 and name  HE1) (segid  B  and resid   29 and name HG21)
    or (segid  B  and resid   46 and name  HE1) (segid  B  and resid   29 and name HG23)
    or (segid  B  and resid   46 and name  HE2) (segid  B  and resid   29 and name HG22)
    or (segid  B  and resid   46 and name  HE2) (segid  B  and resid   29 and name HG21)
    or (segid  B  and resid   46 and name  HE2) (segid  B  and resid   29 and name HG23)
assign (segid  B  and resid   46 and name  HD1) (segid  B  and resid   29 and name HG22) 2.337 0.683 0.683 weight 1.000 ! spec=sumo...oesy, no=1789, id=2003, vol=3.874200e+00
    or (segid  B  and resid   46 and name  HD1) (segid  B  and resid   29 and name HG21)
    or (segid  B  and resid   46 and name  HD1) (segid  B  and resid   29 and name HG23)
    or (segid  B  and resid   46 and name  HD2) (segid  B  and resid   29 and name HG22)
    or (segid  B  and resid   46 and name  HD2) (segid  B  and resid   29 and name HG21)
    or (segid  B  and resid   46 and name  HD2) (segid  B  and resid   29 and name HG23)
assign (segid  B  and resid   29 and name HG22) (segid  B  and resid   29 and name   HB) 1.865 0.435 0.435 weight 1.000 ! spec=sumo...oesy, no=1793, id=2007, vol=1.499800e+01
    or (segid  B  and resid   29 and name HG21) (segid  B  and resid   29 and name   HB)
    or (segid  B  and resid   29 and name HG23) (segid  B  and resid   29 and name   HB)
assign (segid  B  and resid   71 and name HG21) (segid  B  and resid   37 and name   HA) 2.957 1.093 1.093 weight 1.000 ! spec=sumo...oesy, no=1797, id=2011, vol=9.457100e-01
    or (segid  B  and resid   71 and name HG22) (segid  B  and resid   37 and name   HA)
    or (segid  B  and resid   71 and name HG23) (segid  B  and resid   37 and name   HA)
assign (segid  B  and resid   71 and name   HA) (segid  B  and resid   71 and name HG21) 2.097 0.550 0.550 weight 1.000 ! spec=sumo...oesy, no=1799, id=2013, vol=7.428400e+00
    or (segid  B  and resid   71 and name   HA) (segid  B  and resid   71 and name HG22)
    or (segid  B  and resid   71 and name   HA) (segid  B  and resid   71 and name HG23)
assign (segid  B  and resid   71 and name   HB) (segid  B  and resid   71 and name HG21) 1.988 0.494 0.494 weight 1.000 ! spec=sumo...oesy, no=1801, id=2015, vol=1.024736e+01
    or (segid  B  and resid   71 and name   HB) (segid  B  and resid   71 and name HG22)
    or (segid  B  and resid   71 and name   HB) (segid  B  and resid   71 and name HG23)
assign (segid  B  and resid   28 and name   HB) (segid  B  and resid   28 and name HG12) 1.759 0.387 0.387 weight 1.000 ! spec=sumo...oesy, no=1812, id=2025, vol=2.133390e+01
    or (segid  B  and resid   28 and name   HB) (segid  B  and resid   28 and name HG11)
    or (segid  B  and resid   28 and name   HB) (segid  B  and resid   28 and name HG13)
assign (segid  B  and resid   85 and name HG12) (segid  B  and resid   23 and name  HA2) 2.936 1.078 1.078 weight 1.000 ! spec=sumo...oesy, no=1816, id=2027, vol=9.863400e-01
    or (segid  B  and resid   85 and name HG11) (segid  B  and resid   23 and name  HA2)
    or (segid  B  and resid   85 and name HG13) (segid  B  and resid   23 and name  HA2)
assign (segid  B  and resid   22 and name  HB2) (segid  B  and resid   22 and name   HA) 1.838 0.422 0.422 weight 1.000 ! spec=sumo...oesy, no=1820, id=2031, vol=1.640601e+01
    or (segid  B  and resid   22 and name  HB1) (segid  B  and resid   22 and name   HA)
    or (segid  B  and resid   22 and name  HB3) (segid  B  and resid   22 and name   HA)
assign (segid  B  and resid   22 and name  HB2) (segid  B  and resid   28 and name HG22) 2.817 0.992 0.992 weight 1.000 ! spec=sumo...oesy, no=1821, id=2032, vol=1.264660e+00
    or (segid  B  and resid   22 and name  HB2) (segid  B  and resid   28 and name HG21)
    or (segid  B  and resid   22 and name  HB2) (segid  B  and resid   28 and name HG23)
    or (segid  B  and resid   22 and name  HB1) (segid  B  and resid   28 and name HG22)
    or (segid  B  and resid   22 and name  HB1) (segid  B  and resid   28 and name HG21)
    or (segid  B  and resid   22 and name  HB1) (segid  B  and resid   28 and name HG23)
    or (segid  B  and resid   22 and name  HB3) (segid  B  and resid   28 and name HG22)
    or (segid  B  and resid   22 and name  HB3) (segid  B  and resid   28 and name HG21)
    or (segid  B  and resid   22 and name  HB3) (segid  B  and resid   28 and name HG23)
assign (segid  B  and resid   10 and name HG12) (segid  B  and resid    9 and name  HA2) 2.872 1.031 1.031 weight 1.000 ! spec=sumo...oesy, no=1823, id=2034, vol=1.124730e+00
    or (segid  B  and resid   10 and name HG11) (segid  B  and resid    9 and name  HA2)
    or (segid  B  and resid   10 and name HG13) (segid  B  and resid    9 and name  HA2)
assign (segid  B  and resid   10 and name HG22) (segid  B  and resid   35 and name  HD2) 3.034 1.150 1.150 weight 1.000 ! spec=sumo...oesy, no=1828, id=2036, vol=8.108200e-01
    or (segid  B  and resid   10 and name HG21) (segid  B  and resid   35 and name  HD2)
    or (segid  B  and resid   10 and name HG23) (segid  B  and resid   35 and name  HD2)
assign (segid  B  and resid   66 and name HG11) (segid  B  and resid   66 and name HG22) 2.420 0.732 0.732 weight 1.000 ! spec=sumo...oesy, no=1832, id=2040, vol=3.143920e+00
    or (segid  B  and resid   66 and name HG11) (segid  B  and resid   66 and name HG21)
    or (segid  B  and resid   66 and name HG11) (segid  B  and resid   66 and name HG23)
assign (segid  B  and resid   66 and name HG22) (segid  B  and resid   77 and name  HE2) 2.559 0.819 0.819 weight 1.000 ! spec=sumo...oesy, no=1833, id=2041, vol=2.249630e+00
    or (segid  B  and resid   66 and name HG22) (segid  B  and resid   77 and name  HE1)
    or (segid  B  and resid   66 and name HG22) (segid  B  and resid   77 and name  HE3)
    or (segid  B  and resid   66 and name HG21) (segid  B  and resid   77 and name  HE2)
    or (segid  B  and resid   66 and name HG21) (segid  B  and resid   77 and name  HE1)
    or (segid  B  and resid   66 and name HG21) (segid  B  and resid   77 and name  HE3)
    or (segid  B  and resid   66 and name HG23) (segid  B  and resid   77 and name  HE2)
    or (segid  B  and resid   66 and name HG23) (segid  B  and resid   77 and name  HE1)
    or (segid  B  and resid   66 and name HG23) (segid  B  and resid   77 and name  HE3)
assign (segid  B  and resid   61 and name  HD1) (segid  B  and resid   66 and name HG22) 2.868 1.028 1.028 weight 1.000 ! spec=sumo...oesy, no=1836, id=2042, vol=1.135090e+00
    or (segid  B  and resid   61 and name  HD1) (segid  B  and resid   66 and name HG21)
    or (segid  B  and resid   61 and name  HD1) (segid  B  and resid   66 and name HG23)
    or (segid  B  and resid   61 and name  HD2) (segid  B  and resid   66 and name HG22)
    or (segid  B  and resid   61 and name  HD2) (segid  B  and resid   66 and name HG21)
    or (segid  B  and resid   61 and name  HD2) (segid  B  and resid   66 and name HG23)
assign (segid  B  and resid   66 and name HG22) (segid  B  and resid   61 and name  HB2) 2.284 0.652 0.652 weight 1.000 ! spec=sumo...oesy, no=1839, id=2045, vol=4.451630e+00
    or (segid  B  and resid   66 and name HG21) (segid  B  and resid   61 and name  HB2)
    or (segid  B  and resid   66 and name HG23) (segid  B  and resid   61 and name  HB2)
assign (segid  B  and resid   66 and name HG22) (segid  B  and resid   64 and name  HG1) 2.487 0.773 0.773 weight 1.000 ! spec=sumo...oesy, no=1840, id=2046, vol=2.668330e+00
    or (segid  B  and resid   66 and name HG21) (segid  B  and resid   64 and name  HG1)
    or (segid  B  and resid   66 and name HG23) (segid  B  and resid   64 and name  HG1)
assign (segid  B  and resid   66 and name HG22) (segid  B  and resid   66 and name   HB) 1.907 0.454 0.454 weight 1.000 ! spec=sumo...oesy, no=1841, id=2047, vol=1.315725e+01
    or (segid  B  and resid   66 and name HG21) (segid  B  and resid   66 and name   HB)
    or (segid  B  and resid   66 and name HG23) (segid  B  and resid   66 and name   HB)
assign (segid  B  and resid   60 and name   HA) (segid  B  and resid   66 and name HG22) 3.018 1.138 1.138 weight 1.000 ! spec=sumo...oesy, no=1843, id=2049, vol=8.364700e-01
    or (segid  B  and resid   60 and name   HA) (segid  B  and resid   66 and name HG21)
    or (segid  B  and resid   60 and name   HA) (segid  B  and resid   66 and name HG23)
assign (segid  B  and resid   57 and name HG22) (segid  B  and resid   59 and name  HE1) 2.693 0.907 0.907 weight 1.000 ! spec=sumo...oesy, no=1848, id=2052, vol=1.655280e+00
    or (segid  B  and resid   57 and name HG22) (segid  B  and resid   59 and name  HE2)
    or (segid  B  and resid   57 and name HG21) (segid  B  and resid   59 and name  HE1)
    or (segid  B  and resid   57 and name HG21) (segid  B  and resid   59 and name  HE2)
    or (segid  B  and resid   57 and name HG23) (segid  B  and resid   59 and name  HE1)
    or (segid  B  and resid   57 and name HG23) (segid  B  and resid   59 and name  HE2)
assign (segid  B  and resid   57 and name HG22) (segid  B  and resid   50 and name HE22) 2.855 1.019 1.019 weight 1.000 ! spec=sumo...oesy, no=1849, id=2053, vol=1.165490e+00
    or (segid  B  and resid   57 and name HG21) (segid  B  and resid   50 and name HE22)
    or (segid  B  and resid   57 and name HG23) (segid  B  and resid   50 and name HE22)
assign (segid  B  and resid   57 and name   HA) (segid  B  and resid   57 and name HG22) 2.099 0.551 0.551 weight 1.000 ! spec=sumo...oesy, no=1850, id=2054, vol=7.385360e+00
    or (segid  B  and resid   57 and name   HA) (segid  B  and resid   57 and name HG21)
    or (segid  B  and resid   57 and name   HA) (segid  B  and resid   57 and name HG23)
assign (segid  B  and resid   57 and name HG22) (segid  B  and resid   87 and name HE21) 2.279 0.649 0.649 weight 1.000 ! spec=sumo...oesy, no=1854, id=2057, vol=4.511210e+00
    or (segid  B  and resid   57 and name HG21) (segid  B  and resid   87 and name HE21)
    or (segid  B  and resid   57 and name HG23) (segid  B  and resid   87 and name HE21)
assign (segid  B  and resid   57 and name HG22) (segid  B  and resid   87 and name  HB1) 2.643 0.873 0.873 weight 1.000 ! spec=sumo...oesy, no=1856, id=2059, vol=1.851930e+00
    or (segid  B  and resid   57 and name HG21) (segid  B  and resid   87 and name  HB1)
    or (segid  B  and resid   57 and name HG23) (segid  B  and resid   87 and name  HB1)
assign (segid  B  and resid   87 and name  HB2) (segid  B  and resid   57 and name HG22) 2.758 0.951 0.951 weight 1.000 ! spec=sumo...oesy, no=1857, id=2060, vol=1.436140e+00
    or (segid  B  and resid   87 and name  HB2) (segid  B  and resid   57 and name HG21)
    or (segid  B  and resid   87 and name  HB2) (segid  B  and resid   57 and name HG23)
assign (segid  B  and resid   57 and name HG22) (segid  B  and resid   57 and name   HB) 1.927 0.464 0.464 weight 1.000 ! spec=sumo...oesy, no=1859, id=2062, vol=1.233556e+01
    or (segid  B  and resid   57 and name HG21) (segid  B  and resid   57 and name   HB)
    or (segid  B  and resid   57 and name HG23) (segid  B  and resid   57 and name   HB)
assign (segid  B  and resid   57 and name HG22) (segid  B  and resid   52 and name  HB1) 2.480 0.769 0.769 weight 1.000 ! spec=sumo...oesy, no=1860, id=2063, vol=2.718710e+00
    or (segid  B  and resid   57 and name HG21) (segid  B  and resid   52 and name  HB1)
    or (segid  B  and resid   57 and name HG23) (segid  B  and resid   52 and name  HB1)
assign (segid  B  and resid   57 and name HG22) (segid  B  and resid   52 and name  HB2) 2.522 0.795 0.795 weight 1.000 ! spec=sumo...oesy, no=1861, id=2064, vol=2.458040e+00
    or (segid  B  and resid   57 and name HG21) (segid  B  and resid   52 and name  HB2)
    or (segid  B  and resid   57 and name HG23) (segid  B  and resid   52 and name  HB2)
assign (segid  B  and resid   45 and name  HB2) (segid  B  and resid   31 and name  HD1) 2.303 0.663 0.663 weight 1.000 ! spec=sumo...oesy, no=1865, id=2067, vol=4.239560e+00
    or (segid  B  and resid   45 and name  HB2) (segid  B  and resid   31 and name  HD2)
    or (segid  B  and resid   45 and name  HB1) (segid  B  and resid   31 and name  HD1)
    or (segid  B  and resid   45 and name  HB1) (segid  B  and resid   31 and name  HD2)
    or (segid  B  and resid   45 and name  HB3) (segid  B  and resid   31 and name  HD1)
    or (segid  B  and resid   45 and name  HB3) (segid  B  and resid   31 and name  HD2)
assign (segid  B  and resid   45 and name  HB2) (segid  B  and resid   42 and name   HA) 2.282 0.651 0.651 weight 1.000 ! spec=sumo...oesy, no=1867, id=2069, vol=4.468340e+00
    or (segid  B  and resid   45 and name  HB1) (segid  B  and resid   42 and name   HA)
    or (segid  B  and resid   45 and name  HB3) (segid  B  and resid   42 and name   HA)
assign (segid  B  and resid   61 and name  HD1) (segid  B  and resid   77 and name  HE2) 2.280 0.650 0.650 weight 1.000 ! spec=sumo...oesy, no=1870, id=2071, vol=4.497870e+00
    or (segid  B  and resid   61 and name  HD1) (segid  B  and resid   77 and name  HE1)
    or (segid  B  and resid   61 and name  HD1) (segid  B  and resid   77 and name  HE3)
    or (segid  B  and resid   61 and name  HD2) (segid  B  and resid   77 and name  HE2)
    or (segid  B  and resid   61 and name  HD2) (segid  B  and resid   77 and name  HE1)
    or (segid  B  and resid   61 and name  HD2) (segid  B  and resid   77 and name  HE3)
assign (segid  B  and resid   61 and name   HA) (segid  B  and resid   77 and name  HE2) 2.879 1.036 1.036 weight 1.000 ! spec=sumo...oesy, no=1871, id=2072, vol=1.109570e+00
    or (segid  B  and resid   61 and name   HA) (segid  B  and resid   77 and name  HE1)
    or (segid  B  and resid   61 and name   HA) (segid  B  and resid   77 and name  HE3)
assign (segid  B  and resid   77 and name  HE2) (segid  B  and resid   72 and name   HA) 2.538 0.805 0.805 weight 1.000 ! spec=sumo...oesy, no=1872, id=2073, vol=2.363490e+00
    or (segid  B  and resid   77 and name  HE1) (segid  B  and resid   72 and name   HA)
    or (segid  B  and resid   77 and name  HE3) (segid  B  and resid   72 and name   HA)
assign (segid  B  and resid   61 and name  HB1) (segid  B  and resid   77 and name  HE2) 2.375 0.705 0.705 weight 1.000 ! spec=sumo...oesy, no=1873, id=2074, vol=3.523770e+00
    or (segid  B  and resid   61 and name  HB1) (segid  B  and resid   77 and name  HE1)
    or (segid  B  and resid   61 and name  HB1) (segid  B  and resid   77 and name  HE3)
assign (segid  B  and resid   77 and name  HE2) (segid  B  and resid   61 and name  HB2) 2.507 0.786 0.786 weight 1.000 ! spec=sumo...oesy, no=1874, id=2075, vol=2.543500e+00
    or (segid  B  and resid   77 and name  HE1) (segid  B  and resid   61 and name  HB2)
    or (segid  B  and resid   77 and name  HE3) (segid  B  and resid   61 and name  HB2)
assign (segid  B  and resid   77 and name  HE2) (segid  B  and resid   72 and name  HB1) 2.284 0.652 0.652 weight 1.000 ! spec=sumo...oesy, no=1877, id=2078, vol=4.450740e+00
    or (segid  B  and resid   77 and name  HE1) (segid  B  and resid   72 and name  HB1)
    or (segid  B  and resid   77 and name  HE3) (segid  B  and resid   72 and name  HB1)
assign (segid  B  and resid   77 and name  HE2) (segid  B  and resid   75 and name  HB2) 2.389 0.713 0.713 weight 1.000 ! spec=sumo...oesy, no=1879, id=2080, vol=3.399900e+00
    or (segid  B  and resid   77 and name  HE1) (segid  B  and resid   75 and name  HB2)
    or (segid  B  and resid   77 and name  HE3) (segid  B  and resid   75 and name  HB2)
assign (segid  B  and resid   77 and name  HE2) (segid  B  and resid   77 and name  HG1) 2.437 0.742 0.742 weight 1.000 ! spec=sumo...oesy, no=1881, id=2082, vol=3.019050e+00
    or (segid  B  and resid   77 and name  HE1) (segid  B  and resid   77 and name  HG1)
    or (segid  B  and resid   77 and name  HE3) (segid  B  and resid   77 and name  HG1)
assign (segid  B  and resid   75 and name HD12) (segid  B  and resid   77 and name  HE2) 1.934 0.468 0.468 weight 1.000 ! spec=sumo...oesy, no=1882, id=2083, vol=1.207083e+01
    or (segid  B  and resid   75 and name HD12) (segid  B  and resid   77 and name  HE1)
    or (segid  B  and resid   75 and name HD12) (segid  B  and resid   77 and name  HE3)
    or (segid  B  and resid   75 and name HD11) (segid  B  and resid   77 and name  HE2)
    or (segid  B  and resid   75 and name HD11) (segid  B  and resid   77 and name  HE1)
    or (segid  B  and resid   75 and name HD11) (segid  B  and resid   77 and name  HE3)
    or (segid  B  and resid   75 and name HD13) (segid  B  and resid   77 and name  HE2)
    or (segid  B  and resid   75 and name HD13) (segid  B  and resid   77 and name  HE1)
    or (segid  B  and resid   75 and name HD13) (segid  B  and resid   77 and name  HE3)
assign (segid  B  and resid   73 and name  HB2) (segid  B  and resid   36 and name   HA) 2.847 1.013 1.013 weight 1.000 ! spec=sumo...oesy, no=1884, id=2085, vol=1.187380e+00
    or (segid  B  and resid   73 and name  HB1) (segid  B  and resid   36 and name   HA)
    or (segid  B  and resid   73 and name  HB3) (segid  B  and resid   36 and name   HA)
assign (segid  B  and resid   73 and name  HB2) (segid  B  and resid   71 and name   HB) 3.097 1.199 1.199 weight 1.000 ! spec=sumo...oesy, no=1885, id=2086, vol=7.157000e-01
    or (segid  B  and resid   73 and name  HB1) (segid  B  and resid   71 and name   HB)
    or (segid  B  and resid   73 and name  HB3) (segid  B  and resid   71 and name   HB)
assign (segid  B  and resid   73 and name  HB2) (segid  B  and resid   35 and name   HA) 3.131 1.225 1.225 weight 1.000 ! spec=sumo...oesy, no=1886, id=2087, vol=6.712800e-01
    or (segid  B  and resid   73 and name  HB1) (segid  B  and resid   35 and name   HA)
    or (segid  B  and resid   73 and name  HB3) (segid  B  and resid   35 and name   HA)
assign (segid  B  and resid   73 and name  HB2) (segid  B  and resid   72 and name  HB2) 2.954 1.091 1.091 weight 1.000 ! spec=sumo...oesy, no=1893, id=2093, vol=9.512300e-01
    or (segid  B  and resid   73 and name  HB1) (segid  B  and resid   72 and name  HB2)
    or (segid  B  and resid   73 and name  HB3) (segid  B  and resid   72 and name  HB2)
assign (segid  B  and resid   73 and name  HB2) (segid  B  and resid   35 and name  HB2) 2.287 0.654 0.654 weight 1.000 ! spec=sumo...oesy, no=1894, id=2094, vol=4.417540e+00
    or (segid  B  and resid   73 and name  HB1) (segid  B  and resid   35 and name  HB2)
    or (segid  B  and resid   73 and name  HB3) (segid  B  and resid   35 and name  HB2)
assign (segid  B  and resid   59 and name  HD1) (segid  B  and resid   83 and name HG22) 2.168 0.588 0.588 weight 1.000 ! spec=sumo...oesy, no=1896, id=2096, vol=6.082640e+00
    or (segid  B  and resid   59 and name  HD1) (segid  B  and resid   83 and name HG21)
    or (segid  B  and resid   59 and name  HD1) (segid  B  and resid   83 and name HG23)
    or (segid  B  and resid   59 and name  HD2) (segid  B  and resid   83 and name HG22)
    or (segid  B  and resid   59 and name  HD2) (segid  B  and resid   83 and name HG21)
    or (segid  B  and resid   59 and name  HD2) (segid  B  and resid   83 and name HG23)
assign (segid  B  and resid   59 and name  HE1) (segid  B  and resid   83 and name HG22) 2.776 0.963 0.963 weight 1.000 ! spec=sumo...oesy, no=1897, id=2097, vol=1.381270e+00
    or (segid  B  and resid   59 and name  HE1) (segid  B  and resid   83 and name HG21)
    or (segid  B  and resid   59 and name  HE1) (segid  B  and resid   83 and name HG23)
    or (segid  B  and resid   59 and name  HE2) (segid  B  and resid   83 and name HG22)
    or (segid  B  and resid   59 and name  HE2) (segid  B  and resid   83 and name HG21)
    or (segid  B  and resid   59 and name  HE2) (segid  B  and resid   83 and name HG23)
assign (segid  B  and resid   21 and name   HA) (segid  B  and resid   83 and name HG22) 2.760 0.952 0.952 weight 1.000 ! spec=sumo...oesy, no=1899, id=2099, vol=1.430320e+00
    or (segid  B  and resid   21 and name   HA) (segid  B  and resid   83 and name HG21)
    or (segid  B  and resid   21 and name   HA) (segid  B  and resid   83 and name HG23)
assign (segid  B  and resid   59 and name  HB2) (segid  B  and resid   83 and name HG22) 2.428 0.737 0.737 weight 1.000 ! spec=sumo...oesy, no=1902, id=2102, vol=3.081320e+00
    or (segid  B  and resid   59 and name  HB2) (segid  B  and resid   83 and name HG21)
    or (segid  B  and resid   59 and name  HB2) (segid  B  and resid   83 and name HG23)
assign (segid  B  and resid   83 and name HG22) (segid  B  and resid   83 and name   HB) 2.103 0.553 0.553 weight 1.000 ! spec=sumo...oesy, no=1904, id=2104, vol=7.309700e+00
    or (segid  B  and resid   83 and name HG21) (segid  B  and resid   83 and name   HB)
    or (segid  B  and resid   83 and name HG23) (segid  B  and resid   83 and name   HB)
assign (segid  B  and resid   83 and name HG22) (segid  B  and resid   77 and name  HE2) 2.584 0.835 0.835 weight 1.000 ! spec=sumo...oesy, no=1907, id=2107, vol=2.121470e+00
    or (segid  B  and resid   83 and name HG22) (segid  B  and resid   77 and name  HE1)
    or (segid  B  and resid   83 and name HG22) (segid  B  and resid   77 and name  HE3)
    or (segid  B  and resid   83 and name HG21) (segid  B  and resid   77 and name  HE2)
    or (segid  B  and resid   83 and name HG21) (segid  B  and resid   77 and name  HE1)
    or (segid  B  and resid   83 and name HG21) (segid  B  and resid   77 and name  HE3)
    or (segid  B  and resid   83 and name HG23) (segid  B  and resid   77 and name  HE2)
    or (segid  B  and resid   83 and name HG23) (segid  B  and resid   77 and name  HE1)
    or (segid  B  and resid   83 and name HG23) (segid  B  and resid   77 and name  HE3)
assign (segid  B  and resid   83 and name HG22) (segid  B  and resid   61 and name  HD1) 3.081 1.186 1.186 weight 1.000 ! spec=sumo...oesy, no=1910, id=2110, vol=7.392900e-01
    or (segid  B  and resid   83 and name HG22) (segid  B  and resid   61 and name  HD2)
    or (segid  B  and resid   83 and name HG21) (segid  B  and resid   61 and name  HD1)
    or (segid  B  and resid   83 and name HG21) (segid  B  and resid   61 and name  HD2)
    or (segid  B  and resid   83 and name HG23) (segid  B  and resid   61 and name  HD1)
    or (segid  B  and resid   83 and name HG23) (segid  B  and resid   61 and name  HD2)
assign (segid  B  and resid   43 and name  HE2) (segid  B  and resid   68 and name  HB1) 2.500 0.781 0.781 weight 1.000 ! spec=sumo...oesy, no=1917, id=2115, vol=2.590340e+00
    or (segid  B  and resid   43 and name  HE1) (segid  B  and resid   68 and name  HB1)
    or (segid  B  and resid   43 and name  HE3) (segid  B  and resid   68 and name  HB1)
assign (segid  B  and resid   43 and name  HE2) (segid  B  and resid   68 and name   HA) 2.301 0.662 0.662 weight 1.000 ! spec=sumo...oesy, no=1922, id=2119, vol=4.254570e+00
    or (segid  B  and resid   43 and name  HE1) (segid  B  and resid   68 and name   HA)
    or (segid  B  and resid   43 and name  HE3) (segid  B  and resid   68 and name   HA)
assign (segid  B  and resid   43 and name  HE2) (segid  B  and resid   59 and name  HB1) 2.439 0.744 0.744 weight 1.000 ! spec=sumo...oesy, no=1923, id=2120, vol=2.999270e+00
    or (segid  B  and resid   43 and name  HE1) (segid  B  and resid   59 and name  HB1)
    or (segid  B  and resid   43 and name  HE3) (segid  B  and resid   59 and name  HB1)
assign (segid  B  and resid   43 and name  HE2) (segid  B  and resid   59 and name  HB2) 2.627 0.862 0.862 weight 1.000 ! spec=sumo...oesy, no=1924, id=2121, vol=1.923570e+00
    or (segid  B  and resid   43 and name  HE1) (segid  B  and resid   59 and name  HB2)
    or (segid  B  and resid   43 and name  HE3) (segid  B  and resid   59 and name  HB2)
assign (segid  B  and resid   43 and name  HE2) (segid  B  and resid   66 and name HG12) 2.195 0.602 0.602 weight 1.000 ! spec=sumo...oesy, no=1929, id=2126, vol=5.649140e+00
    or (segid  B  and resid   43 and name  HE1) (segid  B  and resid   66 and name HG12)
    or (segid  B  and resid   43 and name  HE3) (segid  B  and resid   66 and name HG12)
assign (segid  B  and resid   59 and name  HD1) (segid  B  and resid   43 and name  HE2) 2.435 0.741 0.741 weight 1.000 ! spec=sumo...oesy, no=1932, id=2129, vol=3.030460e+00
    or (segid  B  and resid   59 and name  HD1) (segid  B  and resid   43 and name  HE1)
    or (segid  B  and resid   59 and name  HD1) (segid  B  and resid   43 and name  HE3)
    or (segid  B  and resid   59 and name  HD2) (segid  B  and resid   43 and name  HE2)
    or (segid  B  and resid   59 and name  HD2) (segid  B  and resid   43 and name  HE1)
    or (segid  B  and resid   59 and name  HD2) (segid  B  and resid   43 and name  HE3)
assign (segid  B  and resid   59 and name  HE1) (segid  B  and resid   43 and name  HE2) 2.806 0.984 0.984 weight 1.000 ! spec=sumo...oesy, no=1933, id=2130, vol=1.295110e+00
    or (segid  B  and resid   59 and name  HE1) (segid  B  and resid   43 and name  HE1)
    or (segid  B  and resid   59 and name  HE1) (segid  B  and resid   43 and name  HE3)
    or (segid  B  and resid   59 and name  HE2) (segid  B  and resid   43 and name  HE2)
    or (segid  B  and resid   59 and name  HE2) (segid  B  and resid   43 and name  HE1)
    or (segid  B  and resid   59 and name  HE2) (segid  B  and resid   43 and name  HE3)
assign (segid  B  and resid   31 and name  HB1) (segid  B  and resid   33 and name HG22) 2.878 1.035 1.035 weight 1.000 ! spec=sumo...oesy, no=1939, id=2134, vol=1.111710e+00
    or (segid  B  and resid   31 and name  HB1) (segid  B  and resid   33 and name HG21)
    or (segid  B  and resid   31 and name  HB1) (segid  B  and resid   33 and name HG23)
assign (segid  B  and resid   31 and name  HB2) (segid  B  and resid   33 and name HG22) 2.747 0.944 0.944 weight 1.000 ! spec=sumo...oesy, no=1943, id=2137, vol=1.468840e+00
    or (segid  B  and resid   31 and name  HB2) (segid  B  and resid   33 and name HG21)
    or (segid  B  and resid   31 and name  HB2) (segid  B  and resid   33 and name HG23)
assign (segid  B  and resid   33 and name HG22) (segid  B  and resid   33 and name   HB) 2.058 0.530 0.530 weight 1.000 ! spec=sumo...oesy, no=1944, id=2138, vol=8.305610e+00
    or (segid  B  and resid   33 and name HG21) (segid  B  and resid   33 and name   HB)
    or (segid  B  and resid   33 and name HG23) (segid  B  and resid   33 and name   HB)
assign (segid  B  and resid   17 and name HG22) (segid  B  and resid   17 and name   HB) 2.092 0.547 0.547 weight 1.000 ! spec=sumo...oesy, no=1952, id=2145, vol=7.547880e+00
    or (segid  B  and resid   17 and name HG21) (segid  B  and resid   17 and name   HB)
    or (segid  B  and resid   17 and name HG23) (segid  B  and resid   17 and name   HB)
assign (segid  B  and resid   17 and name HG22) (segid  B  and resid   35 and name  HG2) 2.306 0.664 0.664 weight 1.000 ! spec=sumo...oesy, no=1953, id=2146, vol=4.207260e+00
    or (segid  B  and resid   17 and name HG21) (segid  B  and resid   35 and name  HG2)
    or (segid  B  and resid   17 and name HG23) (segid  B  and resid   35 and name  HG2)
assign (segid  B  and resid   17 and name HG22) (segid  B  and resid   10 and name   HB) 2.619 0.857 0.857 weight 1.000 ! spec=sumo...oesy, no=1958, id=2150, vol=1.958130e+00
    or (segid  B  and resid   17 and name HG21) (segid  B  and resid   10 and name   HB)
    or (segid  B  and resid   17 and name HG23) (segid  B  and resid   10 and name   HB)
assign (segid  B  and resid   66 and name HD12) (segid  B  and resid   59 and name  HD1) 2.750 0.945 0.945 weight 1.000 ! spec=sumo...oesy, no=1966, id=2154, vol=1.460740e+00
    or (segid  B  and resid   66 and name HD12) (segid  B  and resid   59 and name  HD2)
    or (segid  B  and resid   66 and name HD11) (segid  B  and resid   59 and name  HD1)
    or (segid  B  and resid   66 and name HD11) (segid  B  and resid   59 and name  HD2)
    or (segid  B  and resid   66 and name HD13) (segid  B  and resid   59 and name  HD1)
    or (segid  B  and resid   66 and name HD13) (segid  B  and resid   59 and name  HD2)
assign (segid  B  and resid   61 and name  HB2) (segid  B  and resid   66 and name HD12) 2.304 0.664 0.664 weight 1.000 ! spec=sumo...oesy, no=1969, id=2157, vol=4.222090e+00
    or (segid  B  and resid   61 and name  HB2) (segid  B  and resid   66 and name HD11)
    or (segid  B  and resid   61 and name  HB2) (segid  B  and resid   66 and name HD13)
assign (segid  B  and resid   59 and name  HB2) (segid  B  and resid   66 and name HD12) 2.382 0.709 0.709 weight 1.000 ! spec=sumo...oesy, no=1970, id=2158, vol=3.459650e+00
    or (segid  B  and resid   59 and name  HB2) (segid  B  and resid   66 and name HD11)
    or (segid  B  and resid   59 and name  HB2) (segid  B  and resid   66 and name HD13)
assign (segid  B  and resid   77 and name  HE2) (segid  B  and resid   66 and name HD12) 2.234 0.624 0.624 weight 1.000 ! spec=sumo...oesy, no=1972, id=2160, vol=5.080210e+00
    or (segid  B  and resid   77 and name  HE2) (segid  B  and resid   66 and name HD11)
    or (segid  B  and resid   77 and name  HE2) (segid  B  and resid   66 and name HD13)
    or (segid  B  and resid   77 and name  HE1) (segid  B  and resid   66 and name HD12)
    or (segid  B  and resid   77 and name  HE1) (segid  B  and resid   66 and name HD11)
    or (segid  B  and resid   77 and name  HE1) (segid  B  and resid   66 and name HD13)
    or (segid  B  and resid   77 and name  HE3) (segid  B  and resid   66 and name HD12)
    or (segid  B  and resid   77 and name  HE3) (segid  B  and resid   66 and name HD11)
    or (segid  B  and resid   77 and name  HE3) (segid  B  and resid   66 and name HD13)
assign (segid  B  and resid   57 and name HD12) (segid  B  and resid   87 and name HE21) 2.504 0.783 0.783 weight 1.000 ! spec=sumo...oesy, no=1987, id=2167, vol=2.566040e+00
    or (segid  B  and resid   57 and name HD11) (segid  B  and resid   87 and name HE21)
    or (segid  B  and resid   57 and name HD13) (segid  B  and resid   87 and name HE21)
assign (segid  B  and resid   57 and name HD12) (segid  B  and resid   57 and name   HB) 2.112 0.558 0.558 weight 1.000 ! spec=sumo...oesy, no=1989, id=2169, vol=7.118130e+00
    or (segid  B  and resid   57 and name HD11) (segid  B  and resid   57 and name   HB)
    or (segid  B  and resid   57 and name HD13) (segid  B  and resid   57 and name   HB)
assign (segid  B  and resid   57 and name HD12) (segid  B  and resid   59 and name   HZ) 2.485 0.772 0.772 weight 1.000 ! spec=sumo...oesy, no=1993, id=2171, vol=2.683170e+00
    or (segid  B  and resid   57 and name HD11) (segid  B  and resid   59 and name   HZ)
    or (segid  B  and resid   57 and name HD13) (segid  B  and resid   59 and name   HZ)
assign (segid  B  and resid   33 and name HD12) (segid  B  and resid   33 and name   HA) 2.758 0.951 0.951 weight 1.000 ! spec=sumo...oesy, no=1994, id=2172, vol=1.436060e+00
    or (segid  B  and resid   33 and name HD11) (segid  B  and resid   33 and name   HA)
    or (segid  B  and resid   33 and name HD13) (segid  B  and resid   33 and name   HA)
assign (segid  B  and resid   33 and name HD12) (segid  B  and resid   39 and name   HA) 2.418 0.731 0.731 weight 1.000 ! spec=sumo...oesy, no=1996, id=2174, vol=3.158600e+00
    or (segid  B  and resid   33 and name HD11) (segid  B  and resid   39 and name   HA)
    or (segid  B  and resid   33 and name HD13) (segid  B  and resid   39 and name   HA)
assign (segid  B  and resid   33 and name HD12) (segid  B  and resid   42 and name   HA) 3.042 1.157 1.157 weight 1.000 ! spec=sumo...oesy, no=1997, id=2175, vol=7.967400e-01
    or (segid  B  and resid   33 and name HD11) (segid  B  and resid   42 and name   HA)
    or (segid  B  and resid   33 and name HD13) (segid  B  and resid   42 and name   HA)
assign (segid  B  and resid   33 and name HD12) (segid  B  and resid   33 and name   HB) 2.116 0.560 0.560 weight 1.000 ! spec=sumo...oesy, no=1999, id=2177, vol=7.033640e+00
    or (segid  B  and resid   33 and name HD11) (segid  B  and resid   33 and name   HB)
    or (segid  B  and resid   33 and name HD13) (segid  B  and resid   33 and name   HB)
assign (segid  B  and resid   83 and name HD12) (segid  B  and resid   59 and name  HD1) 2.857 1.020 1.020 weight 1.000 ! spec=sumo...oesy, no=2003, id=2180, vol=1.162420e+00
    or (segid  B  and resid   83 and name HD12) (segid  B  and resid   59 and name  HD2)
    or (segid  B  and resid   83 and name HD11) (segid  B  and resid   59 and name  HD1)
    or (segid  B  and resid   83 and name HD11) (segid  B  and resid   59 and name  HD2)
    or (segid  B  and resid   83 and name HD13) (segid  B  and resid   59 and name  HD1)
    or (segid  B  and resid   83 and name HD13) (segid  B  and resid   59 and name  HD2)
assign (segid  B  and resid   83 and name   HA) (segid  B  and resid   83 and name HD12) 2.976 1.107 1.107 weight 1.000 ! spec=sumo...oesy, no=2005, id=2182, vol=9.089900e-01
    or (segid  B  and resid   83 and name   HA) (segid  B  and resid   83 and name HD11)
    or (segid  B  and resid   83 and name   HA) (segid  B  and resid   83 and name HD13)
assign (segid  B  and resid   83 and name HD12) (segid  B  and resid   83 and name   HB) 2.216 0.614 0.614 weight 1.000 ! spec=sumo...oesy, no=2008, id=2185, vol=5.336920e+00
    or (segid  B  and resid   83 and name HD11) (segid  B  and resid   83 and name   HB)
    or (segid  B  and resid   83 and name HD13) (segid  B  and resid   83 and name   HB)
assign (segid  B  and resid   83 and name HD12) (segid  B  and resid   19 and name  HB1) 2.505 0.784 0.784 weight 1.000 ! spec=sumo...oesy, no=2010, id=2187, vol=2.556560e+00
    or (segid  B  and resid   83 and name HD11) (segid  B  and resid   19 and name  HB1)
    or (segid  B  and resid   83 and name HD13) (segid  B  and resid   19 and name  HB1)
assign (segid  B  and resid   77 and name  HE2) (segid  B  and resid   83 and name HD12) 2.154 0.580 0.580 weight 1.000 ! spec=sumo...oesy, no=2011, id=2188, vol=6.326020e+00
    or (segid  B  and resid   77 and name  HE2) (segid  B  and resid   83 and name HD11)
    or (segid  B  and resid   77 and name  HE2) (segid  B  and resid   83 and name HD13)
    or (segid  B  and resid   77 and name  HE1) (segid  B  and resid   83 and name HD12)
    or (segid  B  and resid   77 and name  HE1) (segid  B  and resid   83 and name HD11)
    or (segid  B  and resid   77 and name  HE1) (segid  B  and resid   83 and name HD13)
    or (segid  B  and resid   77 and name  HE3) (segid  B  and resid   83 and name HD12)
    or (segid  B  and resid   77 and name  HE3) (segid  B  and resid   83 and name HD11)
    or (segid  B  and resid   77 and name  HE3) (segid  B  and resid   83 and name HD13)
assign (segid  B  and resid   83 and name HG22) (segid  B  and resid   83 and name HD12) 1.996 0.498 0.498 weight 1.000 ! spec=sumo...oesy, no=2012, id=2189, vol=1.000189e+01
    or (segid  B  and resid   83 and name HG22) (segid  B  and resid   83 and name HD11)
    or (segid  B  and resid   83 and name HG22) (segid  B  and resid   83 and name HD13)
    or (segid  B  and resid   83 and name HG21) (segid  B  and resid   83 and name HD12)
    or (segid  B  and resid   83 and name HG21) (segid  B  and resid   83 and name HD11)
    or (segid  B  and resid   83 and name HG21) (segid  B  and resid   83 and name HD13)
    or (segid  B  and resid   83 and name HG23) (segid  B  and resid   83 and name HD12)
    or (segid  B  and resid   83 and name HG23) (segid  B  and resid   83 and name HD11)
    or (segid  B  and resid   83 and name HG23) (segid  B  and resid   83 and name HD13)
assign (segid  B  and resid   19 and name HD22) (segid  B  and resid   83 and name HD12) 2.011 0.505 0.505 weight 1.000 ! spec=sumo...oesy, no=2013, id=2190, vol=9.556840e+00
    or (segid  B  and resid   19 and name HD22) (segid  B  and resid   83 and name HD11)
    or (segid  B  and resid   19 and name HD22) (segid  B  and resid   83 and name HD13)
    or (segid  B  and resid   19 and name HD21) (segid  B  and resid   83 and name HD12)
    or (segid  B  and resid   19 and name HD21) (segid  B  and resid   83 and name HD11)
    or (segid  B  and resid   19 and name HD21) (segid  B  and resid   83 and name HD13)
    or (segid  B  and resid   19 and name HD23) (segid  B  and resid   83 and name HD12)
    or (segid  B  and resid   19 and name HD23) (segid  B  and resid   83 and name HD11)
    or (segid  B  and resid   19 and name HD23) (segid  B  and resid   83 and name HD13)
assign (segid  B  and resid   42 and name HD22) (segid  B  and resid   83 and name HD12) 2.377 0.706 0.706 weight 1.000 ! spec=sumo...oesy, no=2014, id=2191, vol=3.505920e+00
    or (segid  B  and resid   42 and name HD22) (segid  B  and resid   83 and name HD11)
    or (segid  B  and resid   42 and name HD22) (segid  B  and resid   83 and name HD13)
    or (segid  B  and resid   42 and name HD21) (segid  B  and resid   83 and name HD12)
    or (segid  B  and resid   42 and name HD21) (segid  B  and resid   83 and name HD11)
    or (segid  B  and resid   42 and name HD21) (segid  B  and resid   83 and name HD13)
    or (segid  B  and resid   42 and name HD23) (segid  B  and resid   83 and name HD12)
    or (segid  B  and resid   42 and name HD23) (segid  B  and resid   83 and name HD11)
    or (segid  B  and resid   42 and name HD23) (segid  B  and resid   83 and name HD13)
assign (segid  B  and resid   61 and name  HD1) (segid  B  and resid   83 and name HD12) 3.123 1.219 1.219 weight 1.000 ! spec=sumo...oesy, no=2015, id=2192, vol=6.809800e-01
    or (segid  B  and resid   61 and name  HD1) (segid  B  and resid   83 and name HD11)
    or (segid  B  and resid   61 and name  HD1) (segid  B  and resid   83 and name HD13)
    or (segid  B  and resid   61 and name  HD2) (segid  B  and resid   83 and name HD12)
    or (segid  B  and resid   61 and name  HD2) (segid  B  and resid   83 and name HD11)
    or (segid  B  and resid   61 and name  HD2) (segid  B  and resid   83 and name HD13)
assign (segid  B  and resid   17 and name HD12) (segid  B  and resid   35 and name   HA) 2.833 1.003 1.003 weight 1.000 ! spec=sumo...oesy, no=2017, id=2193, vol=1.222350e+00
    or (segid  B  and resid   17 and name HD11) (segid  B  and resid   35 and name   HA)
    or (segid  B  and resid   17 and name HD13) (segid  B  and resid   35 and name   HA)
assign (segid  B  and resid   35 and name  HD2) (segid  B  and resid   17 and name HD12) 2.875 1.033 1.033 weight 1.000 ! spec=sumo...oesy, no=2018, id=2194, vol=1.119050e+00
    or (segid  B  and resid   35 and name  HD2) (segid  B  and resid   17 and name HD11)
    or (segid  B  and resid   35 and name  HD2) (segid  B  and resid   17 and name HD13)
assign (segid  B  and resid   77 and name  HB1) (segid  B  and resid   17 and name HD12) 2.333 0.680 0.680 weight 1.000 ! spec=sumo...oesy, no=2020, id=2196, vol=3.920090e+00
    or (segid  B  and resid   77 and name  HB1) (segid  B  and resid   17 and name HD11)
    or (segid  B  and resid   77 and name  HB1) (segid  B  and resid   17 and name HD13)
assign (segid  B  and resid   17 and name HD12) (segid  B  and resid   17 and name   HB) 2.196 0.603 0.603 weight 1.000 ! spec=sumo...oesy, no=2021, id=2197, vol=5.641380e+00
    or (segid  B  and resid   17 and name HD11) (segid  B  and resid   17 and name   HB)
    or (segid  B  and resid   17 and name HD13) (segid  B  and resid   17 and name   HB)
assign (segid  B  and resid   17 and name HG11) (segid  B  and resid   17 and name HD12) 1.920 0.461 0.461 weight 1.000 ! spec=sumo...oesy, no=2022, id=2198, vol=1.260555e+01
    or (segid  B  and resid   17 and name HG11) (segid  B  and resid   17 and name HD11)
    or (segid  B  and resid   17 and name HG11) (segid  B  and resid   17 and name HD13)
assign (segid  B  and resid   17 and name HG22) (segid  B  and resid   17 and name HD12) 2.135 0.570 0.570 weight 1.000 ! spec=sumo...oesy, no=2023, id=2199, vol=6.663890e+00
    or (segid  B  and resid   17 and name HG22) (segid  B  and resid   17 and name HD11)
    or (segid  B  and resid   17 and name HG22) (segid  B  and resid   17 and name HD13)
    or (segid  B  and resid   17 and name HG21) (segid  B  and resid   17 and name HD12)
    or (segid  B  and resid   17 and name HG21) (segid  B  and resid   17 and name HD11)
    or (segid  B  and resid   17 and name HG21) (segid  B  and resid   17 and name HD13)
    or (segid  B  and resid   17 and name HG23) (segid  B  and resid   17 and name HD12)
    or (segid  B  and resid   17 and name HG23) (segid  B  and resid   17 and name HD11)
    or (segid  B  and resid   17 and name HG23) (segid  B  and resid   17 and name HD13)
assign (segid  B  and resid   17 and name HD12) (segid  B  and resid   19 and name   HA) 3.096 1.198 1.198 weight 1.000 ! spec=sumo...oesy, no=2025, id=2200, vol=7.176800e-01
    or (segid  B  and resid   17 and name HD11) (segid  B  and resid   19 and name   HA)
    or (segid  B  and resid   17 and name HD13) (segid  B  and resid   19 and name   HA)
assign (segid  B  and resid   17 and name HG12) (segid  B  and resid   17 and name HD12) 2.070 0.536 0.536 weight 1.000 ! spec=sumo...oesy, no=2029, id=2204, vol=8.032250e+00
    or (segid  B  and resid   17 and name HG12) (segid  B  and resid   17 and name HD11)
    or (segid  B  and resid   17 and name HG12) (segid  B  and resid   17 and name HD13)
assign (segid  B  and resid   57 and name HD12) (segid  B  and resid   46 and name  HB2) 3.118 1.215 1.215 weight 1.000 ! spec=sumo...oesy, no=2036, id=2207, vol=6.880900e-01
    or (segid  B  and resid   57 and name HD11) (segid  B  and resid   46 and name  HB2)
    or (segid  B  and resid   57 and name HD13) (segid  B  and resid   46 and name  HB2)
assign (segid  B  and resid   19 and name   HA) (segid  B  and resid   19 and name  HB1) 2.629 0.864 0.864 weight 1.000 ! spec=sumo...oesy, no=2085, id=2209, vol=1.913310e+00
assign (segid  B  and resid   42 and name   HG) (segid  B  and resid   19 and name  HB1) 2.993 1.120 1.120 weight 1.000 ! spec=sumo...oesy, no=2088, id=2212, vol=8.785200e-01
assign (segid  B  and resid   19 and name  HB2) (segid  B  and resid   33 and name HG22) 2.454 0.753 0.753 weight 1.000 ! spec=sumo...oesy, no=2090, id=2213, vol=2.891960e+00
    or (segid  B  and resid   19 and name  HB2) (segid  B  and resid   33 and name HG21)
    or (segid  B  and resid   19 and name  HB2) (segid  B  and resid   33 and name HG23)
assign (segid  B  and resid   42 and name   HG) (segid  B  and resid   19 and name  HB2) 2.943 1.082 1.082 weight 1.000 ! spec=sumo...oesy, no=2092, id=2215, vol=9.731000e-01
assign (segid  B  and resid   19 and name  HB1) (segid  B  and resid   19 and name  HB2) 2.040 0.520 0.520 weight 1.000 ! spec=sumo...oesy, no=2094, id=2217, vol=8.755390e+00
assign (segid  B  and resid   52 and name  HB1) (segid  B  and resid   47 and name   HA) 2.736 0.936 0.936 weight 1.000 ! spec=sumo...oesy, no=2104, id=2219, vol=1.505220e+00
assign (segid  B  and resid   52 and name  HB1) (segid  B  and resid   52 and name   HA) 2.569 0.825 0.825 weight 1.000 ! spec=sumo...oesy, no=2106, id=2220, vol=2.198470e+00
assign (segid  B  and resid   52 and name  HB2) (segid  B  and resid   52 and name   HA) 2.690 0.905 0.905 weight 1.000 ! spec=sumo...oesy, no=2109, id=2222, vol=1.665960e+00
assign (segid  B  and resid   52 and name  HB2) (segid  B  and resid   47 and name   HA) 2.598 0.844 0.844 weight 1.000 ! spec=sumo...oesy, no=2110, id=2223, vol=2.054450e+00
assign (segid  B  and resid   33 and name   HB) (segid  B  and resid   31 and name  HB2) 3.113 1.211 1.211 weight 1.000 ! spec=sumo...oesy, no=2124, id=2230, vol=6.944900e-01
assign (segid  B  and resid   33 and name HG11) (segid  B  and resid   33 and name   HB) 2.376 0.706 0.706 weight 1.000 ! spec=sumo...oesy, no=2126, id=2232, vol=3.508960e+00
assign (segid  B  and resid   33 and name   HB) (segid  B  and resid   33 and name HG12) 2.640 0.871 0.871 weight 1.000 ! spec=sumo...oesy, no=2127, id=2233, vol=1.866690e+00
assign (segid  B  and resid   42 and name   HG) (segid  B  and resid   33 and name   HB) 2.952 1.090 1.090 weight 1.000 ! spec=sumo...oesy, no=2130, id=2236, vol=9.541900e-01
assign (segid  B  and resid   61 and name  HB1) (segid  B  and resid   75 and name  HB1) 3.061 1.171 1.171 weight 1.000 ! spec=sumo...oesy, no=2132, id=2237, vol=7.681400e-01
assign (segid  B  and resid   75 and name HD12) (segid  B  and resid   75 and name  HB1) 2.389 0.713 0.713 weight 1.000 ! spec=sumo...oesy, no=2143, id=2243, vol=3.399560e+00
    or (segid  B  and resid   75 and name HD11) (segid  B  and resid   75 and name  HB1)
    or (segid  B  and resid   75 and name HD13) (segid  B  and resid   75 and name  HB1)
assign (segid  B  and resid   17 and name   HB) (segid  B  and resid   17 and name HG11) 2.544 0.809 0.809 weight 1.000 ! spec=sumo...oesy, no=2147, id=2246, vol=2.330500e+00
assign (segid  B  and resid   17 and name   HB) (segid  B  and resid   17 and name HG12) 2.573 0.827 0.827 weight 1.000 ! spec=sumo...oesy, no=2151, id=2250, vol=2.177910e+00
assign (segid  B  and resid   75 and name  HB1) (segid  B  and resid   75 and name  HB2) 2.088 0.545 0.545 weight 1.000 ! spec=sumo...oesy, no=2156, id=2255, vol=7.616550e+00
assign (segid  B  and resid   75 and name  HB2) (segid  B  and resid   77 and name  HG1) 2.907 1.057 1.057 weight 1.000 ! spec=sumo...oesy, no=2157, id=2256, vol=1.046070e+00
assign (segid  B  and resid   75 and name HD12) (segid  B  and resid   75 and name  HB2) 2.472 0.764 0.764 weight 1.000 ! spec=sumo...oesy, no=2159, id=2258, vol=2.769600e+00
    or (segid  B  and resid   75 and name HD11) (segid  B  and resid   75 and name  HB2)
    or (segid  B  and resid   75 and name HD13) (segid  B  and resid   75 and name  HB2)
assign (segid  B  and resid   42 and name  HB1) (segid  B  and resid   39 and name   HA) 3.155 1.244 1.244 weight 1.000 ! spec=sumo...oesy, no=2160, id=2259, vol=6.406200e-01
assign (segid  B  and resid   42 and name  HB1) (segid  B  and resid   39 and name HD22) 2.757 0.950 0.950 weight 1.000 ! spec=sumo...oesy, no=2164, id=2262, vol=1.437440e+00
    or (segid  B  and resid   42 and name  HB1) (segid  B  and resid   39 and name HD21)
    or (segid  B  and resid   42 and name  HB1) (segid  B  and resid   39 and name HD23)
assign (segid  B  and resid   42 and name  HB1) (segid  B  and resid   42 and name   HA) 2.677 0.896 0.896 weight 1.000 ! spec=sumo...oesy, no=2165, id=2263, vol=1.715050e+00
assign (segid  B  and resid   42 and name   HG) (segid  B  and resid   42 and name  HB1) 2.648 0.877 0.877 weight 1.000 ! spec=sumo...oesy, no=2167, id=2265, vol=1.831080e+00
assign (segid  B  and resid   42 and name  HB1) (segid  B  and resid   42 and name  HB2) 2.187 0.598 0.598 weight 1.000 ! spec=sumo...oesy, no=2169, id=2267, vol=5.780890e+00
assign (segid  B  and resid   42 and name  HB2) (segid  B  and resid   39 and name   HA) 3.058 1.169 1.169 weight 1.000 ! spec=sumo...oesy, no=2170, id=2268, vol=7.723600e-01
assign (segid  B  and resid   42 and name  HB2) (segid  B  and resid   42 and name   HA) 2.470 0.763 0.763 weight 1.000 ! spec=sumo...oesy, no=2171, id=2269, vol=2.780080e+00
assign (segid  B  and resid   42 and name   HG) (segid  B  and resid   42 and name  HB2) 2.492 0.776 0.776 weight 1.000 ! spec=sumo...oesy, no=2173, id=2271, vol=2.639130e+00
assign (segid  B  and resid   42 and name  HB2) (segid  B  and resid   42 and name HD22) 2.731 0.932 0.932 weight 1.000 ! spec=sumo...oesy, no=2174, id=2272, vol=1.524180e+00
    or (segid  B  and resid   42 and name  HB2) (segid  B  and resid   42 and name HD21)
    or (segid  B  and resid   42 and name  HB2) (segid  B  and resid   42 and name HD23)
assign (segid  B  and resid   59 and name  HE1) (segid  B  and resid   57 and name   HB) 3.158 1.246 1.246 weight 1.000 ! spec=sumo...oesy, no=2192, id=2282, vol=6.373600e-01
    or (segid  B  and resid   59 and name  HE2) (segid  B  and resid   57 and name   HB)
assign (segid  B  and resid   66 and name   HB) (segid  B  and resid   66 and name HG11) 2.631 0.866 0.866 weight 1.000 ! spec=sumo...oesy, no=2206, id=2292, vol=1.903250e+00
assign (segid  B  and resid   60 and name  HG2) (segid  B  and resid   60 and name  HD1) 2.481 0.769 0.769 weight 1.000 ! spec=sumo...oesy, no=2231, id=2296, vol=2.710970e+00
assign (segid  B  and resid   60 and name  HB2) (segid  B  and resid   60 and name  HD1) 2.526 0.797 0.797 weight 1.000 ! spec=sumo...oesy, no=2233, id=2298, vol=2.433620e+00
# isopeptide
assign ( resid 82 and segid A and name OT1 ) (resid 11 and segid B and name NZ) 2.25 0.05 0.05
assign ( resid 82 and segid A and name C ) (resid 11 and segid B and name NZ) 1.35 0.05 0.05
assign ( resid 82 and segid A and name CA ) (resid 11 and segid B and name NZ) 2.45 0.05 0.05
assign ( resid 82 and segid A and name C ) (resid 11 and segid B and name CE) 2.45 0.05 0.05
# Ambiguous inter-molecular restraints
!
! HADDOCK AIR restraints for 1st molecule
!
!
assign ( resid 4  and segid A)
       (
        ( resid 7  and segid C)
     or
        ( resid 8  and segid C)
     or
        ( resid 9  and segid C)
     or
        ( resid 10  and segid C)
     or
        ( resid 19  and segid C)
     or
        ( resid 20  and segid C)
     or
        ( resid 21  and segid C)
     or
        ( resid 22  and segid C)
     or
        ( resid 6  and segid C)
     or
        ( resid 11  and segid C)
     or
        ( resid 18  and segid C)
     or
        ( resid 23  and segid C)
       )  2.0 2.0 0.0
!
assign ( resid 6  and segid A)
       (
        ( resid 7  and segid C)
     or
        ( resid 8  and segid C)
     or
        ( resid 9  and segid C)
     or
        ( resid 10  and segid C)
     or
        ( resid 19  and segid C)
     or
        ( resid 20  and segid C)
     or
        ( resid 21  and segid C)
     or
        ( resid 22  and segid C)
     or
        ( resid 6  and segid C)
     or
        ( resid 11  and segid C)
     or
        ( resid 18  and segid C)
     or
        ( resid 23  and segid C)
       )  2.0 2.0 0.0
!
assign ( resid 8  and segid A)
       (
        ( resid 7  and segid C)
     or
        ( resid 8  and segid C)
     or
        ( resid 9  and segid C)
     or
        ( resid 10  and segid C)
     or
        ( resid 19  and segid C)
     or
        ( resid 20  and segid C)
     or
        ( resid 21  and segid C)
     or
        ( resid 22  and segid C)
     or
        ( resid 6  and segid C)
     or
        ( resid 11  and segid C)
     or
        ( resid 18  and segid C)
     or
        ( resid 23  and segid C)
       )  2.0 2.0 0.0
!
assign ( resid 20  and segid A and name O )
       (
        ( resid 7  and segid C)
     or
        ( resid 8  and segid C)
     or
        ( resid 9  and segid C)
     or
        ( resid 10  and segid C)
     or
        ( resid 19  and segid C)
     or
        ( resid 20  and segid C)
     or
        ( resid 21  and segid C)
     or
        ( resid 22  and segid C)
     or
        ( resid 6  and segid C)
     or
        ( resid 11  and segid C)
     or
        ( resid 18  and segid C)
     or
        ( resid 23  and segid C)
       )  2.0 2.0 0.0
!
assign ( resid 22  and segid A and name HN)
       (
        ( resid 7  and segid C)
     or
        ( resid 8  and segid C)
     or
        ( resid 9  and segid C)
     or
        ( resid 10  and segid C)
     or
        ( resid 19  and segid C)
     or
        ( resid 20  and segid C)
     or
        ( resid 21  and segid C)
     or
        ( resid 22  and segid C)
     or
        ( resid 6  and segid C)
     or
        ( resid 11  and segid C)
     or
        ( resid 18  and segid C)
     or
        ( resid 23  and segid C)
       )  2.0 2.0 0.0
assign ( resid 22  and segid A and name O)
       (
        ( resid 7  and segid C)
     or
        ( resid 8  and segid C)
     or
        ( resid 9  and segid C)
     or
        ( resid 10  and segid C)
     or
        ( resid 19  and segid C)
     or
        ( resid 20  and segid C)
     or
        ( resid 21  and segid C)
     or
        ( resid 22  and segid C)
     or
        ( resid 6  and segid C)
     or
        ( resid 11  and segid C)
     or
        ( resid 18  and segid C)
     or
        ( resid 23  and segid C)
       )  2.0 2.0 0.0
!
assign ( resid 24  and segid A)
       (
        ( resid 7  and segid C)
     or
        ( resid 8  and segid C)
     or
        ( resid 9  and segid C)
     or
        ( resid 10  and segid C)
     or
        ( resid 19  and segid C)
     or
        ( resid 20  and segid C)
     or
        ( resid 21  and segid C)
     or
        ( resid 22  and segid C)
     or
        ( resid 6  and segid C)
     or
        ( resid 11  and segid C)
     or
        ( resid 18  and segid C)
     or
        ( resid 23  and segid C)
       )  2.0 2.0 0.0
!
assign ( resid 25  and segid A)
       (
        ( resid 7  and segid C)
     or
        ( resid 8  and segid C)
     or
        ( resid 9  and segid C)
     or
        ( resid 10  and segid C)
     or
        ( resid 19  and segid C)
     or
        ( resid 20  and segid C)
     or
        ( resid 21  and segid C)
     or
        ( resid 22  and segid C)
     or
        ( resid 6  and segid C)
     or
        ( resid 11  and segid C)
     or
        ( resid 18  and segid C)
     or
        ( resid 23  and segid C)
       )  2.0 2.0 0.0
!
assign ( resid 26  and segid A)
       (
        ( resid 7  and segid C)
     or
        ( resid 8  and segid C)
     or
        ( resid 9  and segid C)
     or
        ( resid 10  and segid C)
     or
        ( resid 19  and segid C)
     or
        ( resid 20  and segid C)
     or
        ( resid 21  and segid C)
     or
        ( resid 22  and segid C)
     or
        ( resid 6  and segid C)
     or
        ( resid 11  and segid C)
     or
        ( resid 18  and segid C)
     or
        ( resid 23  and segid C)
       )  2.0 2.0 0.0
!
assign ( resid 35  and segid A)
       (
        ( resid 7  and segid C)
     or
        ( resid 8  and segid C)
     or
        ( resid 9  and segid C)
     or
        ( resid 10  and segid C)
     or
        ( resid 19  and segid C)
     or
        ( resid 20  and segid C)
     or
        ( resid 21  and segid C)
     or
        ( resid 22  and segid C)
     or
        ( resid 6  and segid C)
     or
        ( resid 11  and segid C)
     or
        ( resid 18  and segid C)
     or
        ( resid 23  and segid C)
       )  2.0 2.0 0.0
!
assign ( resid 39  and segid A)
       (
        ( resid 7  and segid C)
     or
        ( resid 8  and segid C)
     or
        ( resid 9  and segid C)
     or
        ( resid 10  and segid C)
     or
        ( resid 19  and segid C)
     or
        ( resid 20  and segid C)
     or
        ( resid 21  and segid C)
     or
        ( resid 22  and segid C)
     or
        ( resid 6  and segid C)
     or
        ( resid 11  and segid C)
     or
        ( resid 18  and segid C)
     or
        ( resid 23  and segid C)
       )  2.0 2.0 0.0
!
! HADDOCK AIR restraints for 2nd molecule
!
!
assign ( resid 14  and segid B)
       (
        ( resid 7  and segid C)
     or
        ( resid 8  and segid C)
     or
        ( resid 9  and segid C)
     or
        ( resid 10  and segid C)
     or
        ( resid 19  and segid C)
     or
        ( resid 20  and segid C)
     or
        ( resid 21  and segid C)
     or
        ( resid 22  and segid C)
     or
        ( resid 6  and segid C)
     or
        ( resid 11  and segid C)
     or
        ( resid 18  and segid C)
     or
        ( resid 23  and segid C)
       )  2.0 2.0 0.0
!
assign ( resid 16  and segid B)
       (
        ( resid 7  and segid C)
     or
        ( resid 8  and segid C)
     or
        ( resid 9  and segid C)
     or
        ( resid 10  and segid C)
     or
        ( resid 19  and segid C)
     or
        ( resid 20  and segid C)
     or
        ( resid 21  and segid C)
     or
        ( resid 22  and segid C)
     or
        ( resid 6  and segid C)
     or
        ( resid 11  and segid C)
     or
        ( resid 18  and segid C)
     or
        ( resid 23  and segid C)
       )  2.0 2.0 0.0
!
assign ( resid 18  and segid B)
       (
        ( resid 7  and segid C)
     or
        ( resid 8  and segid C)
     or
        ( resid 9  and segid C)
     or
        ( resid 10  and segid C)
     or
        ( resid 19  and segid C)
     or
        ( resid 20  and segid C)
     or
        ( resid 21  and segid C)
     or
        ( resid 22  and segid C)
     or
        ( resid 6  and segid C)
     or
        ( resid 11  and segid C)
     or
        ( resid 18  and segid C)
     or
        ( resid 23  and segid C)
       )  2.0 2.0 0.0
!
assign ( resid 30  and segid B and name O)
       (
        ( resid 7  and segid C)
     or
        ( resid 8  and segid C)
     or
        ( resid 9  and segid C)
     or
        ( resid 10  and segid C)
     or
        ( resid 19  and segid C)
     or
        ( resid 20  and segid C)
     or
        ( resid 21  and segid C)
     or
        ( resid 22  and segid C)
     or
        ( resid 6  and segid C)
     or
        ( resid 11  and segid C)
     or
        ( resid 18  and segid C)
     or
        ( resid 23  and segid C)
       )  2.0 2.0 0.0
!
assign ( resid 32  and segid B and name HN )
       (
        ( resid 7  and segid C)
     or
        ( resid 8  and segid C)
     or
        ( resid 9  and segid C)
     or
        ( resid 10  and segid C)
     or
        ( resid 19  and segid C)
     or
        ( resid 20  and segid C)
     or
        ( resid 21  and segid C)
     or
        ( resid 22  and segid C)
     or
        ( resid 6  and segid C)
     or
        ( resid 11  and segid C)
     or
        ( resid 18  and segid C)
     or
        ( resid 23  and segid C)
       )  2.0 2.0 0.0
assign ( resid 32  and segid B and name O )
       (
        ( resid 7  and segid C)
     or
        ( resid 8  and segid C)
     or
        ( resid 9  and segid C)
     or
        ( resid 10  and segid C)
     or
        ( resid 19  and segid C)
     or
        ( resid 20  and segid C)
     or
        ( resid 21  and segid C)
     or
        ( resid 22  and segid C)
     or
        ( resid 6  and segid C)
     or
        ( resid 11  and segid C)
     or
        ( resid 18  and segid C)
     or
        ( resid 23  and segid C)
       )  2.0 2.0 0.0
!
assign ( resid 34  and segid B)
       (
        ( resid 7  and segid C)
     or
        ( resid 8  and segid C)
     or
        ( resid 9  and segid C)
     or
        ( resid 10  and segid C)
     or
        ( resid 19  and segid C)
     or
        ( resid 20  and segid C)
     or
        ( resid 21  and segid C)
     or
        ( resid 22  and segid C)
     or
        ( resid 6  and segid C)
     or
        ( resid 11  and segid C)
     or
        ( resid 18  and segid C)
     or
        ( resid 23  and segid C)
       )  2.0 2.0 0.0
!
assign ( resid 35  and segid B)
       (
        ( resid 7  and segid C)
     or
        ( resid 8  and segid C)
     or
        ( resid 9  and segid C)
     or
        ( resid 10  and segid C)
     or
        ( resid 19  and segid C)
     or
        ( resid 20  and segid C)
     or
        ( resid 21  and segid C)
     or
        ( resid 22  and segid C)
     or
        ( resid 6  and segid C)
     or
        ( resid 11  and segid C)
     or
        ( resid 18  and segid C)
     or
        ( resid 23  and segid C)
       )  2.0 2.0 0.0
!
assign ( resid 36  and segid B)
       (
        ( resid 7  and segid C)
     or
        ( resid 8  and segid C)
     or
        ( resid 9  and segid C)
     or
        ( resid 10  and segid C)
     or
        ( resid 19  and segid C)
     or
        ( resid 20  and segid C)
     or
        ( resid 21  and segid C)
     or
        ( resid 22  and segid C)
     or
        ( resid 6  and segid C)
     or
        ( resid 11  and segid C)
     or
        ( resid 18  and segid C)
     or
        ( resid 23  and segid C)
       )  2.0 2.0 0.0
!
assign ( resid 45  and segid B)
       (
        ( resid 7  and segid C)
     or
        ( resid 8  and segid C)
     or
        ( resid 9  and segid C)
     or
        ( resid 10  and segid C)
     or
        ( resid 19  and segid C)
     or
        ( resid 20  and segid C)
     or
        ( resid 21  and segid C)
     or
        ( resid 22  and segid C)
     or
        ( resid 6  and segid C)
     or
        ( resid 11  and segid C)
     or
        ( resid 18  and segid C)
     or
        ( resid 23  and segid C)
       )  2.0 2.0 0.0
!
assign ( resid 49  and segid B)
       (
        ( resid 7  and segid C)
     or
        ( resid 8  and segid C)
     or
        ( resid 9  and segid C)
     or
        ( resid 10  and segid C)
     or
        ( resid 19  and segid C)
     or
        ( resid 20  and segid C)
     or
        ( resid 21  and segid C)
     or
        ( resid 22  and segid C)
     or
        ( resid 6  and segid C)
     or
        ( resid 11  and segid C)
     or
        ( resid 18  and segid C)
     or
        ( resid 23  and segid C)
       )  2.0 2.0 0.0
!
! HADDOCK AIR restraints for 3rd molecule
!
!
assign ( resid 7  and segid C)
       (
        ( resid 4  and segid A)
     or
        ( resid 6  and segid A)
     or
        ( resid 8  and segid A)
     or
        ( resid 20  and segid A)
     or
        ( resid 21  and segid A)
     or
        ( resid 22  and segid A)
     or
        ( resid 24  and segid A)
     or
        ( resid 25  and segid A)
     or
        ( resid 26  and segid A)
     or
        ( resid 35  and segid A)
     or
        ( resid 39  and segid A)
     or
        ( resid 3  and segid A)
     or
        ( resid 27  and segid A)
     or
        ( resid 31  and segid A)
     or
        ( resid 70  and segid A)
     or
        ( resid 18  and segid A)
     or
        ( resid 38  and segid A)
     or
        ( resid 14  and segid B)
     or
        ( resid 16  and segid B)
     or
        ( resid 18  and segid B)
     or
        ( resid 30  and segid B)
     or
        ( resid 31  and segid B)
     or
        ( resid 32  and segid B)
     or
        ( resid 34  and segid B)
     or
        ( resid 35  and segid B)
     or
        ( resid 36  and segid B)
     or
        ( resid 45  and segid B)
     or
        ( resid 49  and segid B)
     or
        ( resid 13  and segid B)
     or
        ( resid 37  and segid B)
     or
        ( resid 41  and segid B)
     or
        ( resid 80  and segid B)
     or
        ( resid 28  and segid B)
     or
        ( resid 48  and segid B)
       )  2.0 2.0 0.0
!
assign ( resid 8  and segid C)
       (
        ( resid 4  and segid A)
     or
        ( resid 6  and segid A)
     or
        ( resid 8  and segid A)
     or
        ( resid 20  and segid A)
     or
        ( resid 21  and segid A)
     or
        ( resid 22  and segid A)
     or
        ( resid 24  and segid A)
     or
        ( resid 25  and segid A)
     or
        ( resid 26  and segid A)
     or
        ( resid 35  and segid A)
     or
        ( resid 39  and segid A)
     or
        ( resid 3  and segid A)
     or
        ( resid 27  and segid A)
     or
        ( resid 31  and segid A)
     or
        ( resid 70  and segid A)
     or
        ( resid 18  and segid A)
     or
        ( resid 38  and segid A)
     or
        ( resid 14  and segid B)
     or
        ( resid 16  and segid B)
     or
        ( resid 18  and segid B)
     or
        ( resid 30  and segid B)
     or
        ( resid 31  and segid B)
     or
        ( resid 32  and segid B)
     or
        ( resid 34  and segid B)
     or
        ( resid 35  and segid B)
     or
        ( resid 36  and segid B)
     or
        ( resid 45  and segid B)
     or
        ( resid 49  and segid B)
     or
        ( resid 13  and segid B)
     or
        ( resid 37  and segid B)
     or
        ( resid 41  and segid B)
     or
        ( resid 80  and segid B)
     or
        ( resid 28  and segid B)
     or
        ( resid 48  and segid B)
       )  2.0 2.0 0.0
!
assign ( resid 9  and segid C)
       (
        ( resid 4  and segid A)
     or
        ( resid 6  and segid A)
     or
        ( resid 8  and segid A)
     or
        ( resid 20  and segid A)
     or
        ( resid 21  and segid A)
     or
        ( resid 22  and segid A)
     or
        ( resid 24  and segid A)
     or
        ( resid 25  and segid A)
     or
        ( resid 26  and segid A)
     or
        ( resid 35  and segid A)
     or
        ( resid 39  and segid A)
     or
        ( resid 3  and segid A)
     or
        ( resid 27  and segid A)
     or
        ( resid 31  and segid A)
     or
        ( resid 70  and segid A)
     or
        ( resid 18  and segid A)
     or
        ( resid 38  and segid A)
     or
        ( resid 14  and segid B)
     or
        ( resid 16  and segid B)
     or
        ( resid 18  and segid B)
     or
        ( resid 30  and segid B)
     or
        ( resid 31  and segid B)
     or
        ( resid 32  and segid B)
     or
        ( resid 34  and segid B)
     or
        ( resid 35  and segid B)
     or
        ( resid 36  and segid B)
     or
        ( resid 45  and segid B)
     or
        ( resid 49  and segid B)
     or
        ( resid 13  and segid B)
     or
        ( resid 37  and segid B)
     or
        ( resid 41  and segid B)
     or
        ( resid 80  and segid B)
     or
        ( resid 28  and segid B)
     or
        ( resid 48  and segid B)
       )  4.0 4.0 0.0
!
assign ( resid 10  and segid C)
       (
        ( resid 4  and segid A)
     or
        ( resid 6  and segid A)
     or
        ( resid 8  and segid A)
     or
        ( resid 20  and segid A)
     or
        ( resid 21  and segid A)
     or
        ( resid 22  and segid A)
     or
        ( resid 24  and segid A)
     or
        ( resid 25  and segid A)
     or
        ( resid 26  and segid A)
     or
        ( resid 35  and segid A)
     or
        ( resid 39  and segid A)
     or
        ( resid 3  and segid A)
     or
        ( resid 27  and segid A)
     or
        ( resid 31  and segid A)
     or
        ( resid 70  and segid A)
     or
        ( resid 18  and segid A)
     or
        ( resid 38  and segid A)
     or
        ( resid 14  and segid B)
     or
        ( resid 16  and segid B)
     or
        ( resid 18  and segid B)
     or
        ( resid 30  and segid B)
     or
        ( resid 31  and segid B)
     or
        ( resid 32  and segid B)
     or
        ( resid 34  and segid B)
     or
        ( resid 35  and segid B)
     or
        ( resid 36  and segid B)
     or
        ( resid 45  and segid B)
     or
        ( resid 49  and segid B)
     or
        ( resid 13  and segid B)
     or
        ( resid 37  and segid B)
     or
        ( resid 41  and segid B)
     or
        ( resid 80  and segid B)
     or
        ( resid 28  and segid B)
     or
        ( resid 48  and segid B)
       )  2.0 2.0 0.0
!
assign ( resid 19  and segid C)
       (
        ( resid 4  and segid A)
     or
        ( resid 6  and segid A)
     or
        ( resid 8  and segid A)
     or
        ( resid 20  and segid A)
     or
        ( resid 21  and segid A)
     or
        ( resid 22  and segid A)
     or
        ( resid 24  and segid A)
     or
        ( resid 25  and segid A)
     or
        ( resid 26  and segid A)
     or
        ( resid 35  and segid A)
     or
        ( resid 39  and segid A)
     or
        ( resid 3  and segid A)
     or
        ( resid 27  and segid A)
     or
        ( resid 31  and segid A)
     or
        ( resid 70  and segid A)
     or
        ( resid 18  and segid A)
     or
        ( resid 38  and segid A)
     or
        ( resid 14  and segid B)
     or
        ( resid 16  and segid B)
     or
        ( resid 18  and segid B)
     or
        ( resid 30  and segid B)
     or
        ( resid 31  and segid B)
     or
        ( resid 32  and segid B)
     or
        ( resid 34  and segid B)
     or
        ( resid 35  and segid B)
     or
        ( resid 36  and segid B)
     or
        ( resid 45  and segid B)
     or
        ( resid 49  and segid B)
     or
        ( resid 13  and segid B)
     or
        ( resid 37  and segid B)
     or
        ( resid 41  and segid B)
     or
        ( resid 80  and segid B)
     or
        ( resid 28  and segid B)
     or
        ( resid 48  and segid B)
       )  2.0 2.0 0.0
!
assign ( resid 20  and segid C)
       (
        ( resid 4  and segid A)
     or
        ( resid 6  and segid A)
     or
        ( resid 8  and segid A)
     or
        ( resid 20  and segid A)
     or
        ( resid 21  and segid A)
     or
        ( resid 22  and segid A)
     or
        ( resid 24  and segid A)
     or
        ( resid 25  and segid A)
     or
        ( resid 26  and segid A)
     or
        ( resid 35  and segid A)
     or
        ( resid 39  and segid A)
     or
        ( resid 3  and segid A)
     or
        ( resid 27  and segid A)
     or
        ( resid 31  and segid A)
     or
        ( resid 70  and segid A)
     or
        ( resid 18  and segid A)
     or
        ( resid 38  and segid A)
     or
        ( resid 14  and segid B)
     or
        ( resid 16  and segid B)
     or
        ( resid 18  and segid B)
     or
        ( resid 30  and segid B)
     or
        ( resid 31  and segid B)
     or
        ( resid 32  and segid B)
     or
        ( resid 34  and segid B)
     or
        ( resid 35  and segid B)
     or
        ( resid 36  and segid B)
     or
        ( resid 45  and segid B)
     or
        ( resid 49  and segid B)
     or
        ( resid 13  and segid B)
     or
        ( resid 37  and segid B)
     or
        ( resid 41  and segid B)
     or
        ( resid 80  and segid B)
     or
        ( resid 28  and segid B)
     or
        ( resid 48  and segid B)
       )  2.0 2.0 0.0
!
assign ( resid 21  and segid C)
       (
        ( resid 4  and segid A)
     or
        ( resid 6  and segid A)
     or
        ( resid 8  and segid A)
     or
        ( resid 20  and segid A)
     or
        ( resid 21  and segid A)
     or
        ( resid 22  and segid A)
     or
        ( resid 24  and segid A)
     or
        ( resid 25  and segid A)
     or
        ( resid 26  and segid A)
     or
        ( resid 35  and segid A)
     or
        ( resid 39  and segid A)
     or
        ( resid 3  and segid A)
     or
        ( resid 27  and segid A)
     or
        ( resid 31  and segid A)
     or
        ( resid 70  and segid A)
     or
        ( resid 18  and segid A)
     or
        ( resid 38  and segid A)
     or
        ( resid 14  and segid B)
     or
        ( resid 16  and segid B)
     or
        ( resid 18  and segid B)
     or
        ( resid 30  and segid B)
     or
        ( resid 31  and segid B)
     or
        ( resid 32  and segid B)
     or
        ( resid 34  and segid B)
     or
        ( resid 35  and segid B)
     or
        ( resid 36  and segid B)
     or
        ( resid 45  and segid B)
     or
        ( resid 49  and segid B)
     or
        ( resid 13  and segid B)
     or
        ( resid 37  and segid B)
     or
        ( resid 41  and segid B)
     or
        ( resid 80  and segid B)
     or
        ( resid 28  and segid B)
     or
        ( resid 48  and segid B)
       )  4.0 4.0 0.0
!
assign ( resid 22  and segid C)
       (
        ( resid 4  and segid A)
     or
        ( resid 6  and segid A)
     or
        ( resid 8  and segid A)
     or
        ( resid 20  and segid A)
     or
        ( resid 21  and segid A)
     or
        ( resid 22  and segid A)
     or
        ( resid 24  and segid A)
     or
        ( resid 25  and segid A)
     or
        ( resid 26  and segid A)
     or
        ( resid 35  and segid A)
     or
        ( resid 39  and segid A)
     or
        ( resid 3  and segid A)
     or
        ( resid 27  and segid A)
     or
        ( resid 31  and segid A)
     or
        ( resid 70  and segid A)
     or
        ( resid 18  and segid A)
     or
        ( resid 38  and segid A)
     or
        ( resid 14  and segid B)
     or
        ( resid 16  and segid B)
     or
        ( resid 18  and segid B)
     or
        ( resid 30  and segid B)
     or
        ( resid 31  and segid B)
     or
        ( resid 32  and segid B)
     or
        ( resid 34  and segid B)
     or
        ( resid 35  and segid B)
     or
        ( resid 36  and segid B)
     or
        ( resid 45  and segid B)
     or
        ( resid 49  and segid B)
     or
        ( resid 13  and segid B)
     or
        ( resid 37  and segid B)
     or
        ( resid 41  and segid B)
     or
        ( resid 80  and segid B)
     or
        ( resid 28  and segid B)
     or
        ( resid 48  and segid B)
       )  2.0 2.0 0.0
!!! from spin label
assign ( resid 24 and segid B and name HN) ((resid 2 or resid 26) and segid C and name CB) 15.0 15.0 0.0
assign ( resid 25 and segid B and name HN) ((resid 2 or resid 26) and segid C and name CB) 15.0 15.0 0.0
assign ( resid 28 and segid B and name HN) ((resid 2 or resid 26) and segid C and name CB) 20.0 20.0 0.0
assign ( resid 45 and segid B and name HN) ((resid 2 or resid 26) and segid C and name CB) 20.0 20.0 0.0
assign ( resid 54 and segid B and name HN) ((resid 2 or resid 26) and segid C and name CB) 20.0 20.0 0.0
assign ( resid 87 and segid B and name HN) ((resid 2 or resid 26) and segid C and name CB) 20.0 20.0 0.0
!
assign ( resid 13 and segid A and name HN) ((resid 2 or resid 26) and segid C and name CB) 20.0 20.0 0.0
assign ( resid 14 and segid A and name HN) ((resid 2 or resid 26) and segid C and name CB) 15.0 15.0 0.0
assign ( resid 15 and segid A and name HN) ((resid 2 or resid 26) and segid C and name CB) 15.0 15.0 0.0
assign ( resid 18 and segid A and name HN) ((resid 2 or resid 26) and segid C and name CB) 20.0 20.0 0.0
assign ( resid 20 and segid A and name HN) ((resid 2 or resid 26) and segid C and name CB) 20.0 20.0 0.0
assign ( resid 35 and segid A and name HN) ((resid 2 or resid 26) and segid C and name CB) 20.0 20.0 0.0
assign ( resid 38 and segid A and name HN) ((resid 2 or resid 26) and segid C and name CB) 20.0 20.0 0.0
assign ( resid 39 and segid A and name HN) ((resid 2 or resid 26) and segid C and name CB) 20.0 20.0 0.0
assign ( resid 44 and segid A and name HN) ((resid 2 or resid 26) and segid C and name CB) 15.0 15.0 0.0
!assign ( resid 58 and segid A and name HN) ((resid 2 or resid 26) and segid C and name CB) 15.0 15.0 0.0
assign ( resid 77 and segid A and name HN) ((resid 2 or resid 26) and segid C and name CB) 15.0 15.0 0.0
!!! restraints according to similarity to MCAF-SUMO3 complex
assign ( resid 8 and segid C and name HG* ) (((resid 29 or resid 31 or resid 41 or resid 33 or resid 37 or resid 42)
           and segid B) or ((resid 19 or resid 21 or resid 31 or resid 23 or resid 27 or resid 32) and segid A))
                          2.0 2.0 0.0
assign ( resid 10 and segid C and name HD* ) (((resid 29 or resid 31 or resid 41 or resid 33 or resid 37 or resid 42)
           and segid B) or ((resid 19 or resid 21 or resid 31 or resid 23 or resid 27 or resid 32) and segid A))
                          2.0 2.0 0.0
assign ( resid 20 and segid C and name HG* ) (((resid 29 or resid 31 or resid 41 or resid 33 or resid 37 or resid 42)
           and segid B) or ((resid 19 or resid 21 or resid 31 or resid 23 or resid 27 or resid 32) and segid A))
                          2.0 2.0 0.0
assign ( resid 22 and segid C and name HD* ) (((resid 29 or resid 31 or resid 41 or resid 33 or resid 37 or resid 42)
           and segid B) or ((resid 19 or resid 21 or resid 31 or resid 23 or resid 27 or resid 32) and segid A))
                          2.0 2.0 0.0
assign ( resid 31 and segid B ) ((resid 8 or resid 20) and segid C ) 4.0 4.0 0.0
assign ( resid 31 and segid B ) ((resid 10 or resid 22) and segid C ) 4.0 4.0 0.0
assign ( resid 21 and segid A ) ((resid 8 or resid 20) and segid C ) 4.0 4.0 0.0
assign ( resid 21 and segid A ) ((resid 10 or resid 22) and segid C ) 4.0 4.0 0.0
assign (segid B and resid  16 and name c ) (segid B and resid  17 and name n ) 
 (segid B and resid  17 and name ca ) (segid B and resid  17 and name c ) 1.0   -135 31  2 ! 17 -135 31
assign (segid B and resid  17 and name n ) (segid B and resid  17 and name ca ) 
 (segid B and resid  17 and name c ) (segid B and resid  18 and name n ) 1.0   145 25  2 ! 17 145 25
assign (segid B and resid  17 and name c ) (segid B and resid  18 and name n ) 
 (segid B and resid  18 and name ca ) (segid B and resid  18 and name c ) 1.0   -115 28  2 ! 18 -115 28
assign (segid B and resid  18 and name n ) (segid B and resid  18 and name ca ) 
 (segid B and resid  18 and name c ) (segid B and resid  19 and name n ) 1.0   128 25  2 ! 18 128 25
assign (segid B and resid  18 and name c ) (segid B and resid  19 and name n ) 
 (segid B and resid  19 and name ca ) (segid B and resid  19 and name c ) 1.0   -128 25  2 ! 19 -128 25
assign (segid B and resid  19 and name n ) (segid B and resid  19 and name ca ) 
 (segid B and resid  19 and name c ) (segid B and resid  20 and name n ) 1.0   148 25  2 ! 19 148 25
assign (segid B and resid  19 and name c ) (segid B and resid  20 and name n ) 
 (segid B and resid  20 and name ca ) (segid B and resid  20 and name c ) 1.0   -124 50  2 ! 20 -124 50
assign (segid B and resid  20 and name n ) (segid B and resid  20 and name ca ) 
 (segid B and resid  20 and name c ) (segid B and resid  21 and name n ) 1.0   141 29  2 ! 20 141 29
assign (segid B and resid  20 and name c ) (segid B and resid  21 and name n ) 
 (segid B and resid  21 and name ca ) (segid B and resid  21 and name c ) 1.0   -107 30  2 ! 21 -107 30
assign (segid B and resid  21 and name n ) (segid B and resid  21 and name ca ) 
 (segid B and resid  21 and name c ) (segid B and resid  22 and name n ) 1.0   120 25  2 ! 21 120 25
assign (segid B and resid  21 and name c ) (segid B and resid  22 and name n ) 
 (segid B and resid  22 and name ca ) (segid B and resid  22 and name c ) 1.0   -110 27  2 ! 22 -110 27
assign (segid B and resid  22 and name n ) (segid B and resid  22 and name ca ) 
 (segid B and resid  22 and name c ) (segid B and resid  23 and name n ) 1.0   132 41  2 ! 22 132 41
assign (segid B and resid  27 and name c ) (segid B and resid  28 and name n ) 
 (segid B and resid  28 and name ca ) (segid B and resid  28 and name c ) 1.0   -118 33  2 ! 28 -118 33
assign (segid B and resid  28 and name n ) (segid B and resid  28 and name ca ) 
 (segid B and resid  28 and name c ) (segid B and resid  29 and name n ) 1.0   141 26  2 ! 28 141 26
assign (segid B and resid  28 and name c ) (segid B and resid  29 and name n ) 
 (segid B and resid  29 and name ca ) (segid B and resid  29 and name c ) 1.0   -128 25  2 ! 29 -128 25
assign (segid B and resid  29 and name n ) (segid B and resid  29 and name ca ) 
 (segid B and resid  29 and name c ) (segid B and resid  30 and name n ) 1.0   126 25  2 ! 29 126 25
assign (segid B and resid  29 and name c ) (segid B and resid  30 and name n ) 
 (segid B and resid  30 and name ca ) (segid B and resid  30 and name c ) 1.0   -115 52  2 ! 30 -115 52
assign (segid B and resid  30 and name n ) (segid B and resid  30 and name ca ) 
 (segid B and resid  30 and name c ) (segid B and resid  31 and name n ) 1.0   136 27  2 ! 30 136 27
assign (segid B and resid  30 and name c ) (segid B and resid  31 and name n ) 
 (segid B and resid  31 and name ca ) (segid B and resid  31 and name c ) 1.0   -130 36  2 ! 31 -130 36
assign (segid B and resid  31 and name n ) (segid B and resid  31 and name ca ) 
 (segid B and resid  31 and name c ) (segid B and resid  32 and name n ) 1.0   144 25  2 ! 31 144 25
assign (segid B and resid  31 and name c ) (segid B and resid  32 and name n ) 
 (segid B and resid  32 and name ca ) (segid B and resid  32 and name c ) 1.0   -103 41  2 ! 32 -103 41
assign (segid B and resid  32 and name n ) (segid B and resid  32 and name ca ) 
 (segid B and resid  32 and name c ) (segid B and resid  33 and name n ) 1.0   135 25  2 ! 32 135 25
assign (segid B and resid  32 and name c ) (segid B and resid  33 and name n ) 
 (segid B and resid  33 and name ca ) (segid B and resid  33 and name c ) 1.0   -139 25  2 ! 33 -139 25
assign (segid B and resid  33 and name n ) (segid B and resid  33 and name ca ) 
 (segid B and resid  33 and name c ) (segid B and resid  34 and name n ) 1.0   159 25  2 ! 33 159 25
assign (segid B and resid  38 and name c ) (segid B and resid  39 and name n ) 
 (segid B and resid  39 and name ca ) (segid B and resid  39 and name c ) 1.0   -54 25  2 ! 39 -54 25
assign (segid B and resid  39 and name n ) (segid B and resid  39 and name ca ) 
 (segid B and resid  39 and name c ) (segid B and resid  40 and name n ) 1.0   -44 25  2 ! 39 -44 25
assign (segid B and resid  39 and name c ) (segid B and resid  40 and name n ) 
 (segid B and resid  40 and name ca ) (segid B and resid  40 and name c ) 1.0   -62 25  2 ! 40 -62 25
assign (segid B and resid  40 and name n ) (segid B and resid  40 and name ca ) 
 (segid B and resid  40 and name c ) (segid B and resid  41 and name n ) 1.0   -36 25  2 ! 40 -36 25
assign (segid B and resid  40 and name c ) (segid B and resid  41 and name n ) 
 (segid B and resid  41 and name ca ) (segid B and resid  41 and name c ) 1.0   -65 25  2 ! 41 -65 25
assign (segid B and resid  41 and name n ) (segid B and resid  41 and name ca ) 
 (segid B and resid  41 and name c ) (segid B and resid  42 and name n ) 1.0   -38 25  2 ! 41 -38 25
assign (segid B and resid  41 and name c ) (segid B and resid  42 and name n ) 
 (segid B and resid  42 and name ca ) (segid B and resid  42 and name c ) 1.0   -64 25  2 ! 42 -64 25
assign (segid B and resid  42 and name n ) (segid B and resid  42 and name ca ) 
 (segid B and resid  42 and name c ) (segid B and resid  43 and name n ) 1.0   -43 25  2 ! 42 -43 25
assign (segid B and resid  42 and name c ) (segid B and resid  43 and name n ) 
 (segid B and resid  43 and name ca ) (segid B and resid  43 and name c ) 1.0   -60 25  2 ! 43 -60 25
assign (segid B and resid  43 and name n ) (segid B and resid  43 and name ca ) 
 (segid B and resid  43 and name c ) (segid B and resid  44 and name n ) 1.0   -43 25  2 ! 43 -43 25
assign (segid B and resid  43 and name c ) (segid B and resid  44 and name n ) 
 (segid B and resid  44 and name ca ) (segid B and resid  44 and name c ) 1.0   -62 25  2 ! 44 -62 25
assign (segid B and resid  44 and name n ) (segid B and resid  44 and name ca ) 
 (segid B and resid  44 and name c ) (segid B and resid  45 and name n ) 1.0   -43 25  2 ! 44 -43 25
assign (segid B and resid  44 and name c ) (segid B and resid  45 and name n ) 
 (segid B and resid  45 and name ca ) (segid B and resid  45 and name c ) 1.0   -66 25  2 ! 45 -66 25
assign (segid B and resid  45 and name n ) (segid B and resid  45 and name ca ) 
 (segid B and resid  45 and name c ) (segid B and resid  46 and name n ) 1.0   -36 25  2 ! 45 -36 25
assign (segid B and resid  45 and name c ) (segid B and resid  46 and name n ) 
 (segid B and resid  46 and name ca ) (segid B and resid  46 and name c ) 1.0   -65 25  2 ! 46 -65 25
assign (segid B and resid  46 and name n ) (segid B and resid  46 and name ca ) 
 (segid B and resid  46 and name c ) (segid B and resid  47 and name n ) 1.0   -45 25  2 ! 46 -45 25
assign (segid B and resid  46 and name c ) (segid B and resid  47 and name n ) 
 (segid B and resid  47 and name ca ) (segid B and resid  47 and name c ) 1.0   -59 25  2 ! 47 -59 25
assign (segid B and resid  47 and name n ) (segid B and resid  47 and name ca ) 
 (segid B and resid  47 and name c ) (segid B and resid  48 and name n ) 1.0   -44 25  2 ! 47 -44 25
assign (segid B and resid  47 and name c ) (segid B and resid  48 and name n ) 
 (segid B and resid  48 and name ca ) (segid B and resid  48 and name c ) 1.0   -61 25  2 ! 48 -61 25
assign (segid B and resid  48 and name n ) (segid B and resid  48 and name ca ) 
 (segid B and resid  48 and name c ) (segid B and resid  49 and name n ) 1.0   -42 25  2 ! 48 -42 25
assign (segid B and resid  48 and name c ) (segid B and resid  49 and name n ) 
 (segid B and resid  49 and name ca ) (segid B and resid  49 and name c ) 1.0   -64 25  2 ! 49 -64 25
assign (segid B and resid  49 and name n ) (segid B and resid  49 and name ca ) 
 (segid B and resid  49 and name c ) (segid B and resid  50 and name n ) 1.0   -31 25  2 ! 49 -31 25
assign (segid B and resid  56 and name c ) (segid B and resid  57 and name n ) 
 (segid B and resid  57 and name ca ) (segid B and resid  57 and name c ) 1.0   -118 42  2 ! 57 -118 42
assign (segid B and resid  57 and name n ) (segid B and resid  57 and name ca ) 
 (segid B and resid  57 and name c ) (segid B and resid  58 and name n ) 1.0   151 42  2 ! 57 151 42
assign (segid B and resid  57 and name c ) (segid B and resid  58 and name n ) 
 (segid B and resid  58 and name ca ) (segid B and resid  58 and name c ) 1.0   -136 36  2 ! 58 -136 36
assign (segid B and resid  58 and name n ) (segid B and resid  58 and name ca ) 
 (segid B and resid  58 and name c ) (segid B and resid  59 and name n ) 1.0   147 28  2 ! 58 147 28
assign (segid B and resid  58 and name c ) (segid B and resid  59 and name n ) 
 (segid B and resid  59 and name ca ) (segid B and resid  59 and name c ) 1.0   -113 25  2 ! 59 -113 25
assign (segid B and resid  59 and name n ) (segid B and resid  59 and name ca ) 
 (segid B and resid  59 and name c ) (segid B and resid  60 and name n ) 1.0   138 25  2 ! 59 138 25
assign (segid B and resid  59 and name c ) (segid B and resid  60 and name n ) 
 (segid B and resid  60 and name ca ) (segid B and resid  60 and name c ) 1.0   -129 25  2 ! 60 -129 25
assign (segid B and resid  60 and name n ) (segid B and resid  60 and name ca ) 
 (segid B and resid  60 and name c ) (segid B and resid  61 and name n ) 1.0   150 25  2 ! 60 150 25
assign (segid B and resid  60 and name c ) (segid B and resid  61 and name n ) 
 (segid B and resid  61 and name ca ) (segid B and resid  61 and name c ) 1.0   -131 35  2 ! 61 -131 35
assign (segid B and resid  61 and name n ) (segid B and resid  61 and name ca ) 
 (segid B and resid  61 and name c ) (segid B and resid  62 and name n ) 1.0   128 25  2 ! 61 128 25
assign (segid B and resid  61 and name c ) (segid B and resid  62 and name n ) 
 (segid B and resid  62 and name ca ) (segid B and resid  62 and name c ) 1.0   -79 36  2 ! 62 -79 36
assign (segid B and resid  62 and name n ) (segid B and resid  62 and name ca ) 
 (segid B and resid  62 and name c ) (segid B and resid  63 and name n ) 1.0   119 38  2 ! 62 119 38
assign (segid B and resid  71 and name c ) (segid B and resid  72 and name n ) 
 (segid B and resid  72 and name ca ) (segid B and resid  72 and name c ) 1.0   -54 25  2 ! 72 -54 25
assign (segid B and resid  72 and name n ) (segid B and resid  72 and name ca ) 
 (segid B and resid  72 and name c ) (segid B and resid  73 and name n ) 1.0   -31 25  2 ! 72 -31 25
assign (segid B and resid  72 and name c ) (segid B and resid  73 and name n ) 
 (segid B and resid  73 and name ca ) (segid B and resid  73 and name c ) 1.0   -67 25  2 ! 73 -67 25
assign (segid B and resid  73 and name n ) (segid B and resid  73 and name ca ) 
 (segid B and resid  73 and name c ) (segid B and resid  74 and name n ) 1.0   -34 25  2 ! 73 -34 25
assign (segid B and resid  73 and name c ) (segid B and resid  74 and name n ) 
 (segid B and resid  74 and name ca ) (segid B and resid  74 and name c ) 1.0   -65 25  2 ! 74 -65 25
assign (segid B and resid  74 and name n ) (segid B and resid  74 and name ca ) 
 (segid B and resid  74 and name c ) (segid B and resid  75 and name n ) 1.0   -35 25  2 ! 74 -35 25
assign (segid B and resid  81 and name c ) (segid B and resid  82 and name n ) 
 (segid B and resid  82 and name ca ) (segid B and resid  82 and name c ) 1.0   -116 38  2 ! 82 -116 38
assign (segid B and resid  82 and name n ) (segid B and resid  82 and name ca ) 
 (segid B and resid  82 and name c ) (segid B and resid  83 and name n ) 1.0   133 25  2 ! 82 133 25
assign (segid B and resid  82 and name c ) (segid B and resid  83 and name n ) 
 (segid B and resid  83 and name ca ) (segid B and resid  83 and name c ) 1.0   -127 26  2 ! 83 -127 26
assign (segid B and resid  83 and name n ) (segid B and resid  83 and name ca ) 
 (segid B and resid  83 and name c ) (segid B and resid  84 and name n ) 1.0   129 25  2 ! 83 129 25
assign (segid B and resid  83 and name c ) (segid B and resid  84 and name n ) 
 (segid B and resid  84 and name ca ) (segid B and resid  84 and name c ) 1.0   -115 46  2 ! 84 -115 46
assign (segid B and resid  84 and name n ) (segid B and resid  84 and name ca ) 
 (segid B and resid  84 and name c ) (segid B and resid  85 and name n ) 1.0   147 25  2 ! 84 147 25
assign (segid B and resid  84 and name c ) (segid B and resid  85 and name n ) 
 (segid B and resid  85 and name ca ) (segid B and resid  85 and name c ) 1.0   -115 33  2 ! 85 -115 33
assign (segid B and resid  85 and name n ) (segid B and resid  85 and name ca ) 
 (segid B and resid  85 and name c ) (segid B and resid  86 and name n ) 1.0   136 25  2 ! 85 136 25
assign (segid B and resid  85 and name c ) (segid B and resid  86 and name n ) 
 (segid B and resid  86 and name ca ) (segid B and resid  86 and name c ) 1.0   -127 39  2 ! 86 -127 39
assign (segid B and resid  86 and name n ) (segid B and resid  86 and name ca ) 
 (segid B and resid  86 and name c ) (segid B and resid  87 and name n ) 1.0   144 35  2 ! 86 144 35
assign (segid B and resid  86 and name c ) (segid B and resid  87 and name n ) 
 (segid B and resid  87 and name ca ) (segid B and resid  87 and name c ) 1.0   -105 39  2 ! 87 -105 39
assign (segid B and resid  87 and name n ) (segid B and resid  87 and name ca ) 
 (segid B and resid  87 and name c ) (segid B and resid  88 and name n ) 1.0   128 38  2 ! 87 128 38
assign (segid B and resid  87 and name c ) (segid B and resid  88 and name n ) 
 (segid B and resid  88 and name ca ) (segid B and resid  88 and name c ) 1.0   -105 53  2 ! 88 -105 53
assign (segid B and resid  88 and name n ) (segid B and resid  88 and name ca ) 
 (segid B and resid  88 and name c ) (segid B and resid  89 and name n ) 1.0   137 39  2 ! 88 137 39
assign (segid A and resid  6 and name c ) (segid A and resid  7 and name n ) 
 (segid A and resid  7 and name ca ) (segid A and resid  7 and name c ) 1.0   -134 38  2 ! 7 -134 38
assign (segid A and resid  7 and name n ) (segid A and resid  7 and name ca ) 
 (segid A and resid  7 and name c ) (segid A and resid  8 and name n ) 1.0   147 25  2 ! 7 147 25
assign (segid A and resid  7 and name c ) (segid A and resid  8 and name n ) 
 (segid A and resid  8 and name ca ) (segid A and resid  8 and name c ) 1.0   -116 30  2 ! 8 -116 30
assign (segid A and resid  8 and name n ) (segid A and resid  8 and name ca ) 
 (segid A and resid  8 and name c ) (segid A and resid  9 and name n ) 1.0   131 25  2 ! 8 131 25
assign (segid A and resid  8 and name c ) (segid A and resid  9 and name n ) 
 (segid A and resid  9 and name ca ) (segid A and resid  9 and name c ) 1.0   -128 25  2 ! 9 -128 25
assign (segid A and resid  9 and name n ) (segid A and resid  9 and name ca ) 
 (segid A and resid  9 and name c ) (segid A and resid  10 and name n ) 1.0   150 25  2 ! 9 150 25
assign (segid A and resid  9 and name c ) (segid A and resid  10 and name n ) 
 (segid A and resid  10 and name ca ) (segid A and resid  10 and name c ) 1.0   -117 51  2 ! 10 -117 51
assign (segid A and resid  10 and name n ) (segid A and resid  10 and name ca ) 
 (segid A and resid  10 and name c ) (segid A and resid  11 and name n ) 1.0   143 29  2 ! 10 143 29
assign (segid A and resid  10 and name c ) (segid A and resid  11 and name n ) 
 (segid A and resid  11 and name ca ) (segid A and resid  11 and name c ) 1.0   -108 35  2 ! 11 -108 35
assign (segid A and resid  11 and name n ) (segid A and resid  11 and name ca ) 
 (segid A and resid  11 and name c ) (segid A and resid  12 and name n ) 1.0   123 26  2 ! 11 123 26
assign (segid A and resid  11 and name c ) (segid A and resid  12 and name n ) 
 (segid A and resid  12 and name ca ) (segid A and resid  12 and name c ) 1.0   -109 26  2 ! 12 -109 26
assign (segid A and resid  12 and name n ) (segid A and resid  12 and name ca ) 
 (segid A and resid  12 and name c ) (segid A and resid  13 and name n ) 1.0   134 39  2 ! 12 134 39
assign (segid A and resid  17 and name c ) (segid A and resid  18 and name n ) 
 (segid A and resid  18 and name ca ) (segid A and resid  18 and name c ) 1.0   -121 26  2 ! 18 -121 26
assign (segid A and resid  18 and name n ) (segid A and resid  18 and name ca ) 
 (segid A and resid  18 and name c ) (segid A and resid  19 and name n ) 1.0   140 25  2 ! 18 140 25
assign (segid A and resid  18 and name c ) (segid A and resid  19 and name n ) 
 (segid A and resid  19 and name ca ) (segid A and resid  19 and name c ) 1.0   -126 25  2 ! 19 -126 25
assign (segid A and resid  19 and name n ) (segid A and resid  19 and name ca ) 
 (segid A and resid  19 and name c ) (segid A and resid  20 and name n ) 1.0   126 25  2 ! 19 126 25
assign (segid A and resid  19 and name c ) (segid A and resid  20 and name n ) 
 (segid A and resid  20 and name ca ) (segid A and resid  20 and name c ) 1.0   -122 46  2 ! 20 -122 46
assign (segid A and resid  20 and name n ) (segid A and resid  20 and name ca ) 
 (segid A and resid  20 and name c ) (segid A and resid  21 and name n ) 1.0   138 29  2 ! 20 138 29
assign (segid A and resid  20 and name c ) (segid A and resid  21 and name n ) 
 (segid A and resid  21 and name ca ) (segid A and resid  21 and name c ) 1.0   -134 25  2 ! 21 -134 25
assign (segid A and resid  21 and name n ) (segid A and resid  21 and name ca ) 
 (segid A and resid  21 and name c ) (segid A and resid  22 and name n ) 1.0   141 26  2 ! 21 141 26
assign (segid A and resid  21 and name c ) (segid A and resid  22 and name n ) 
 (segid A and resid  22 and name ca ) (segid A and resid  22 and name c ) 1.0   -103 41  2 ! 22 -103 41
assign (segid A and resid  22 and name n ) (segid A and resid  22 and name ca ) 
 (segid A and resid  22 and name c ) (segid A and resid  23 and name n ) 1.0   135 25  2 ! 22 135 25
assign (segid A and resid  22 and name c ) (segid A and resid  23 and name n ) 
 (segid A and resid  23 and name ca ) (segid A and resid  23 and name c ) 1.0   -138 25  2 ! 23 -138 25
assign (segid A and resid  23 and name n ) (segid A and resid  23 and name ca ) 
 (segid A and resid  23 and name c ) (segid A and resid  24 and name n ) 1.0   156 25  2 ! 23 156 25
assign (segid A and resid  28 and name c ) (segid A and resid  29 and name n ) 
 (segid A and resid  29 and name ca ) (segid A and resid  29 and name c ) 1.0   -59 25  2 ! 29 -59 25
assign (segid A and resid  29 and name n ) (segid A and resid  29 and name ca ) 
 (segid A and resid  29 and name c ) (segid A and resid  30 and name n ) 1.0   -43 25  2 ! 29 -43 25
assign (segid A and resid  29 and name c ) (segid A and resid  30 and name n ) 
 (segid A and resid  30 and name ca ) (segid A and resid  30 and name c ) 1.0   -61 25  2 ! 30 -61 25
assign (segid A and resid  30 and name n ) (segid A and resid  30 and name ca ) 
 (segid A and resid  30 and name c ) (segid A and resid  31 and name n ) 1.0   -42 25  2 ! 30 -42 25
assign (segid A and resid  30 and name c ) (segid A and resid  31 and name n ) 
 (segid A and resid  31 and name ca ) (segid A and resid  31 and name c ) 1.0   -65 25  2 ! 31 -65 25
assign (segid A and resid  31 and name n ) (segid A and resid  31 and name ca ) 
 (segid A and resid  31 and name c ) (segid A and resid  32 and name n ) 1.0   -38 25  2 ! 31 -38 25
assign (segid A and resid  31 and name c ) (segid A and resid  32 and name n ) 
 (segid A and resid  32 and name ca ) (segid A and resid  32 and name c ) 1.0   -65 25  2 ! 32 -65 25
assign (segid A and resid  32 and name n ) (segid A and resid  32 and name ca ) 
 (segid A and resid  32 and name c ) (segid A and resid  33 and name n ) 1.0   -44 25  2 ! 32 -44 25
assign (segid A and resid  32 and name c ) (segid A and resid  33 and name n ) 
 (segid A and resid  33 and name ca ) (segid A and resid  33 and name c ) 1.0   -59 25  2 ! 33 -59 25
assign (segid A and resid  33 and name n ) (segid A and resid  33 and name ca ) 
 (segid A and resid  33 and name c ) (segid A and resid  34 and name n ) 1.0   -43 25  2 ! 33 -43 25
assign (segid A and resid  33 and name c ) (segid A and resid  34 and name n ) 
 (segid A and resid  34 and name ca ) (segid A and resid  34 and name c ) 1.0   -63 25  2 ! 34 -63 25
assign (segid A and resid  34 and name n ) (segid A and resid  34 and name ca ) 
 (segid A and resid  34 and name c ) (segid A and resid  35 and name n ) 1.0   -44 25  2 ! 34 -44 25
assign (segid A and resid  34 and name c ) (segid A and resid  35 and name n ) 
 (segid A and resid  35 and name ca ) (segid A and resid  35 and name c ) 1.0   -65 25  2 ! 35 -65 25
assign (segid A and resid  35 and name n ) (segid A and resid  35 and name ca ) 
 (segid A and resid  35 and name c ) (segid A and resid  36 and name n ) 1.0   -37 25  2 ! 35 -37 25
assign (segid A and resid  35 and name c ) (segid A and resid  36 and name n ) 
 (segid A and resid  36 and name ca ) (segid A and resid  36 and name c ) 1.0   -66 25  2 ! 36 -66 25
assign (segid A and resid  36 and name n ) (segid A and resid  36 and name ca ) 
 (segid A and resid  36 and name c ) (segid A and resid  37 and name n ) 1.0   -45 25  2 ! 36 -45 25
assign (segid A and resid  36 and name c ) (segid A and resid  37 and name n ) 
 (segid A and resid  37 and name ca ) (segid A and resid  37 and name c ) 1.0   -60 25  2 ! 37 -60 25
assign (segid A and resid  37 and name n ) (segid A and resid  37 and name ca ) 
 (segid A and resid  37 and name c ) (segid A and resid  38 and name n ) 1.0   -44 25  2 ! 37 -44 25
assign (segid A and resid  37 and name c ) (segid A and resid  38 and name n ) 
 (segid A and resid  38 and name ca ) (segid A and resid  38 and name c ) 1.0   -61 25  2 ! 38 -61 25
assign (segid A and resid  38 and name n ) (segid A and resid  38 and name ca ) 
 (segid A and resid  38 and name c ) (segid A and resid  39 and name n ) 1.0   -42 25  2 ! 38 -42 25
assign (segid A and resid  38 and name c ) (segid A and resid  39 and name n ) 
 (segid A and resid  39 and name ca ) (segid A and resid  39 and name c ) 1.0   -62 25  2 ! 39 -62 25
assign (segid A and resid  39 and name n ) (segid A and resid  39 and name ca ) 
 (segid A and resid  39 and name c ) (segid A and resid  40 and name n ) 1.0   -35 25  2 ! 39 -35 25
assign (segid A and resid  46 and name c ) (segid A and resid  47 and name n ) 
 (segid A and resid  47 and name ca ) (segid A and resid  47 and name c ) 1.0   -118 42  2 ! 47 -118 42
assign (segid A and resid  47 and name n ) (segid A and resid  47 and name ca ) 
 (segid A and resid  47 and name c ) (segid A and resid  48 and name n ) 1.0   151 42  2 ! 47 151 42
assign (segid A and resid  47 and name c ) (segid A and resid  48 and name n ) 
 (segid A and resid  48 and name ca ) (segid A and resid  48 and name c ) 1.0   -136 36  2 ! 48 -136 36
assign (segid A and resid  48 and name n ) (segid A and resid  48 and name ca ) 
 (segid A and resid  48 and name c ) (segid A and resid  49 and name n ) 1.0   147 28  2 ! 48 147 28
assign (segid A and resid  48 and name c ) (segid A and resid  49 and name n ) 
 (segid A and resid  49 and name ca ) (segid A and resid  49 and name c ) 1.0   -113 25  2 ! 49 -113 25
assign (segid A and resid  49 and name n ) (segid A and resid  49 and name ca ) 
 (segid A and resid  49 and name c ) (segid A and resid  50 and name n ) 1.0   138 25  2 ! 49 138 25
assign (segid A and resid  49 and name c ) (segid A and resid  50 and name n ) 
 (segid A and resid  50 and name ca ) (segid A and resid  50 and name c ) 1.0   -130 25  2 ! 50 -130 25
assign (segid A and resid  50 and name n ) (segid A and resid  50 and name ca ) 
 (segid A and resid  50 and name c ) (segid A and resid  51 and name n ) 1.0   150 25  2 ! 50 150 25
assign (segid A and resid  50 and name c ) (segid A and resid  51 and name n ) 
 (segid A and resid  51 and name ca ) (segid A and resid  51 and name c ) 1.0   -128 32  2 ! 51 -128 32
assign (segid A and resid  51 and name n ) (segid A and resid  51 and name ca ) 
 (segid A and resid  51 and name c ) (segid A and resid  52 and name n ) 1.0   125 25  2 ! 51 125 25
assign (segid A and resid  51 and name c ) (segid A and resid  52 and name n ) 
 (segid A and resid  52 and name ca ) (segid A and resid  52 and name c ) 1.0   -83 37  2 ! 52 -83 37
assign (segid A and resid  52 and name n ) (segid A and resid  52 and name ca ) 
 (segid A and resid  52 and name c ) (segid A and resid  53 and name n ) 1.0   117 50  2 ! 52 117 50
assign (segid A and resid  61 and name c ) (segid A and resid  62 and name n ) 
 (segid A and resid  62 and name ca ) (segid A and resid  62 and name c ) 1.0   -54 25  2 ! 62 -54 25
assign (segid A and resid  62 and name n ) (segid A and resid  62 and name ca ) 
 (segid A and resid  62 and name c ) (segid A and resid  63 and name n ) 1.0   -31 25  2 ! 62 -31 25
assign (segid A and resid  62 and name c ) (segid A and resid  63 and name n ) 
 (segid A and resid  63 and name ca ) (segid A and resid  63 and name c ) 1.0   -67 25  2 ! 63 -67 25
assign (segid A and resid  63 and name n ) (segid A and resid  63 and name ca ) 
 (segid A and resid  63 and name c ) (segid A and resid  64 and name n ) 1.0   -34 25  2 ! 63 -34 25
assign (segid A and resid  63 and name c ) (segid A and resid  64 and name n ) 
 (segid A and resid  64 and name ca ) (segid A and resid  64 and name c ) 1.0   -65 25  2 ! 64 -65 25
assign (segid A and resid  64 and name n ) (segid A and resid  64 and name ca ) 
 (segid A and resid  64 and name c ) (segid A and resid  65 and name n ) 1.0   -35 25  2 ! 64 -35 25
assign (segid A and resid  71 and name c ) (segid A and resid  72 and name n ) 
 (segid A and resid  72 and name ca ) (segid A and resid  72 and name c ) 1.0   -115 40  2 ! 72 -115 40
assign (segid A and resid  72 and name n ) (segid A and resid  72 and name ca ) 
 (segid A and resid  72 and name c ) (segid A and resid  73 and name n ) 1.0   136 25  2 ! 72 136 25
assign (segid A and resid  72 and name c ) (segid A and resid  73 and name n ) 
 (segid A and resid  73 and name ca ) (segid A and resid  73 and name c ) 1.0   -128 27  2 ! 73 -128 27
assign (segid A and resid  73 and name n ) (segid A and resid  73 and name ca ) 
 (segid A and resid  73 and name c ) (segid A and resid  74 and name n ) 1.0   131 25  2 ! 73 131 25
assign (segid A and resid  73 and name c ) (segid A and resid  74 and name n ) 
 (segid A and resid  74 and name ca ) (segid A and resid  74 and name c ) 1.0   -112 42  2 ! 74 -112 42
assign (segid A and resid  74 and name n ) (segid A and resid  74 and name ca ) 
 (segid A and resid  74 and name c ) (segid A and resid  75 and name n ) 1.0   146 25  2 ! 74 146 25
assign (segid A and resid  74 and name c ) (segid A and resid  75 and name n ) 
 (segid A and resid  75 and name ca ) (segid A and resid  75 and name c ) 1.0   -118 36  2 ! 75 -118 36
assign (segid A and resid  75 and name n ) (segid A and resid  75 and name ca ) 
 (segid A and resid  75 and name c ) (segid A and resid  76 and name n ) 1.0   134 25  2 ! 75 134 25
assign (segid A and resid  75 and name c ) (segid A and resid  76 and name n ) 
 (segid A and resid  76 and name ca ) (segid A and resid  76 and name c ) 1.0   -127 38  2 ! 76 -127 38
assign (segid A and resid  76 and name n ) (segid A and resid  76 and name ca ) 
 (segid A and resid  76 and name c ) (segid A and resid  77 and name n ) 1.0   148 25  2 ! 76 148 25
assign (segid A and resid  76 and name c ) (segid A and resid  77 and name n ) 
 (segid A and resid  77 and name ca ) (segid A and resid  77 and name c ) 1.0   -103 40  2 ! 77 -103 40
assign (segid A and resid  77 and name n ) (segid A and resid  77 and name ca ) 
 (segid A and resid  77 and name c ) (segid A and resid  78 and name n ) 1.0   132 31  2 ! 77 132 31
assign ( resid 600  and name OO  )
       ( resid 600  and name Z   )
       ( resid 600  and name X   )
       ( resid 600  and name Y   )
       ( segid A and resid     3 and name  N  )
       ( segid A and resid     3 and name HN  )     -0.730  1.000

assign ( resid 600  and name OO  )
       ( resid 600  and name Z   )
       ( resid 600  and name X   )
       ( resid 600  and name Y   )
       ( segid A and resid     5 and name  N  )
       ( segid A and resid     5 and name HN  )     -1.220  1.000

assign ( resid 600  and name OO  )
       ( resid 600  and name Z   )
       ( resid 600  and name X   )
       ( resid 600  and name Y   )
       ( segid A and resid     6 and name  N  )
       ( segid A and resid     6 and name HN  )     -7.170  1.000

assign ( resid 600  and name OO  )
       ( resid 600  and name Z   )
       ( resid 600  and name X   )
       ( resid 600  and name Y   )
       ( segid A and resid     7 and name  N  )
       ( segid A and resid     7 and name HN  )     -8.880  1.000

assign ( resid 600  and name OO  )
       ( resid 600  and name Z   )
       ( resid 600  and name X   )
       ( resid 600  and name Y   )
       ( segid A and resid     8 and name  N  )
       ( segid A and resid     8 and name HN  )     -8.330  1.000

assign ( resid 600  and name OO  )
       ( resid 600  and name Z   )
       ( resid 600  and name X   )
       ( resid 600  and name Y   )
       ( segid A and resid     9 and name  N  )
       ( segid A and resid     9 and name HN  )     -2.680  1.000

assign ( resid 600  and name OO  )
       ( resid 600  and name Z   )
       ( resid 600  and name X   )
       ( resid 600  and name Y   )
       ( segid A and resid    10 and name  N  )
       ( segid A and resid    10 and name HN  )     -6.380  1.000

assign ( resid 600  and name OO  )
       ( resid 600  and name Z   )
       ( resid 600  and name X   )
       ( resid 600  and name Y   )
       ( segid A and resid    11 and name  N  )
       ( segid A and resid    11 and name HN  )     -0.970  1.000

assign ( resid 600  and name OO  )
       ( resid 600  and name Z   )
       ( resid 600  and name X   )
       ( resid 600  and name Y   )
       ( segid A and resid    12 and name  N  )
       ( segid A and resid    12 and name HN  )      1.880  1.000

assign ( resid 600  and name OO  )
       ( resid 600  and name Z   )
       ( resid 600  and name X   )
       ( resid 600  and name Y   )
       ( segid A and resid    13 and name  N  )
       ( segid A and resid    13 and name HN  )      2.190  1.000

assign ( resid 600  and name OO  )
       ( resid 600  and name Z   )
       ( resid 600  and name X   )
       ( resid 600  and name Y   )
       ( segid A and resid    15 and name  N  )
       ( segid A and resid    15 and name HN  )     11.920  1.000

assign ( resid 600  and name OO  )
       ( resid 600  and name Z   )
       ( resid 600  and name X   )
       ( resid 600  and name Y   )
       ( segid A and resid    16 and name  N  )
       ( segid A and resid    16 and name HN  )      9.240  1.000

assign ( resid 600  and name OO  )
       ( resid 600  and name Z   )
       ( resid 600  and name X   )
       ( resid 600  and name Y   )
       ( segid A and resid    17 and name  N  )
       ( segid A and resid    17 and name HN  )     -9.120  1.000

assign ( resid 600  and name OO  )
       ( resid 600  and name Z   )
       ( resid 600  and name X   )
       ( resid 600  and name Y   )
       ( segid A and resid    18 and name  N  )
       ( segid A and resid    18 and name HN  )      3.220  1.000

assign ( resid 600  and name OO  )
       ( resid 600  and name Z   )
       ( resid 600  and name X   )
       ( resid 600  and name Y   )
       ( segid A and resid    19 and name  N  )
       ( segid A and resid    19 and name HN  )     -0.180  1.000

assign ( resid 600  and name OO  )
       ( resid 600  and name Z   )
       ( resid 600  and name X   )
       ( resid 600  and name Y   )
       ( segid A and resid    20 and name  N  )
       ( segid A and resid    20 and name HN  )     -1.880  1.000

assign ( resid 600  and name OO  )
       ( resid 600  and name Z   )
       ( resid 600  and name X   )
       ( resid 600  and name Y   )
       ( segid A and resid    21 and name  N  )
       ( segid A and resid    21 and name HN  )     -5.350  1.000

assign ( resid 600  and name OO  )
       ( resid 600  and name Z   )
       ( resid 600  and name X   )
       ( resid 600  and name Y   )
       ( segid A and resid    23 and name  N  )
       ( segid A and resid    23 and name HN  )     -1.400  1.000

assign ( resid 600  and name OO  )
       ( resid 600  and name Z   )
       ( resid 600  and name X   )
       ( resid 600  and name Y   )
       ( segid A and resid    24 and name  N  )
       ( segid A and resid    24 and name HN  )     -5.170  1.000

assign ( resid 600  and name OO  )
       ( resid 600  and name Z   )
       ( resid 600  and name X   )
       ( resid 600  and name Y   )
       ( segid A and resid    25 and name  N  )
       ( segid A and resid    25 and name HN  )    -13.680  1.000

assign ( resid 600  and name OO  )
       ( resid 600  and name Z   )
       ( resid 600  and name X   )
       ( resid 600  and name Y   )
       ( segid A and resid    27 and name  N  )
       ( segid A and resid    27 and name HN  )      9.910  1.000

assign ( resid 600  and name OO  )
       ( resid 600  and name Z   )
       ( resid 600  and name X   )
       ( resid 600  and name Y   )
       ( segid A and resid    29 and name  N  )
       ( segid A and resid    29 and name HN  )     -4.130  1.000

assign ( resid 600  and name OO  )
       ( resid 600  and name Z   )
       ( resid 600  and name X   )
       ( resid 600  and name Y   )
       ( segid A and resid    30 and name  N  )
       ( segid A and resid    30 and name HN  )      4.800  1.000

assign ( resid 600  and name OO  )
       ( resid 600  and name Z   )
       ( resid 600  and name X   )
       ( resid 600  and name Y   )
       ( segid A and resid    31 and name  N  )
       ( segid A and resid    31 and name HN  )     -9.060  1.000

assign ( resid 600  and name OO  )
       ( resid 600  and name Z   )
       ( resid 600  and name X   )
       ( resid 600  and name Y   )
       ( segid A and resid    32 and name  N  )
       ( segid A and resid    32 and name HN  )     -3.590  1.000

assign ( resid 600  and name OO  )
       ( resid 600  and name Z   )
       ( resid 600  and name X   )
       ( resid 600  and name Y   )
       ( segid A and resid    33 and name  N  )
       ( segid A and resid    33 and name HN  )      4.190  1.000

assign ( resid 600  and name OO  )
       ( resid 600  and name Z   )
       ( resid 600  and name X   )
       ( resid 600  and name Y   )
       ( segid A and resid    34 and name  N  )
       ( segid A and resid    34 and name HN  )     -0.730  1.000

assign ( resid 600  and name OO  )
       ( resid 600  and name Z   )
       ( resid 600  and name X   )
       ( resid 600  and name Y   )
       ( segid A and resid    35 and name  N  )
       ( segid A and resid    35 and name HN  )     -8.330  1.000

assign ( resid 600  and name OO  )
       ( resid 600  and name Z   )
       ( resid 600  and name X   )
       ( resid 600  and name Y   )
       ( segid A and resid    36 and name  N  )
       ( segid A and resid    36 and name HN  )      0.300  1.000

assign ( resid 600  and name OO  )
       ( resid 600  and name Z   )
       ( resid 600  and name X   )
       ( resid 600  and name Y   )
       ( segid A and resid    37 and name  N  )
       ( segid A and resid    37 and name HN  )      5.960  1.000

assign ( resid 600  and name OO  )
       ( resid 600  and name Z   )
       ( resid 600  and name X   )
       ( resid 600  and name Y   )
       ( segid A and resid    38 and name  N  )
       ( segid A and resid    38 and name HN  )     -6.630  1.000

assign ( resid 600  and name OO  )
       ( resid 600  and name Z   )
       ( resid 600  and name X   )
       ( resid 600  and name Y   )
       ( segid A and resid    39 and name  N  )
       ( segid A and resid    39 and name HN  )     -7.420  1.000

assign ( resid 600  and name OO  )
       ( resid 600  and name Z   )
       ( resid 600  and name X   )
       ( resid 600  and name Y   )
       ( segid A and resid    40 and name  N  )
       ( segid A and resid    40 and name HN  )      3.280  1.000

assign ( resid 600  and name OO  )
       ( resid 600  and name Z   )
       ( resid 600  and name X   )
       ( resid 600  and name Y   )
       ( segid A and resid    41 and name  N  )
       ( segid A and resid    41 and name HN  )      1.760  1.000

assign ( resid 600  and name OO  )
       ( resid 600  and name Z   )
       ( resid 600  and name X   )
       ( resid 600  and name Y   )
       ( segid A and resid    42 and name  N  )
       ( segid A and resid    42 and name HN  )    -10.460  1.000

assign ( resid 600  and name OO  )
       ( resid 600  and name Z   )
       ( resid 600  and name X   )
       ( resid 600  and name Y   )
       ( segid A and resid    43 and name  N  )
       ( segid A and resid    43 and name HN  )      6.690  1.000

assign ( resid 600  and name OO  )
       ( resid 600  and name Z   )
       ( resid 600  and name X   )
       ( resid 600  and name Y   )
       ( segid A and resid    45 and name  N  )
       ( segid A and resid    45 and name HN  )     -4.560  1.000

assign ( resid 600  and name OO  )
       ( resid 600  and name Z   )
       ( resid 600  and name X   )
       ( resid 600  and name Y   )
       ( segid A and resid    46 and name  N  )
       ( segid A and resid    46 and name HN  )     -1.700  1.000

assign ( resid 600  and name OO  )
       ( resid 600  and name Z   )
       ( resid 600  and name X   )
       ( resid 600  and name Y   )
       ( segid A and resid    47 and name  N  )
       ( segid A and resid    47 and name HN  )     14.960  1.000

assign ( resid 600  and name OO  )
       ( resid 600  and name Z   )
       ( resid 600  and name X   )
       ( resid 600  and name Y   )
       ( segid A and resid    48 and name  N  )
       ( segid A and resid    48 and name HN  )     16.720  1.000

assign ( resid 600  and name OO  )
       ( resid 600  and name Z   )
       ( resid 600  and name X   )
       ( resid 600  and name Y   )
       ( segid A and resid    49 and name  N  )
       ( segid A and resid    49 and name HN  )     16.720  1.000

assign ( resid 600  and name OO  )
       ( resid 600  and name Z   )
       ( resid 600  and name X   )
       ( resid 600  and name Y   )
       ( segid A and resid    50 and name  N  )
       ( segid A and resid    50 and name HN  )      9.300  1.000

assign ( resid 600  and name OO  )
       ( resid 600  and name Z   )
       ( resid 600  and name X   )
       ( resid 600  and name Y   )
       ( segid A and resid    51 and name  N  )
       ( segid A and resid    51 and name HN  )      4.500  1.000

assign ( resid 600  and name OO  )
       ( resid 600  and name Z   )
       ( resid 600  and name X   )
       ( resid 600  and name Y   )
       ( segid A and resid    52 and name  N  )
       ( segid A and resid    52 and name HN  )      4.190  1.000

assign ( resid 600  and name OO  )
       ( resid 600  and name Z   )
       ( resid 600  and name X   )
       ( resid 600  and name Y   )
       ( segid A and resid    53 and name  N  )
       ( segid A and resid    53 and name HN  )     -1.220  1.000

assign ( resid 600  and name OO  )
       ( resid 600  and name Z   )
       ( resid 600  and name X   )
       ( resid 600  and name Y   )
       ( segid A and resid    54 and name  N  )
       ( segid A and resid    54 and name HN  )     -7.660  1.000

assign ( resid 600  and name OO  )
       ( resid 600  and name Z   )
       ( resid 600  and name X   )
       ( resid 600  and name Y   )
       ( segid A and resid    56 and name  N  )
       ( segid A and resid    56 and name HN  )     -2.130  1.000

assign ( resid 600  and name OO  )
       ( resid 600  and name Z   )
       ( resid 600  and name X   )
       ( resid 600  and name Y   )
       ( segid A and resid    57 and name  N  )
       ( segid A and resid    57 and name HN  )    -16.230  1.000

assign ( resid 600  and name OO  )
       ( resid 600  and name Z   )
       ( resid 600  and name X   )
       ( resid 600  and name Y   )
       ( segid A and resid    59 and name  N  )
       ( segid A and resid    59 and name HN  )     -4.860  1.000

assign ( resid 600  and name OO  )
       ( resid 600  and name Z   )
       ( resid 600  and name X   )
       ( resid 600  and name Y   )
       ( segid A and resid    60 and name  N  )
       ( segid A and resid    60 and name HN  )     -7.480  1.000

assign ( resid 600  and name OO  )
       ( resid 600  and name Z   )
       ( resid 600  and name X   )
       ( resid 600  and name Y   )
       ( segid A and resid    61 and name  N  )
       ( segid A and resid    61 and name HN  )     -3.160  1.000

assign ( resid 600  and name OO  )
       ( resid 600  and name Z   )
       ( resid 600  and name X   )
       ( resid 600  and name Y   )
       ( segid A and resid    63 and name  N  )
       ( segid A and resid    63 and name HN  )      3.590  1.000

assign ( resid 600  and name OO  )
       ( resid 600  and name Z   )
       ( resid 600  and name X   )
       ( resid 600  and name Y   )
       ( segid A and resid    64 and name  N  )
       ( segid A and resid    64 and name HN  )     -5.900  1.000

assign ( resid 600  and name OO  )
       ( resid 600  and name Z   )
       ( resid 600  and name X   )
       ( resid 600  and name Y   )
       ( segid A and resid    65 and name  N  )
       ( segid A and resid    65 and name HN  )     -2.190  1.000

assign ( resid 600  and name OO  )
       ( resid 600  and name Z   )
       ( resid 600  and name X   )
       ( resid 600  and name Y   )
       ( segid A and resid    66 and name  N  )
       ( segid A and resid    66 and name HN  )     15.260  1.000

assign ( resid 600  and name OO  )
       ( resid 600  and name Z   )
       ( resid 600  and name X   )
       ( resid 600  and name Y   )
       ( segid A and resid    67 and name  N  )
       ( segid A and resid    67 and name HN  )     12.400  1.000

assign ( resid 600  and name OO  )
       ( resid 600  and name Z   )
       ( resid 600  and name X   )
       ( resid 600  and name Y   )
       ( segid A and resid    68 and name  N  )
       ( segid A and resid    68 and name HN  )      1.160  1.000

assign ( resid 600  and name OO  )
       ( resid 600  and name Z   )
       ( resid 600  and name X   )
       ( resid 600  and name Y   )
       ( segid A and resid    69 and name  N  )
       ( segid A and resid    69 and name HN  )    -12.100  1.000

assign ( resid 600  and name OO  )
       ( resid 600  and name Z   )
       ( resid 600  and name X   )
       ( resid 600  and name Y   )
       ( segid A and resid    70 and name  N  )
       ( segid A and resid    70 and name HN  )      8.270  1.000

assign ( resid 600  and name OO  )
       ( resid 600  and name Z   )
       ( resid 600  and name X   )
       ( resid 600  and name Y   )
       ( segid A and resid    71 and name  N  )
       ( segid A and resid    71 and name HN  )      8.940  1.000

assign ( resid 600  and name OO  )
       ( resid 600  and name Z   )
       ( resid 600  and name X   )
       ( resid 600  and name Y   )
       ( segid A and resid    72 and name  N  )
       ( segid A and resid    72 and name HN  )     -2.800  1.000

assign ( resid 600  and name OO  )
       ( resid 600  and name Z   )
       ( resid 600  and name X   )
       ( resid 600  and name Y   )
       ( segid A and resid    73 and name  N  )
       ( segid A and resid    73 and name HN  )     -0.970  1.000

assign ( resid 600  and name OO  )
       ( resid 600  and name Z   )
       ( resid 600  and name X   )
       ( resid 600  and name Y   )
       ( segid A and resid    74 and name  N  )
       ( segid A and resid    74 and name HN  )      2.860  1.000

assign ( resid 600  and name OO  )
       ( resid 600  and name Z   )
       ( resid 600  and name X   )
       ( resid 600  and name Y   )
       ( segid A and resid    75 and name  N  )
       ( segid A and resid    75 and name HN  )     12.770  1.000

assign ( resid 600  and name OO  )
       ( resid 600  and name Z   )
       ( resid 600  and name X   )
       ( resid 600  and name Y   )
       ( segid A and resid    76 and name  N  )
       ( segid A and resid    76 and name HN  )     18.850  1.000

assign ( resid 600  and name OO  )
       ( resid 600  and name Z   )
       ( resid 600  and name X   )
       ( resid 600  and name Y   )
       ( segid A and resid    77 and name  N  )
       ( segid A and resid    77 and name HN  )     17.210  1.000

assign ( resid 600  and name OO  )
       ( resid 600  and name Z   )
       ( resid 600  and name X   )
       ( resid 600  and name Y   )
       ( segid A and resid    78 and name  N  )
       ( segid A and resid    78 and name HN  )      5.410  1.000

assign ( resid 600  and name OO  )
       ( resid 600  and name Z   )
       ( resid 600  and name X   )
       ( resid 600  and name Y   )
       ( segid A and resid    82 and name  N  )
       ( segid A and resid    82 and name HN  )     -0.120  1.000

assign ( resid 600  and name OO  )
       ( resid 600  and name Z   )
       ( resid 600  and name X   )
       ( resid 600  and name Y   )
       ( segid B and resid     3 and name  N  )
       ( segid B and resid     3 and name HN  )     -0.320  1.000

assign ( resid 600  and name OO  )
       ( resid 600  and name Z   )
       ( resid 600  and name X   )
       ( resid 600  and name Y   )
       ( segid B and resid     4 and name  N  )
       ( segid B and resid     4 and name HN  )      0.650  1.000

assign ( resid 600  and name OO  )
       ( resid 600  and name Z   )
       ( resid 600  and name X   )
       ( resid 600  and name Y   )
       ( segid B and resid     5 and name  N  )
       ( segid B and resid     5 and name HN  )      1.220  1.000

assign ( resid 600  and name OO  )
       ( resid 600  and name Z   )
       ( resid 600  and name X   )
       ( resid 600  and name Y   )
       ( segid B and resid     7 and name  N  )
       ( segid B and resid     7 and name HN  )     -0.080  1.000

assign ( resid 600  and name OO  )
       ( resid 600  and name Z   )
       ( resid 600  and name X   )
       ( resid 600  and name Y   )
       ( segid B and resid     8 and name  N  )
       ( segid B and resid     8 and name HN  )      0.890  1.000

assign ( resid 600  and name OO  )
       ( resid 600  and name Z   )
       ( resid 600  and name X   )
       ( resid 600  and name Y   )
       ( segid B and resid     9 and name  N  )
       ( segid B and resid     9 and name HN  )      0.490  1.000

assign ( resid 600  and name OO  )
       ( resid 600  and name Z   )
       ( resid 600  and name X   )
       ( resid 600  and name Y   )
       ( segid B and resid    10 and name  N  )
       ( segid B and resid    10 and name HN  )      0.410  1.000

assign ( resid 600  and name OO  )
       ( resid 600  and name Z   )
       ( resid 600  and name X   )
       ( resid 600  and name Y   )
       ( segid B and resid    11 and name  N  )
       ( segid B and resid    11 and name HN  )     -0.650  1.000

assign ( resid 600  and name OO  )
       ( resid 600  and name Z   )
       ( resid 600  and name X   )
       ( resid 600  and name Y   )
       ( segid B and resid    12 and name  N  )
       ( segid B and resid    12 and name HN  )      0.650  1.000

assign ( resid 600  and name OO  )
       ( resid 600  and name Z   )
       ( resid 600  and name X   )
       ( resid 600  and name Y   )
       ( segid B and resid    13 and name  N  )
       ( segid B and resid    13 and name HN  )      1.380  1.000

assign ( resid 600  and name OO  )
       ( resid 600  and name Z   )
       ( resid 600  and name X   )
       ( resid 600  and name Y   )
       ( segid B and resid    14 and name  N  )
       ( segid B and resid    14 and name HN  )      0.810  1.000

assign ( resid 600  and name OO  )
       ( resid 600  and name Z   )
       ( resid 600  and name X   )
       ( resid 600  and name Y   )
       ( segid B and resid    16 and name  N  )
       ( segid B and resid    16 and name HN  )     10.380  1.000

assign ( resid 600  and name OO  )
       ( resid 600  and name Z   )
       ( resid 600  and name X   )
       ( resid 600  and name Y   )
       ( segid B and resid    18 and name  N  )
       ( segid B and resid    18 and name HN  )     10.540  1.000

assign ( resid 600  and name OO  )
       ( resid 600  and name Z   )
       ( resid 600  and name X   )
       ( resid 600  and name Y   )
       ( segid B and resid    19 and name  N  )
       ( segid B and resid    19 and name HN  )     -3.970  1.000

assign ( resid 600  and name OO  )
       ( resid 600  and name Z   )
       ( resid 600  and name X   )
       ( resid 600  and name Y   )
       ( segid B and resid    20 and name  N  )
       ( segid B and resid    20 and name HN  )     -7.700  1.000

assign ( resid 600  and name OO  )
       ( resid 600  and name Z   )
       ( resid 600  and name X   )
       ( resid 600  and name Y   )
       ( segid B and resid    21 and name  N  )
       ( segid B and resid    21 and name HN  )     -8.350  1.000

assign ( resid 600  and name OO  )
       ( resid 600  and name Z   )
       ( resid 600  and name X   )
       ( resid 600  and name Y   )
       ( segid B and resid    22 and name  N  )
       ( segid B and resid    22 and name HN  )     -5.680  1.000

assign ( resid 600  and name OO  )
       ( resid 600  and name Z   )
       ( resid 600  and name X   )
       ( resid 600  and name Y   )
       ( segid B and resid    23 and name  N  )
       ( segid B and resid    23 and name HN  )      5.030  1.000

assign ( resid 600  and name OO  )
       ( resid 600  and name Z   )
       ( resid 600  and name X   )
       ( resid 600  and name Y   )
       ( segid B and resid    25 and name  N  )
       ( segid B and resid    25 and name HN  )     -2.600  1.000

assign ( resid 600  and name OO  )
       ( resid 600  and name Z   )
       ( resid 600  and name X   )
       ( resid 600  and name Y   )
       ( segid B and resid    26 and name  N  )
       ( segid B and resid    26 and name HN  )      3.730  1.000

assign ( resid 600  and name OO  )
       ( resid 600  and name Z   )
       ( resid 600  and name X   )
       ( resid 600  and name Y   )
       ( segid B and resid    27 and name  N  )
       ( segid B and resid    27 and name HN  )     10.220  1.000

assign ( resid 600  and name OO  )
       ( resid 600  and name Z   )
       ( resid 600  and name X   )
       ( resid 600  and name Y   )
       ( segid B and resid    28 and name  N  )
       ( segid B and resid    28 and name HN  )     -0.160  1.000

assign ( resid 600  and name OO  )
       ( resid 600  and name Z   )
       ( resid 600  and name X   )
       ( resid 600  and name Y   )
       ( segid B and resid    29 and name  N  )
       ( segid B and resid    29 and name HN  )     -4.700  1.000

assign ( resid 600  and name OO  )
       ( resid 600  and name Z   )
       ( resid 600  and name X   )
       ( resid 600  and name Y   )
       ( segid B and resid    33 and name  N  )
       ( segid B and resid    33 and name HN  )      9.080  1.000

assign ( resid 600  and name OO  )
       ( resid 600  and name Z   )
       ( resid 600  and name X   )
       ( resid 600  and name Y   )
       ( segid B and resid    35 and name  N  )
       ( segid B and resid    35 and name HN  )      2.680  1.000

assign ( resid 600  and name OO  )
       ( resid 600  and name Z   )
       ( resid 600  and name X   )
       ( resid 600  and name Y   )
       ( segid B and resid    37 and name  N  )
       ( segid B and resid    37 and name HN  )     17.840  1.000

assign ( resid 600  and name OO  )
       ( resid 600  and name Z   )
       ( resid 600  and name X   )
       ( resid 600  and name Y   )
       ( segid B and resid    39 and name  N  )
       ( segid B and resid    39 and name HN  )     -3.570  1.000

assign ( resid 600  and name OO  )
       ( resid 600  and name Z   )
       ( resid 600  and name X   )
       ( resid 600  and name Y   )
       ( segid B and resid    40 and name  N  )
       ( segid B and resid    40 and name HN  )     -3.080  1.000

assign ( resid 600  and name OO  )
       ( resid 600  and name Z   )
       ( resid 600  and name X   )
       ( resid 600  and name Y   )
       ( segid B and resid    41 and name  N  )
       ( segid B and resid    41 and name HN  )     -8.920  1.000

assign ( resid 600  and name OO  )
       ( resid 600  and name Z   )
       ( resid 600  and name X   )
       ( resid 600  and name Y   )
       ( segid B and resid    42 and name  N  )
       ( segid B and resid    42 and name HN  )     -5.270  1.000

assign ( resid 600  and name OO  )
       ( resid 600  and name Z   )
       ( resid 600  and name X   )
       ( resid 600  and name Y   )
       ( segid B and resid    43 and name  N  )
       ( segid B and resid    43 and name HN  )     -5.760  1.000

assign ( resid 600  and name OO  )
       ( resid 600  and name Z   )
       ( resid 600  and name X   )
       ( resid 600  and name Y   )
       ( segid B and resid    44 and name  N  )
       ( segid B and resid    44 and name HN  )    -11.600  1.000

assign ( resid 600  and name OO  )
       ( resid 600  and name Z   )
       ( resid 600  and name X   )
       ( resid 600  and name Y   )
       ( segid B and resid    45 and name  N  )
       ( segid B and resid    45 and name HN  )     -8.110  1.000

assign ( resid 600  and name OO  )
       ( resid 600  and name Z   )
       ( resid 600  and name X   )
       ( resid 600  and name Y   )
       ( segid B and resid    46 and name  N  )
       ( segid B and resid    46 and name HN  )    -11.680  1.000

assign ( resid 600  and name OO  )
       ( resid 600  and name Z   )
       ( resid 600  and name X   )
       ( resid 600  and name Y   )
       ( segid B and resid    47 and name  N  )
       ( segid B and resid    47 and name HN  )     -4.220  1.000

assign ( resid 600  and name OO  )
       ( resid 600  and name Z   )
       ( resid 600  and name X   )
       ( resid 600  and name Y   )
       ( segid B and resid    48 and name  N  )
       ( segid B and resid    48 and name HN  )     -9.330  1.000

assign ( resid 600  and name OO  )
       ( resid 600  and name Z   )
       ( resid 600  and name X   )
       ( resid 600  and name Y   )
       ( segid B and resid    50 and name  N  )
       ( segid B and resid    50 and name HN  )     -4.790  1.000

assign ( resid 600  and name OO  )
       ( resid 600  and name Z   )
       ( resid 600  and name X   )
       ( resid 600  and name Y   )
       ( segid B and resid    51 and name  N  )
       ( segid B and resid    51 and name HN  )    -10.870  1.000

assign ( resid 600  and name OO  )
       ( resid 600  and name Z   )
       ( resid 600  and name X   )
       ( resid 600  and name Y   )
       ( segid B and resid    52 and name  N  )
       ( segid B and resid    52 and name HN  )     -5.520  1.000

assign ( resid 600  and name OO  )
       ( resid 600  and name Z   )
       ( resid 600  and name X   )
       ( resid 600  and name Y   )
       ( segid B and resid    53 and name  N  )
       ( segid B and resid    53 and name HN  )     -8.520  1.000

assign ( resid 600  and name OO  )
       ( resid 600  and name Z   )
       ( resid 600  and name X   )
       ( resid 600  and name Y   )
       ( segid B and resid    55 and name  N  )
       ( segid B and resid    55 and name HN  )     -4.790  1.000

assign ( resid 600  and name OO  )
       ( resid 600  and name Z   )
       ( resid 600  and name X   )
       ( resid 600  and name Y   )
       ( segid B and resid    56 and name  N  )
       ( segid B and resid    56 and name HN  )     -9.890  1.000

assign ( resid 600  and name OO  )
       ( resid 600  and name Z   )
       ( resid 600  and name X   )
       ( resid 600  and name Y   )
       ( segid B and resid    57 and name  N  )
       ( segid B and resid    57 and name HN  )      1.380  1.000

assign ( resid 600  and name OO  )
       ( resid 600  and name Z   )
       ( resid 600  and name X   )
       ( resid 600  and name Y   )
       ( segid B and resid    58 and name  N  )
       ( segid B and resid    58 and name HN  )      4.700  1.000

assign ( resid 600  and name OO  )
       ( resid 600  and name Z   )
       ( resid 600  and name X   )
       ( resid 600  and name Y   )
       ( segid B and resid    59 and name  N  )
       ( segid B and resid    59 and name HN  )      9.570  1.000

assign ( resid 600  and name OO  )
       ( resid 600  and name Z   )
       ( resid 600  and name X   )
       ( resid 600  and name Y   )
       ( segid B and resid    60 and name  N  )
       ( segid B and resid    60 and name HN  )      2.350  1.000

assign ( resid 600  and name OO  )
       ( resid 600  and name Z   )
       ( resid 600  and name X   )
       ( resid 600  and name Y   )
       ( segid B and resid    61 and name  N  )
       ( segid B and resid    61 and name HN  )      2.680  1.000

assign ( resid 600  and name OO  )
       ( resid 600  and name Z   )
       ( resid 600  and name X   )
       ( resid 600  and name Y   )
       ( segid B and resid    62 and name  N  )
       ( segid B and resid    62 and name HN  )     -0.080  1.000

assign ( resid 600  and name OO  )
       ( resid 600  and name Z   )
       ( resid 600  and name X   )
       ( resid 600  and name Y   )
       ( segid B and resid    63 and name  N  )
       ( segid B and resid    63 and name HN  )     -8.190  1.000

assign ( resid 600  and name OO  )
       ( resid 600  and name Z   )
       ( resid 600  and name X   )
       ( resid 600  and name Y   )
       ( segid B and resid    64 and name  N  )
       ( segid B and resid    64 and name HN  )      1.050  1.000

assign ( resid 600  and name OO  )
       ( resid 600  and name Z   )
       ( resid 600  and name X   )
       ( resid 600  and name Y   )
       ( segid B and resid    66 and name  N  )
       ( segid B and resid    66 and name HN  )     -7.700  1.000

assign ( resid 600  and name OO  )
       ( resid 600  and name Z   )
       ( resid 600  and name X   )
       ( resid 600  and name Y   )
       ( segid B and resid    67 and name  N  )
       ( segid B and resid    67 and name HN  )     -0.730  1.000

assign ( resid 600  and name OO  )
       ( resid 600  and name Z   )
       ( resid 600  and name X   )
       ( resid 600  and name Y   )
       ( segid B and resid    68 and name  N  )
       ( segid B and resid    68 and name HN  )      3.490  1.000

assign ( resid 600  and name OO  )
       ( resid 600  and name Z   )
       ( resid 600  and name X   )
       ( resid 600  and name Y   )
       ( segid B and resid    69 and name  N  )
       ( segid B and resid    69 and name HN  )     -6.980  1.000

assign ( resid 600  and name OO  )
       ( resid 600  and name Z   )
       ( resid 600  and name X   )
       ( resid 600  and name Y   )
       ( segid B and resid    70 and name  N  )
       ( segid B and resid    70 and name HN  )    -10.060  1.000

assign ( resid 600  and name OO  )
       ( resid 600  and name Z   )
       ( resid 600  and name X   )
       ( resid 600  and name Y   )
       ( segid B and resid    71 and name  N  )
       ( segid B and resid    71 and name HN  )     -7.220  1.000

assign ( resid 600  and name OO  )
       ( resid 600  and name Z   )
       ( resid 600  and name X   )
       ( resid 600  and name Y   )
       ( segid B and resid    73 and name  N  )
       ( segid B and resid    73 and name HN  )     -3.490  1.000

assign ( resid 600  and name OO  )
       ( resid 600  and name Z   )
       ( resid 600  and name X   )
       ( resid 600  and name Y   )
       ( segid B and resid    74 and name  N  )
       ( segid B and resid    74 and name HN  )     -0.570  1.000

assign ( resid 600  and name OO  )
       ( resid 600  and name Z   )
       ( resid 600  and name X   )
       ( resid 600  and name Y   )
       ( segid B and resid    75 and name  N  )
       ( segid B and resid    75 and name HN  )     -9.980  1.000

assign ( resid 600  and name OO  )
       ( resid 600  and name Z   )
       ( resid 600  and name X   )
       ( resid 600  and name Y   )
       ( segid B and resid    76 and name  N  )
       ( segid B and resid    76 and name HN  )      2.430  1.000

assign ( resid 600  and name OO  )
       ( resid 600  and name Z   )
       ( resid 600  and name X   )
       ( resid 600  and name Y   )
       ( segid B and resid    77 and name  N  )
       ( segid B and resid    77 and name HN  )     14.600  1.000

assign ( resid 600  and name OO  )
       ( resid 600  and name Z   )
       ( resid 600  and name X   )
       ( resid 600  and name Y   )
       ( segid B and resid    78 and name  N  )
       ( segid B and resid    78 and name HN  )    -13.950  1.000

assign ( resid 600  and name OO  )
       ( resid 600  and name Z   )
       ( resid 600  and name X   )
       ( resid 600  and name Y   )
       ( segid B and resid    79 and name  N  )
       ( segid B and resid    79 and name HN  )     -7.700  1.000

assign ( resid 600  and name OO  )
       ( resid 600  and name Z   )
       ( resid 600  and name X   )
       ( resid 600  and name Y   )
       ( segid B and resid    80 and name  N  )
       ( segid B and resid    80 and name HN  )      5.920  1.000

assign ( resid 600  and name OO  )
       ( resid 600  and name Z   )
       ( resid 600  and name X   )
       ( resid 600  and name Y   )
       ( segid B and resid    81 and name  N  )
       ( segid B and resid    81 and name HN  )     -6.890  1.000

assign ( resid 600  and name OO  )
       ( resid 600  and name Z   )
       ( resid 600  and name X   )
       ( resid 600  and name Y   )
       ( segid B and resid    82 and name  N  )
       ( segid B and resid    82 and name HN  )     -6.250  1.000

assign ( resid 600  and name OO  )
       ( resid 600  and name Z   )
       ( resid 600  and name X   )
       ( resid 600  and name Y   )
       ( segid B and resid    83 and name  N  )
       ( segid B and resid    83 and name HN  )     -9.650  1.000

assign ( resid 600  and name OO  )
       ( resid 600  and name Z   )
       ( resid 600  and name X   )
       ( resid 600  and name Y   )
       ( segid B and resid    84 and name  N  )
       ( segid B and resid    84 and name HN  )     -5.760  1.000

assign ( resid 600  and name OO  )
       ( resid 600  and name Z   )
       ( resid 600  and name X   )
       ( resid 600  and name Y   )
       ( segid B and resid    85 and name  N  )
       ( segid B and resid    85 and name HN  )      9.810  1.000

assign ( resid 600  and name OO  )
       ( resid 600  and name Z   )
       ( resid 600  and name X   )
       ( resid 600  and name Y   )
       ( segid B and resid    86 and name  N  )
       ( segid B and resid    86 and name HN  )      5.350  1.000

assign ( resid 600  and name OO  )
       ( resid 600  and name Z   )
       ( resid 600  and name X   )
       ( resid 600  and name Y   )
       ( segid B and resid    87 and name  N  )
       ( segid B and resid    87 and name HN  )      7.700  1.000

assign ( resid 600  and name OO  )
       ( resid 600  and name Z   )
       ( resid 600  and name X   )
       ( resid 600  and name Y   )
       ( segid B and resid    88 and name  N  )
       ( segid B and resid    88 and name HN  )     -3.650  1.000

assign ( resid 600  and name OO  )
       ( resid 600  and name Z   )
       ( resid 600  and name X   )
       ( resid 600  and name Y   )
       ( segid B and resid    90 and name  N  )
       ( segid B and resid    90 and name HN  )      0.240  1.000


  Entry H atom name         Submitted Coord H atom name
  Start of MODEL    1
    1    H1   GLY   1           HT1      GLY   1 285.843 -22.045  -9.292
    2    H2   GLY   1           HT2      GLY   1 286.413 -20.528  -9.778
    3    H3   GLY   1           HT3      GLY   1 284.757 -20.770  -9.536
    4    HA2  GLY   1           HA3      GLY   1 284.942 -20.846  -7.242
    5    HA3  GLY   1           HA2      GLY   1 286.664 -21.187  -7.328
    6    H    THR   2           H        THR   2 288.117 -19.479  -7.831
    7    HA   THR   2           HA       THR   2 287.006 -16.773  -7.770
    8    HB   THR   2           HB       THR   2 288.633 -16.090  -6.040
    9    HG1  THR   2           HG1      THR   2 289.223 -18.852  -6.035
   10   HG21  THR   2          HG21      THR   2 286.331 -17.693  -5.572
   11   HG22  THR   2          HG22      THR   2 287.015 -16.408  -4.576
   12   HG23  THR   2          HG23      THR   2 287.555 -18.073  -4.361
   13    H    GLU   3           H        GLU   3 287.842 -15.704  -9.444
   14    HA   GLU   3           HA       GLU   3 290.553 -16.409 -10.343
   15    HB2  GLU   3           HB2      GLU   3 288.528 -16.701 -11.898
   16    HB3  GLU   3           HB3      GLU   3 288.508 -14.945 -11.989
   17    HG2  GLU   3           HG2      GLU   3 290.587 -14.864 -13.056
   18    HG3  GLU   3           HG3      GLU   3 290.975 -16.526 -12.615
   19    H    ASN   4           H        ASN   4 288.358 -13.593 -10.414
   20    HA   ASN   4           HA       ASN   4 290.553 -11.942  -9.400
   21    HB2  ASN   4           HB2      ASN   4 290.352 -10.285 -11.078
   22    HB3  ASN   4           HB3      ASN   4 290.389 -11.817 -11.947
   23   HD21  ASN   4          HD21      ASN   4 288.060 -12.774 -12.168
   24   HD22  ASN   4          HD22      ASN   4 286.884 -11.661 -12.770
   25    H    ASP   5           H        ASP   5 287.843 -13.048  -8.478
   26    HA   ASP   5           HA       ASP   5 286.388 -10.577  -7.928
   27    HB2  ASP   5           HB2      ASP   5 284.698 -12.029  -6.912
   28    HB3  ASP   5           HB3      ASP   5 285.111 -12.625  -8.515
   29    H    HIS   6           H        HIS   6 285.506 -11.498  -5.222
   30    HA   HIS   6           HA       HIS   6 287.912 -10.655  -3.851
   31    HB2  HIS   6           HB2      HIS   6 285.145 -11.118  -2.726
   32    HB3  HIS   6           HB3      HIS   6 286.547 -10.616  -1.852
   33    HD1  HIS   6           HD1      HIS   6 285.158  -9.146  -5.061
   34    HD2  HIS   6           HD2      HIS   6 286.182  -8.196  -1.151
   35    HE1  HIS   6           HE1      HIS   6 284.776  -6.662  -4.869
   36    HE2  HIS   6           HE2      HIS   6 285.282  -6.122  -2.455
   37    H    ILE   7           H        ILE   7 288.368 -11.638  -1.787
   38    HA   ILE   7           HA       ILE   7 287.690 -14.389  -1.360
   39    HB   ILE   7           HB       ILE   7 289.694 -15.435  -1.755
   40   HG12  ILE   7          HG12      ILE   7 291.082 -12.763  -1.691
   41   HG13  ILE   7          HG13      ILE   7 291.098 -13.966  -0.403
   42   HG21  ILE   7          HG21      ILE   7 288.834 -14.821  -3.885
   43   HG22  ILE   7          HG22      ILE   7 290.597 -14.725  -3.932
   44   HG23  ILE   7          HG23      ILE   7 289.636 -13.253  -3.802
   45   HD11  ILE   7          HD11      ILE   7 292.977 -14.690  -1.316
   46   HD12  ILE   7          HD12      ILE   7 292.684 -13.793  -2.811
   47   HD13  ILE   7          HD13      ILE   7 291.951 -15.376  -2.579
   48    H    ASN   8           H        ASN   8 287.983 -14.955   0.772
   49    HA   ASN   8           HA       ASN   8 288.591 -12.715   2.491
   50    HB2  ASN   8           HB2      ASN   8 286.754 -14.759   2.590
   51    HB3  ASN   8           HB3      ASN   8 287.958 -15.296   3.756
   52   HD21  ASN   8          HD21      ASN   8 286.913 -12.014   2.945
   53   HD22  ASN   8          HD22      ASN   8 286.354 -11.614   4.529
   54    H    LEU   9           H        LEU   9 290.503 -12.471   3.609
   55    HA   LEU   9           HA       LEU   9 292.305 -14.782   3.725
   56    HB2  LEU   9           HB2      LEU   9 292.813 -11.990   3.062
   57    HB3  LEU   9           HB3      LEU   9 293.889 -12.602   4.238
   58    HG   LEU   9           HG       LEU   9 295.060 -13.748   2.717
   59   HD11  LEU   9          HD11      LEU   9 292.396 -14.725   1.730
   60   HD12  LEU   9          HD12      LEU   9 293.684 -15.634   2.521
   61   HD13  LEU   9          HD13      LEU   9 293.885 -15.085   0.856
   62   HD21  LEU   9          HD21      LEU   9 293.427 -11.839   1.188
   63   HD22  LEU   9          HD22      LEU   9 294.267 -13.067   0.242
   64   HD23  LEU   9          HD23      LEU   9 295.180 -11.992   1.302
   65    H    LYS  10           H        LYS  10 293.309 -15.227   5.615
   66    HA   LYS  10           HA       LYS  10 292.126 -13.952   7.966
   67    HB2  LYS  10           HB2      LYS  10 293.241 -16.573   7.259
   68    HB3  LYS  10           HB3      LYS  10 293.482 -16.084   8.898
   69    HG2  LYS  10           HG2      LYS  10 291.289 -16.325   9.411
   70    HG3  LYS  10           HG3      LYS  10 290.765 -15.755   7.829
   71    HD2  LYS  10           HD2      LYS  10 290.187 -17.943   7.613
   72    HD3  LYS  10           HD3      LYS  10 291.855 -18.034   7.050
   73    HE2  LYS  10           HE2      LYS  10 291.535 -19.821   8.586
   74    HE3  LYS  10           HE3      LYS  10 292.519 -18.604   9.399
   75    HZ1  LYS  10           HZ1      LYS  10 290.843 -19.382  10.895
   76    HZ2  LYS  10           HZ2      LYS  10 289.612 -19.078   9.775
   77    HZ3  LYS  10           HZ3      LYS  10 290.463 -17.790  10.467
   78    H    VAL  11           H        VAL  11 293.436 -12.252   8.668
   79    HA   VAL  11           HA       VAL  11 296.313 -12.636   8.397
   80    HB   VAL  11           HB       VAL  11 295.712 -10.558   7.521
   81   HG11  VAL  11          HG11      VAL  11 293.927  -9.407   8.092
   82   HG12  VAL  11          HG12      VAL  11 294.535  -9.172   9.731
   83   HG13  VAL  11          HG13      VAL  11 293.591 -10.608   9.341
   84   HG21  VAL  11          HG21      VAL  11 296.796  -8.939   9.026
   85   HG22  VAL  11          HG22      VAL  11 297.685 -10.447   8.811
   86   HG23  VAL  11          HG23      VAL  11 296.776 -10.162  10.296
   87    H    ALA  12           H        ALA  12 297.524 -13.200  10.043
   88    HA   ALA  12           HA       ALA  12 296.361 -13.262  12.750
   89    HB1  ALA  12           HB1      ALA  12 297.103 -15.353  12.707
   90    HB2  ALA  12           HB2      ALA  12 298.726 -14.676  12.885
   91    HB3  ALA  12           HB3      ALA  12 298.096 -15.048  11.278
   92    H    GLY  13           H        GLY  13 297.137 -12.025  14.391
   93    HA2  GLY  13           HA2      GLY  13 299.315 -10.204  13.712
   94    HA3  GLY  13           HA3      GLY  13 298.165  -9.992  15.008
   95    H    GLN  14           H        GLN  14 300.329 -12.736  14.301
   96    HA   GLN  14           HA       GLN  14 301.954 -13.726  15.482
   97    HB2  GLN  14           HB2      GLN  14 302.193 -10.898  16.440
   98    HB3  GLN  14           HB3      GLN  14 303.318 -12.164  16.866
   99    HG2  GLN  14           HG2      GLN  14 303.529 -12.493  14.311
  100    HG3  GLN  14           HG3      GLN  14 302.855 -10.864  14.241
  101   HE21  GLN  14          HE21      GLN  14 303.994  -9.174  15.375
  102   HE22  GLN  14          HE22      GLN  14 305.710  -9.274  15.556
  103    H    ASP  15           H        ASP  15 299.793 -11.756  17.464
  104    HA   ASP  15           HA       ASP  15 300.435 -13.175  19.885
  105    HB2  ASP  15           HB2      ASP  15 298.331 -11.120  19.214
  106    HB3  ASP  15           HB3      ASP  15 298.484 -11.849  20.810
  107    H    GLY  16           H        GLY  16 298.839 -14.214  17.274
  108    HA2  GLY  16           HA2      GLY  16 297.687 -16.268  17.188
  109    HA3  GLY  16           HA3      GLY  16 297.216 -16.051  18.868
  110    H    SER  17           H        SER  17 296.772 -13.160  17.349
  111    HA   SER  17           HA       SER  17 293.916 -13.691  16.990
  112    HB2  SER  17           HB2      SER  17 293.702 -11.190  17.130
  113    HB3  SER  17           HB3      SER  17 294.349 -11.937  18.591
  114    HG   SER  17           HG       SER  17 295.422  -9.983  17.337
  115    H    VAL  18           H        VAL  18 293.478 -14.204  14.952
  116    HA   VAL  18           HA       VAL  18 294.821 -12.747  12.776
  117    HB   VAL  18           HB       VAL  18 295.194 -14.881  12.141
  118   HG11  VAL  18          HG11      VAL  18 293.514 -16.775  12.672
  119   HG12  VAL  18          HG12      VAL  18 292.874 -15.633  13.854
  120   HG13  VAL  18          HG13      VAL  18 294.563 -16.143  13.941
  121   HG21  VAL  18          HG21      VAL  18 293.798 -14.069  10.395
  122   HG22  VAL  18          HG22      VAL  18 292.339 -14.570  11.249
  123   HG23  VAL  18          HG23      VAL  18 293.461 -15.782  10.636
  124    H    VAL  19           H        VAL  19 293.307 -12.348  10.832
  125    HA   VAL  19           HA       VAL  19 290.552 -11.813  11.680
  126    HB   VAL  19           HB       VAL  19 292.209  -9.710  10.334
  127   HG11  VAL  19          HG11      VAL  19 289.755  -9.640   9.977
  128   HG12  VAL  19          HG12      VAL  19 290.384  -8.225  10.824
  129   HG13  VAL  19          HG13      VAL  19 289.549  -9.493  11.721
  130   HG21  VAL  19          HG21      VAL  19 293.128 -10.057  12.527
  131   HG22  VAL  19          HG22      VAL  19 291.518 -10.006  13.244
  132   HG23  VAL  19          HG23      VAL  19 292.206  -8.552  12.519
  133    H    GLN  20           H        GLN  20 289.051 -11.649   9.966
  134    HA   GLN  20           HA       GLN  20 290.038 -12.881   7.515
  135    HB2  GLN  20           HB2      GLN  20 287.167 -12.434   8.319
  136    HB3  GLN  20           HB3      GLN  20 287.777 -13.503   7.063
  137    HG2  GLN  20           HG2      GLN  20 289.078 -14.205   9.446
  138    HG3  GLN  20           HG3      GLN  20 287.361 -14.047   9.822
  139   HE21  GLN  20          HE21      GLN  20 289.264 -16.363   9.552
  140   HE22  GLN  20          HE22      GLN  20 288.460 -17.460   8.490
  141    H    PHE  21           H        PHE  21 289.818 -12.017   5.523
  142    HA   PHE  21           HA       PHE  21 288.541  -9.405   5.209
  143    HB2  PHE  21           HB2      PHE  21 291.491  -9.900   4.883
  144    HB3  PHE  21           HB3      PHE  21 290.673  -8.555   4.096
  145    HD1  PHE  21           HD2      PHE  21 289.286  -7.010   5.630
  146    HD2  PHE  21           HD1      PHE  21 292.324  -9.647   7.002
  147    HE1  PHE  21           HE2      PHE  21 289.519  -5.666   7.674
  148    HE2  PHE  21           HE1      PHE  21 292.567  -8.296   9.049
  149    HZ   PHE  21           HZ       PHE  21 291.167  -6.312   9.370
  150    H    LYS  22           H        LYS  22 287.422  -9.447   3.331
  151    HA   LYS  22           HA       LYS  22 288.309 -11.297   1.291
  152    HB2  LYS  22           HB2      LYS  22 285.736 -10.298   1.899
  153    HB3  LYS  22           HB3      LYS  22 286.169  -9.688   0.321
  154    HG2  LYS  22           HG2      LYS  22 286.146 -11.732  -0.627
  155    HG3  LYS  22           HG3      LYS  22 286.745 -12.496   0.802
  156    HD2  LYS  22           HD2      LYS  22 284.714 -13.076   1.456
  157    HD3  LYS  22           HD3      LYS  22 284.107 -11.437   1.196
  158    HE2  LYS  22           HE2      LYS  22 282.881 -12.896  -0.235
  159    HE3  LYS  22           HE3      LYS  22 283.981 -11.940  -1.228
  160    HZ1  LYS  22           HZ1      LYS  22 284.206 -14.789  -0.471
  161    HZ2  LYS  22           HZ2      LYS  22 285.539 -13.916  -1.038
  162    HZ3  LYS  22           HZ3      LYS  22 284.177 -14.112  -2.022
  163    H    ILE  23           H        ILE  23 289.670 -10.753  -0.192
  164    HA   ILE  23           HA       ILE  23 289.760  -7.985  -1.094
  165    HB   ILE  23           HB       ILE  23 291.602  -8.056   0.394
  166   HG12  ILE  23          HG12      ILE  23 292.485  -8.542  -2.451
  167   HG13  ILE  23          HG13      ILE  23 292.224  -6.996  -1.661
  168   HG21  ILE  23          HG21      ILE  23 293.354  -9.886   0.155
  169   HG22  ILE  23          HG22      ILE  23 292.142 -10.767  -0.775
  170   HG23  ILE  23          HG23      ILE  23 291.820 -10.331   0.905
  171   HD11  ILE  23          HD11      ILE  23 294.470  -7.041  -1.537
  172   HD12  ILE  23          HD12      ILE  23 294.549  -8.803  -1.566
  173   HD13  ILE  23          HD13      ILE  23 294.135  -7.963  -0.071
  174    H    LYS  24           H        LYS  24 289.779  -7.833  -3.205
  175    HA   LYS  24           HA       LYS  24 289.391 -10.081  -4.822
  176    HB2  LYS  24           HB2      LYS  24 290.091  -7.238  -5.493
  177    HB3  LYS  24           HB3      LYS  24 289.816  -8.464  -6.730
  178    HG2  LYS  24           HG2      LYS  24 287.632  -8.751  -5.095
  179    HG3  LYS  24           HG3      LYS  24 287.903  -7.011  -5.081
  180    HD2  LYS  24           HD2      LYS  24 287.498  -8.779  -7.491
  181    HD3  LYS  24           HD3      LYS  24 286.398  -7.542  -6.877
  182    HE2  LYS  24           HE2      LYS  24 287.735  -5.805  -7.606
  183    HE3  LYS  24           HE3      LYS  24 289.186  -6.808  -7.632
  184    HZ1  LYS  24           HZ1      LYS  24 288.535  -7.815  -9.622
  185    HZ2  LYS  24           HZ2      LYS  24 288.170  -6.180  -9.854
  186    HZ3  LYS  24           HZ3      LYS  24 286.935  -7.278  -9.494
  187    H    ARG  25           H        ARG  25 290.798 -11.366  -5.980
  188    HA   ARG  25           HA       ARG  25 293.278 -11.847  -5.046
  189    HB2  ARG  25           HB2      ARG  25 292.370 -12.278  -7.865
  190    HB3  ARG  25           HB3      ARG  25 293.679 -13.111  -7.075
  191    HG2  ARG  25           HG2      ARG  25 291.561 -13.528  -5.373
  192    HG3  ARG  25           HG3      ARG  25 290.832 -13.623  -6.975
  193    HD2  ARG  25           HD2      ARG  25 293.255 -15.171  -6.066
  194    HD3  ARG  25           HD3      ARG  25 291.616 -15.812  -6.162
  195    HE   ARG  25           HE       ARG  25 292.385 -14.736  -8.657
  196   HH11  ARG  25          HH11      ARG  25 292.980 -17.474  -6.575
  197   HH12  ARG  25          HH12      ARG  25 293.388 -18.535  -7.881
  198   HH21  ARG  25          HH21      ARG  25 292.922 -16.132 -10.374
  199   HH22  ARG  25          HH22      ARG  25 293.356 -17.774 -10.037
  200    H    HIS  26           H        HIS  26 292.857 -10.262  -8.233
  201    HA   HIS  26           HA       HIS  26 295.591  -9.547  -8.313
  202    HB2  HIS  26           HB2      HIS  26 293.333  -8.418  -9.967
  203    HB3  HIS  26           HB3      HIS  26 295.054  -8.266 -10.305
  204    HD1  HIS  26           HD1      HIS  26 295.880  -9.896 -11.957
  205    HD2  HIS  26           HD2      HIS  26 292.593 -11.354  -9.874
  206    HE1  HIS  26           HE1      HIS  26 295.403 -12.157 -12.950
  207    HE2  HIS  26           HE2      HIS  26 293.397 -13.013 -11.688
  208    H    THR  27           H        THR  27 294.133  -8.541  -5.929
  209    HA   THR  27           HA       THR  27 294.608  -5.670  -6.328
  210    HB   THR  27           HB       THR  27 293.056  -6.975  -4.085
  211    HG1  THR  27           HG1      THR  27 291.798  -7.163  -5.826
  212   HG21  THR  27          HG21      THR  27 293.880  -4.905  -3.301
  213   HG22  THR  27          HG22      THR  27 292.203  -4.629  -3.780
  214   HG23  THR  27          HG23      THR  27 293.515  -4.104  -4.831
  215    HA   PRO  28           HA       PRO  28 298.204  -6.195  -3.839
  216    HB2  PRO  28           HB2      PRO  28 297.849  -3.445  -2.901
  217    HB3  PRO  28           HB3      PRO  28 299.146  -4.133  -3.873
  218    HG2  PRO  28           HG2      PRO  28 297.307  -2.419  -4.877
  219    HG3  PRO  28           HG3      PRO  28 298.093  -3.675  -5.849
  220    HD2  PRO  28           HD2      PRO  28 295.356  -3.604  -4.680
  221    HD3  PRO  28           HD3      PRO  28 295.918  -4.303  -6.213
  222    H    LEU  29           H        LEU  29 298.319  -7.150  -1.961
  223    HA   LEU  29           HA       LEU  29 296.293  -7.309  -0.092
  224    HB2  LEU  29           HB2      LEU  29 299.257  -7.760   0.166
  225    HB3  LEU  29           HB3      LEU  29 298.115  -8.146   1.446
  226    HG   LEU  29           HG       LEU  29 297.810  -9.245  -1.332
  227   HD11  LEU  29          HD11      LEU  29 299.391 -10.403   0.944
  228   HD12  LEU  29          HD12      LEU  29 299.965  -9.982  -0.673
  229   HD13  LEU  29          HD13      LEU  29 298.839 -11.323  -0.457
  230   HD21  LEU  29          HD21      LEU  29 295.831  -9.584  -0.255
  231   HD22  LEU  29          HD22      LEU  29 296.587  -9.757   1.339
  232   HD23  LEU  29          HD23      LEU  29 296.696 -11.064   0.151
  233    H    SER  30           H        SER  30 298.462  -4.707  -0.633
  234    HA   SER  30           HA       SER  30 298.817  -3.564   1.849
  235    HB2  SER  30           HB2      SER  30 299.912  -2.476   0.090
  236    HB3  SER  30           HB3      SER  30 298.458  -2.410  -0.903
  237    HG   SER  30           HG       SER  30 299.393  -0.605   0.862
  238    H    LYS  31           H        LYS  31 295.878  -4.042   0.096
  239    HA   LYS  31           HA       LYS  31 294.415  -1.990   1.506
  240    HB2  LYS  31           HB2      LYS  31 293.993  -2.928  -0.881
  241    HB3  LYS  31           HB3      LYS  31 293.147  -4.220  -0.041
  242    HG2  LYS  31           HG2      LYS  31 291.476  -2.827   0.699
  243    HG3  LYS  31           HG3      LYS  31 292.481  -1.381   0.572
  244    HD2  LYS  31           HD2      LYS  31 292.021  -2.779  -1.968
  245    HD3  LYS  31           HD3      LYS  31 290.570  -2.107  -1.223
  246    HE2  LYS  31           HE2      LYS  31 292.261  -0.033  -0.923
  247    HE3  LYS  31           HE3      LYS  31 292.907  -0.747  -2.400
  248    HZ1  LYS  31           HZ1      LYS  31 290.329  -0.756  -2.979
  249    HZ2  LYS  31           HZ2      LYS  31 291.333   0.562  -3.318
  250    HZ3  LYS  31           HZ3      LYS  31 290.356   0.578  -1.938
  251    H    LEU  32           H        LEU  32 294.521  -5.554   1.424
  252    HA   LEU  32           HA       LEU  32 292.672  -6.104   3.421
  253    HB2  LEU  32           HB2      LEU  32 293.516  -7.819   1.984
  254    HB3  LEU  32           HB3      LEU  32 295.164  -7.488   2.455
  255    HG   LEU  32           HG       LEU  32 293.311  -8.504   4.562
  256   HD11  LEU  32          HD11      LEU  32 293.914  -9.873   2.072
  257   HD12  LEU  32          HD12      LEU  32 292.706 -10.222   3.310
  258   HD13  LEU  32          HD13      LEU  32 294.369 -10.777   3.517
  259   HD21  LEU  32          HD21      LEU  32 295.836  -7.848   4.729
  260   HD22  LEU  32          HD22      LEU  32 296.086  -9.428   3.977
  261   HD23  LEU  32          HD23      LEU  32 295.239  -9.305   5.533
  262    H    MET  33           H        MET  33 296.181  -5.523   3.652
  263    HA   MET  33           HA       MET  33 296.273  -5.851   6.441
  264    HB2  MET  33           HB2      MET  33 298.296  -4.139   5.108
  265    HB3  MET  33           HB3      MET  33 298.475  -5.372   6.293
  266    HG2  MET  33           HG2      MET  33 298.936  -6.946   4.821
  267    HG3  MET  33           HG3      MET  33 297.596  -6.488   3.787
  268    HE1  MET  33           HE1      MET  33 301.078  -7.225   3.565
  269    HE2  MET  33           HE2      MET  33 301.322  -5.916   4.726
  270    HE3  MET  33           HE3      MET  33 301.964  -5.775   3.081
  271    H    LYS  34           H        LYS  34 295.646  -3.162   4.302
  272    HA   LYS  34           HA       LYS  34 295.927  -1.068   6.159
  273    HB2  LYS  34           HB2      LYS  34 294.489  -1.434   3.573
  274    HB3  LYS  34           HB3      LYS  34 293.995  -0.085   4.585
  275    HG2  LYS  34           HG2      LYS  34 296.879  -0.487   3.969
  276    HG3  LYS  34           HG3      LYS  34 295.816   0.241   2.767
  277    HD2  LYS  34           HD2      LYS  34 295.149   1.594   5.061
  278    HD3  LYS  34           HD3      LYS  34 296.887   1.353   5.245
  279    HE2  LYS  34           HE2      LYS  34 296.747   2.127   2.652
  280    HE3  LYS  34           HE3      LYS  34 295.395   3.025   3.339
  281    HZ1  LYS  34           HZ1      LYS  34 298.203   3.096   4.303
  282    HZ2  LYS  34           HZ2      LYS  34 296.911   3.934   5.002
  283    HZ3  LYS  34           HZ3      LYS  34 297.418   4.318   3.435
  284    H    ALA  35           H        ALA  35 293.387  -3.377   5.518
  285    HA   ALA  35           HA       ALA  35 291.396  -2.108   7.144
  286    HB1  ALA  35           HB1      ALA  35 290.895  -3.678   5.270
  287    HB2  ALA  35           HB2      ALA  35 290.134  -4.137   6.792
  288    HB3  ALA  35           HB3      ALA  35 291.576  -4.988   6.233
  289    H    TYR  36           H        TYR  36 293.885  -4.569   7.543
  290    HA   TYR  36           HA       TYR  36 293.192  -5.448  10.152
  291    HB2  TYR  36           HB2      TYR  36 294.881  -6.495   8.524
  292    HB3  TYR  36           HB3      TYR  36 295.972  -5.221   9.031
  293    HD1  TYR  36           HD2      TYR  36 293.574  -7.247  11.036
  294    HD2  TYR  36           HD1      TYR  36 297.648  -6.237  10.292
  295    HE1  TYR  36           HE2      TYR  36 294.276  -8.595  12.959
  296    HE2  TYR  36           HE1      TYR  36 298.354  -7.572  12.194
  297    HH   TYR  36           HH       TYR  36 297.051  -8.343  14.485
  298    H    CYS  37           H        CYS  37 295.382  -2.902   8.924
  299    HA   CYS  37           HA       CYS  37 296.265  -1.985  11.450
  300    HB2  CYS  37           HB2      CYS  37 296.384  -1.133   8.649
  301    HB3  CYS  37           HB3      CYS  37 296.232   0.228   9.751
  302    HG   CYS  37           HG       CYS  37 298.624  -1.748   9.715
  303    H    GLU  38           H        GLU  38 293.492  -1.448   9.429
  304    HA   GLU  38           HA       GLU  38 292.347   0.755  10.797
  305    HB2  GLU  38           HB2      GLU  38 291.683   0.219   8.538
  306    HB3  GLU  38           HB3      GLU  38 291.170  -1.387   9.023
  307    HG2  GLU  38           HG2      GLU  38 289.724   0.334  10.646
  308    HG3  GLU  38           HG3      GLU  38 289.747   1.087   9.060
  309    H    ARG  39           H        ARG  39 291.874  -2.779  10.940
  310    HA   ARG  39           HA       ARG  39 289.872  -3.129  12.665
  311    HB2  ARG  39           HB2      ARG  39 292.420  -4.493  12.045
  312    HB3  ARG  39           HB3      ARG  39 291.369  -5.138  13.222
  313    HG2  ARG  39           HG2      ARG  39 290.300  -4.393  10.614
  314    HG3  ARG  39           HG3      ARG  39 291.312  -5.834  10.753
  315    HD2  ARG  39           HD2      ARG  39 288.882  -6.091  11.012
  316    HD3  ARG  39           HD3      ARG  39 289.868  -6.859  12.222
  317    HE   ARG  39           HE       ARG  39 289.104  -5.253  13.772
  318   HH11  ARG  39          HH11      ARG  39 287.659  -4.814  10.608
  319   HH12  ARG  39          HH12      ARG  39 286.392  -3.794  11.199
  320   HH21  ARG  39          HH21      ARG  39 287.431  -3.910  14.534
  321   HH22  ARG  39          HH22      ARG  39 286.262  -3.281  13.422
  322    H    GLN  40           H        GLN  40 293.303  -2.593  13.412
  323    HA   GLN  40           HA       GLN  40 292.568  -2.114  16.217
  324    HB2  GLN  40           HB2      GLN  40 295.375  -2.887  15.832
  325    HB3  GLN  40           HB3      GLN  40 294.182  -3.500  16.955
  326    HG2  GLN  40           HG2      GLN  40 294.495  -5.374  15.762
  327    HG3  GLN  40           HG3      GLN  40 293.289  -4.640  14.709
  328   HE21  GLN  40          HE21      GLN  40 295.310  -2.584  13.874
  329   HE22  GLN  40          HE22      GLN  40 296.302  -3.400  12.726
  330    H    GLY  41           H        GLY  41 295.872  -1.423  15.336
  331    HA2  GLY  41           HA2      GLY  41 295.386   1.220  14.485
  332    HA3  GLY  41           HA3      GLY  41 295.888   1.145  16.162
  333    H    LEU  42           H        LEU  42 297.048  -1.180  13.841
  334    HA   LEU  42           HA       LEU  42 299.746  -0.636  14.414
  335    HB2  LEU  42           HB2      LEU  42 298.412  -2.201  12.226
  336    HB3  LEU  42           HB3      LEU  42 300.159  -2.077  12.313
  337    HG   LEU  42           HG       LEU  42 298.775  -2.906  14.793
  338   HD11  LEU  42          HD11      LEU  42 299.200  -5.296  13.412
  339   HD12  LEU  42          HD12      LEU  42 298.280  -4.265  12.316
  340   HD13  LEU  42          HD13      LEU  42 297.661  -4.606  13.936
  341   HD21  LEU  42          HD21      LEU  42 300.750  -4.040  15.198
  342   HD22  LEU  42          HD22      LEU  42 301.288  -2.620  14.299
  343   HD23  LEU  42          HD23      LEU  42 301.142  -4.178  13.484
  344    H    SER  43           H        SER  43 301.305  -0.234  12.506
  345    HA   SER  43           HA       SER  43 300.563   2.379  11.427
  346    HB2  SER  43           HB2      SER  43 302.655   2.163  12.724
  347    HB3  SER  43           HB3      SER  43 303.265   1.021  11.529
  348    HG   SER  43           HG       SER  43 303.203   2.670   9.988
  349    H    MET  44           H        MET  44 301.318  -0.828  10.386
  350    HA   MET  44           HA       MET  44 300.975  -1.836   8.379
  351    HB2  MET  44           HB2      MET  44 299.411   0.270   7.981
  352    HB3  MET  44           HB3      MET  44 300.672   0.661   6.817
  353    HG2  MET  44           HG2      MET  44 300.278  -1.954   6.279
  354    HG3  MET  44           HG3      MET  44 298.659  -1.475   6.781
  355    HE1  MET  44           HE1      MET  44 299.265  -1.594   2.699
  356    HE2  MET  44           HE2      MET  44 298.450  -2.478   3.989
  357    HE3  MET  44           HE3      MET  44 300.212  -2.444   3.920
  358    H    ARG  45           H        ARG  45 303.194   0.620   9.047
  359    HA   ARG  45           HA       ARG  45 304.961  -0.127   6.836
  360    HB2  ARG  45           HB2      ARG  45 304.348   2.347   8.026
  361    HB3  ARG  45           HB3      ARG  45 306.015   1.992   8.440
  362    HG2  ARG  45           HG2      ARG  45 305.261   1.555   5.629
  363    HG3  ARG  45           HG3      ARG  45 305.246   3.231   6.183
  364    HD2  ARG  45           HD2      ARG  45 307.539   2.896   7.063
  365    HD3  ARG  45           HD3      ARG  45 307.540   1.289   6.338
  366    HE   ARG  45           HE       ARG  45 307.854   3.812   4.980
  367   HH11  ARG  45          HH11      ARG  45 306.983   0.450   4.636
  368   HH12  ARG  45          HH12      ARG  45 307.335   0.404   2.941
  369   HH21  ARG  45          HH21      ARG  45 308.313   3.754   2.751
  370   HH22  ARG  45          HH22      ARG  45 308.090   2.279   1.871
  371    H    GLN  46           H        GLN  46 304.538   0.122  10.254
  372    HA   GLN  46           HA       GLN  46 307.104  -1.010  11.006
  373    HB2  GLN  46           HB2      GLN  46 305.773   0.713  12.306
  374    HB3  GLN  46           HB3      GLN  46 304.639  -0.582  12.685
  375    HG2  GLN  46           HG2      GLN  46 307.424  -1.248  13.252
  376    HG3  GLN  46           HG3      GLN  46 306.825   0.126  14.180
  377   HE21  GLN  46          HE21      GLN  46 307.503  -2.752  14.809
  378   HE22  GLN  46          HE22      GLN  46 306.129  -3.322  15.683
  379    H    ILE  47           H        ILE  47 304.385  -2.112   9.700
  380    HA   ILE  47           HA       ILE  47 304.290  -4.713  11.080
  381    HB   ILE  47           HB       ILE  47 302.303  -3.039  10.827
  382   HG12  ILE  47          HG12      ILE  47 301.976  -5.296  11.749
  383   HG13  ILE  47          HG13      ILE  47 300.660  -4.759  10.678
  384   HG21  ILE  47          HG21      ILE  47 302.627  -2.764   8.435
  385   HG22  ILE  47          HG22      ILE  47 301.006  -3.339   8.836
  386   HG23  ILE  47          HG23      ILE  47 302.199  -4.453   8.186
  387   HD11  ILE  47          HD11      ILE  47 302.399  -7.028  10.477
  388   HD12  ILE  47          HD12      ILE  47 302.171  -6.111   8.985
  389   HD13  ILE  47          HD13      ILE  47 300.758  -6.720   9.878
  390    H    ARG  48           H        ARG  48 304.447  -6.528   9.864
  391    HA   ARG  48           HA       ARG  48 304.671  -6.252   6.954
  392    HB2  ARG  48           HB2      ARG  48 306.539  -7.680   8.840
  393    HB3  ARG  48           HB3      ARG  48 306.353  -8.167   7.160
  394    HG2  ARG  48           HG2      ARG  48 307.154  -5.423   8.076
  395    HG3  ARG  48           HG3      ARG  48 308.263  -6.673   7.502
  396    HD2  ARG  48           HD2      ARG  48 307.857  -6.108   5.418
  397    HD3  ARG  48           HD3      ARG  48 306.150  -6.426   5.636
  398    HE   ARG  48           HE       ARG  48 307.418  -3.817   6.192
  399   HH11  ARG  48          HH11      ARG  48 304.722  -5.706   5.002
  400   HH12  ARG  48          HH12      ARG  48 303.779  -4.315   4.593
  401   HH21  ARG  48          HH21      ARG  48 306.170  -2.001   5.651
  402   HH22  ARG  48          HH22      ARG  48 304.597  -2.218   4.959
  403    H    PHE  49           H        PHE  49 303.049  -7.394   6.174
  404    HA   PHE  49           HA       PHE  49 301.836  -9.396   7.865
  405    HB2  PHE  49           HB2      PHE  49 301.078  -8.270   5.168
  406    HB3  PHE  49           HB3      PHE  49 300.254  -9.640   5.849
  407    HD1  PHE  49           HD2      PHE  49 301.485  -6.453   7.375
  408    HD2  PHE  49           HD1      PHE  49 298.205  -9.010   6.475
  409    HE1  PHE  49           HE2      PHE  49 300.016  -4.964   8.559
  410    HE2  PHE  49           HE1      PHE  49 296.722  -7.486   7.727
  411    HZ   PHE  49           HZ       PHE  49 297.676  -5.477   8.784
  412    H    ARG  50           H        ARG  50 302.454 -11.566   7.648
  413    HA   ARG  50           HA       ARG  50 303.807 -12.254   5.142
  414    HB2  ARG  50           HB2      ARG  50 304.915 -12.672   7.417
  415    HB3  ARG  50           HB3      ARG  50 303.819 -14.017   7.547
  416    HG2  ARG  50           HG2      ARG  50 304.894 -14.174   5.044
  417    HG3  ARG  50           HG3      ARG  50 306.243 -13.687   6.021
  418    HD2  ARG  50           HD2      ARG  50 304.474 -15.923   6.877
  419    HD3  ARG  50           HD3      ARG  50 305.726 -16.175   5.687
  420    HE   ARG  50           HE       ARG  50 306.476 -14.975   8.237
  421   HH11  ARG  50          HH11      ARG  50 306.647 -17.685   6.038
  422   HH12  ARG  50          HH12      ARG  50 307.926 -18.460   6.905
  423   HH21  ARG  50          HH21      ARG  50 308.161 -15.994   9.365
  424   HH22  ARG  50          HH22      ARG  50 308.787 -17.503   8.789
  425    H    PHE  51           H        PHE  51 303.002 -13.869   3.944
  426    HA   PHE  51           HA       PHE  51 300.266 -14.571   4.554
  427    HB2  PHE  51           HB2      PHE  51 300.391 -13.925   2.328
  428    HB3  PHE  51           HB3      PHE  51 301.959 -14.652   2.105
  429    HD1  PHE  51           HD1      PHE  51 298.502 -15.714   2.932
  430    HD2  PHE  51           HD2      PHE  51 302.046 -16.508   0.730
  431    HE1  PHE  51           HE1      PHE  51 297.431 -17.668   1.921
  432    HE2  PHE  51           HE2      PHE  51 300.980 -18.472  -0.292
  433    HZ   PHE  51           HZ       PHE  51 298.663 -19.058   0.304
  434    H    ASP  52           H        ASP  52 299.625 -16.808   4.314
  435    HA   ASP  52           HA       ASP  52 300.725 -18.451   6.182
  436    HB2  ASP  52           HB2      ASP  52 298.664 -18.932   4.671
  437    HB3  ASP  52           HB3      ASP  52 299.820 -19.727   3.610
  438    H    GLY  53           H        GLY  53 302.843 -18.315   6.335
  439    HA2  GLY  53           HA2      GLY  53 305.054 -18.636   5.970
  440    HA3  GLY  53           HA3      GLY  53 304.556 -20.056   5.086
  441    H    GLN  54           H        GLN  54 304.537 -16.447   4.524
  442    HA   GLN  54           HA       GLN  54 306.323 -16.698   2.339
  443    HB2  GLN  54           HB2      GLN  54 303.831 -17.540   1.616
  444    HB3  GLN  54           HB3      GLN  54 303.718 -15.821   1.259
  445    HG2  GLN  54           HG2      GLN  54 304.447 -16.671  -0.741
  446    HG3  GLN  54           HG3      GLN  54 305.964 -16.189   0.021
  447   HE21  GLN  54          HE21      GLN  54 304.580 -18.540  -1.726
  448   HE22  GLN  54          HE22      GLN  54 305.531 -19.896  -1.234
  449    HA   PRO  55           HA       PRO  55 306.593 -12.593   4.227
  450    HB2  PRO  55           HB2      PRO  55 308.318 -11.865   2.082
  451    HB3  PRO  55           HB3      PRO  55 308.773 -12.263   3.735
  452    HG2  PRO  55           HG2      PRO  55 308.784 -13.972   1.310
  453    HG3  PRO  55           HG3      PRO  55 309.799 -14.068   2.761
  454    HD2  PRO  55           HD2      PRO  55 307.853 -15.837   2.284
  455    HD3  PRO  55           HD3      PRO  55 308.189 -15.275   3.934
  456    H    ILE  56           H        ILE  56 305.521 -10.716   3.747
  457    HA   ILE  56           HA       ILE  56 304.157 -10.663   1.140
  458    HB   ILE  56           HB       ILE  56 303.275  -9.719   3.822
  459   HG12  ILE  56          HG12      ILE  56 302.601 -12.015   2.052
  460   HG13  ILE  56          HG13      ILE  56 302.912 -11.980   3.764
  461   HG21  ILE  56          HG21      ILE  56 301.900  -9.316   1.188
  462   HG22  ILE  56          HG22      ILE  56 302.515  -8.076   2.288
  463   HG23  ILE  56          HG23      ILE  56 301.146  -9.083   2.776
  464   HD11  ILE  56          HD11      ILE  56 300.708 -12.328   3.841
  465   HD12  ILE  56          HD12      ILE  56 300.407 -11.508   2.309
  466   HD13  ILE  56          HD13      ILE  56 300.682 -10.566   3.778
  467    H    ASN  57           H        ASN  57 303.585  -8.800   0.239
  468    HA   ASN  57           HA       ASN  57 305.101  -6.391   0.937
  469    HB2  ASN  57           HB2      ASN  57 304.438  -7.351  -1.808
  470    HB3  ASN  57           HB3      ASN  57 305.473  -5.998  -1.413
  471   HD21  ASN  57          HD21      ASN  57 306.771  -7.485   0.760
  472   HD22  ASN  57          HD22      ASN  57 307.801  -8.625  -0.013
  473    H    GLU  58           H        GLU  58 304.049  -4.417   0.523
  474    HA   GLU  58           HA       GLU  58 301.315  -4.322   0.945
  475    HB2  GLU  58           HB2      GLU  58 303.419  -2.433   0.166
  476    HB3  GLU  58           HB3      GLU  58 301.822  -1.984  -0.408
  477    HG2  GLU  58           HG2      GLU  58 300.991  -2.217   1.926
  478    HG3  GLU  58           HG3      GLU  58 302.658  -2.478   2.437
  479    H    THR  59           H        THR  59 303.138  -4.640  -2.000
  480    HA   THR  59           HA       THR  59 300.794  -4.238  -3.652
  481    HB   THR  59           HB       THR  59 302.496  -4.705  -5.505
  482    HG1  THR  59           HG1      THR  59 304.245  -5.542  -4.640
  483   HG21  THR  59          HG21      THR  59 302.168  -2.390  -3.799
  484   HG22  THR  59          HG22      THR  59 302.294  -2.496  -5.558
  485   HG23  THR  59          HG23      THR  59 303.755  -2.445  -4.571
  486    H    ASP  60           H        ASP  60 302.561  -6.892  -2.309
  487    HA   ASP  60           HA       ASP  60 302.066  -8.916  -4.151
  488    HB2  ASP  60           HB2      ASP  60 302.286  -8.920  -1.156
  489    HB3  ASP  60           HB3      ASP  60 301.890 -10.399  -2.021
  490    H    THR  61           H        THR  61 300.312 -10.128  -4.717
  491    HA   THR  61           HA       THR  61 297.805  -9.564  -3.287
  492    HB   THR  61           HB       THR  61 296.602  -9.290  -5.194
  493    HG1  THR  61           HG1      THR  61 298.263 -10.154  -7.153
  494   HG21  THR  61          HG21      THR  61 297.773  -7.903  -6.810
  495   HG22  THR  61          HG22      THR  61 299.321  -8.411  -6.122
  496   HG23  THR  61          HG23      THR  61 298.195  -7.461  -5.152
  497    HA   PRO  62           HA       PRO  62 296.834 -13.734  -2.429
  498    HB2  PRO  62           HB2      PRO  62 294.478 -13.292  -4.198
  499    HB3  PRO  62           HB3      PRO  62 294.537 -13.930  -2.557
  500    HG2  PRO  62           HG2      PRO  62 293.739 -11.412  -3.201
  501    HG3  PRO  62           HG3      PRO  62 294.447 -11.849  -1.632
  502    HD2  PRO  62           HD2      PRO  62 295.564 -10.224  -3.774
  503    HD3  PRO  62           HD3      PRO  62 296.143 -10.435  -2.113
  504    H    ALA  63           H        ALA  63 296.047 -12.723  -5.819
  505    HA   ALA  63           HA       ALA  63 296.308 -15.262  -7.012
  506    HB1  ALA  63           HB1      ALA  63 297.013 -12.621  -8.248
  507    HB2  ALA  63           HB2      ALA  63 295.332 -13.100  -7.951
  508    HB3  ALA  63           HB3      ALA  63 296.340 -14.053  -9.044
  509    H    GLN  64           H        GLN  64 298.393 -12.570  -6.481
  510    HA   GLN  64           HA       GLN  64 300.726 -13.503  -7.765
  511    HB2  GLN  64           HB2      GLN  64 299.716 -11.225  -6.381
  512    HB3  GLN  64           HB3      GLN  64 301.231 -11.650  -5.662
  513    HG2  GLN  64           HG2      GLN  64 300.795 -11.227  -8.592
  514    HG3  GLN  64           HG3      GLN  64 301.399  -9.994  -7.487
  515   HE21  GLN  64          HE21      GLN  64 303.472  -9.702  -7.921
  516   HE22  GLN  64          HE22      GLN  64 304.652 -10.948  -8.119
  517    H    LEU  65           H        LEU  65 299.138 -14.262  -4.922
  518    HA   LEU  65           HA       LEU  65 301.488 -15.529  -3.709
  519    HB2  LEU  65           HB2      LEU  65 299.100 -14.122  -2.571
  520    HB3  LEU  65           HB3      LEU  65 300.097 -15.145  -1.586
  521    HG   LEU  65           HG       LEU  65 300.801 -12.551  -2.934
  522   HD11  LEU  65          HD11      LEU  65 301.522 -13.200  -0.137
  523   HD12  LEU  65          HD12      LEU  65 299.820 -12.926  -0.500
  524   HD13  LEU  65          HD13      LEU  65 301.012 -11.675  -0.860
  525   HD21  LEU  65          HD21      LEU  65 303.122 -12.940  -2.096
  526   HD22  LEU  65          HD22      LEU  65 302.635 -13.977  -3.438
  527   HD23  LEU  65          HD23      LEU  65 302.668 -14.617  -1.794
  528    H    GLU  66           H        GLU  66 298.845 -16.203  -5.450
  529    HA   GLU  66           HA       GLU  66 297.328 -17.901  -5.647
  530    HB2  GLU  66           HB2      GLU  66 299.709 -19.417  -4.542
  531    HB3  GLU  66           HB3      GLU  66 298.317 -20.165  -5.314
  532    HG2  GLU  66           HG2      GLU  66 298.952 -19.533  -7.397
  533    HG3  GLU  66           HG3      GLU  66 299.744 -18.063  -6.832
  534    H    MET  67           H        MET  67 296.565 -16.542  -3.612
  535    HA   MET  67           HA       MET  67 296.536 -18.030  -1.156
  536    HB2  MET  67           HB2      MET  67 295.611 -15.353  -2.068
  537    HB3  MET  67           HB3      MET  67 294.978 -15.992  -0.566
  538    HG2  MET  67           HG2      MET  67 297.636 -16.454  -0.281
  539    HG3  MET  67           HG3      MET  67 297.638 -14.956  -1.197
  540    HE1  MET  67           HE1      MET  67 298.760 -13.467   1.100
  541    HE2  MET  67           HE2      MET  67 297.366 -12.403   1.289
  542    HE3  MET  67           HE3      MET  67 297.812 -12.993  -0.312
  543    H    GLU  68           H        GLU  68 293.661 -16.385  -2.313
  544    HA   GLU  68           HA       GLU  68 291.743 -17.510  -3.281
  545    HB2  GLU  68           HB2      GLU  68 292.528 -19.696  -1.368
  546    HB3  GLU  68           HB3      GLU  68 290.935 -19.599  -2.098
  547    HG2  GLU  68           HG2      GLU  68 291.655 -20.309  -4.098
  548    HG3  GLU  68           HG3      GLU  68 293.178 -19.429  -3.983
  549    H    ASP  69           H        ASP  69 289.620 -18.204  -1.919
  550    HA   ASP  69           HA       ASP  69 289.332 -16.048   0.018
  551    HB2  ASP  69           HB2      ASP  69 287.040 -16.134  -0.414
  552    HB3  ASP  69           HB3      ASP  69 287.787 -16.494  -1.966
  553    H    GLU  70           H        GLU  70 290.703 -18.404   0.579
  554    HA   GLU  70           HA       GLU  70 289.599 -18.967   3.179
  555    HB2  GLU  70           HB2      GLU  70 289.807 -21.182   1.148
  556    HB3  GLU  70           HB3      GLU  70 289.655 -21.470   2.878
  557    HG2  GLU  70           HG2      GLU  70 287.574 -19.926   2.680
  558    HG3  GLU  70           HG3      GLU  70 287.672 -20.333   0.969
  559    H    ASP  71           H        ASP  71 291.956 -17.770   2.247
  560    HA   ASP  71           HA       ASP  71 293.960 -19.685   3.179
  561    HB2  ASP  71           HB2      ASP  71 293.975 -17.973   0.981
  562    HB3  ASP  71           HB3      ASP  71 295.033 -17.198   2.148
  563    H    THR  72           H        THR  72 295.875 -18.070   4.105
  564    HA   THR  72           HA       THR  72 294.605 -16.361   6.142
  565    HB   THR  72           HB       THR  72 296.576 -18.572   6.669
  566    HG1  THR  72           HG1      THR  72 294.157 -18.106   8.013
  567   HG21  THR  72          HG21      THR  72 295.680 -17.263   9.041
  568   HG22  THR  72          HG22      THR  72 296.484 -16.104   7.985
  569   HG23  THR  72          HG23      THR  72 297.328 -17.566   8.491
  570    H    ILE  73           H        ILE  73 295.635 -14.567   6.488
  571    HA   ILE  73           HA       ILE  73 298.255 -14.147   5.231
  572    HB   ILE  73           HB       ILE  73 296.012 -12.226   5.914
  573   HG12  ILE  73          HG12      ILE  73 296.268 -12.834   3.635
  574   HG13  ILE  73          HG13      ILE  73 296.930 -11.227   3.843
  575   HG21  ILE  73          HG21      ILE  73 297.451 -10.806   6.979
  576   HG22  ILE  73          HG22      ILE  73 298.223 -10.580   5.410
  577   HG23  ILE  73          HG23      ILE  73 298.858 -11.769   6.542
  578   HD11  ILE  73          HD11      ILE  73 299.087 -12.626   4.317
  579   HD12  ILE  73          HD12      ILE  73 298.639 -12.011   2.724
  580   HD13  ILE  73          HD13      ILE  73 298.282 -13.685   3.160
  581    H    ASP  74           H        ASP  74 299.908 -14.014   6.546
  582    HA   ASP  74           HA       ASP  74 299.382 -14.180   9.422
  583    HB2  ASP  74           HB2      ASP  74 302.052 -14.636   8.042
  584    HB3  ASP  74           HB3      ASP  74 301.581 -15.105   9.675
  585    H    VAL  75           H        VAL  75 300.211 -12.642  10.831
  586    HA   VAL  75           HA       VAL  75 301.406 -10.352   9.439
  587    HB   VAL  75           HB       VAL  75 299.210 -10.349  11.415
  588   HG11  VAL  75          HG11      VAL  75 300.902  -9.395  12.859
  589   HG12  VAL  75          HG12      VAL  75 299.910  -8.074  12.242
  590   HG13  VAL  75          HG13      VAL  75 301.504  -8.366  11.555
  591   HG21  VAL  75          HG21      VAL  75 298.488  -8.523  10.116
  592   HG22  VAL  75          HG22      VAL  75 299.225  -9.632   8.961
  593   HG23  VAL  75          HG23      VAL  75 300.106  -8.212   9.500
  594    H    PHE  76           H        PHE  76 303.090  -9.441  10.129
  595    HA   PHE  76           HA       PHE  76 304.272 -10.103  12.692
  596    HB2  PHE  76           HB2      PHE  76 305.756 -10.318  10.096
  597    HB3  PHE  76           HB3      PHE  76 306.440 -10.566  11.676
  598    HD1  PHE  76           HD1      PHE  76 305.059 -12.319  13.126
  599    HD2  PHE  76           HD2      PHE  76 305.298 -12.348   8.854
  600    HE1  PHE  76           HE1      PHE  76 304.505 -14.709  13.113
  601    HE2  PHE  76           HE2      PHE  76 304.742 -14.743   8.868
  602    HZ   PHE  76           HZ       PHE  76 304.346 -15.921  10.982
  603    H    GLN  77           H        GLN  77 305.106  -8.351  13.507
  604    HA   GLN  77           HA       GLN  77 304.906  -5.867  12.015
  605    HB2  GLN  77           HB2      GLN  77 304.637  -6.608  14.733
  606    HB3  GLN  77           HB3      GLN  77 305.978  -5.472  14.646
  607    HG2  GLN  77           HG2      GLN  77 304.646  -3.764  13.844
  608    HG3  GLN  77           HG3      GLN  77 303.408  -4.873  13.250
  609   HE21  GLN  77          HE21      GLN  77 302.501  -6.282  15.133
  610   HE22  GLN  77          HE22      GLN  77 302.008  -5.388  16.527
  611    H    GLN  78           H        GLN  78 306.607  -5.289  10.785
  612    HA   GLN  78           HA       GLN  78 308.717  -5.044   9.996
  613    HB2  GLN  78           HB2      GLN  78 308.580  -3.992  12.683
  614    HB3  GLN  78           HB3      GLN  78 310.214  -4.521  12.306
  615    HG2  GLN  78           HG2      GLN  78 308.973  -2.987  10.163
  616    HG3  GLN  78           HG3      GLN  78 309.125  -2.092  11.674
  617   HE21  GLN  78          HE21      GLN  78 310.628  -2.813   8.852
  618   HE22  GLN  78          HE22      GLN  78 312.267  -2.510   9.306
  619    H    GLN  79           H        GLN  79 309.669  -6.788   9.192
  620    HA   GLN  79           HA       GLN  79 311.768  -8.090  10.395
  621    HB2  GLN  79           HB2      GLN  79 310.813 -10.353  10.845
  622    HB3  GLN  79           HB3      GLN  79 310.282  -9.116  11.974
  623    HG2  GLN  79           HG2      GLN  79 308.149  -9.398  11.432
  624    HG3  GLN  79           HG3      GLN  79 308.499  -9.354   9.705
  625   HE21  GLN  79          HE21      GLN  79 308.404 -11.413  12.545
  626   HE22  GLN  79          HE22      GLN  79 308.211 -12.903  11.692
  627    H    THR  80           H        THR  80 309.159  -8.225   8.133
  628    HA   THR  80           HA       THR  80 310.519 -10.101   6.394
  629    HB   THR  80           HB       THR  80 308.555 -10.229   5.166
  630    HG1  THR  80           HG1      THR  80 307.973  -8.270   4.569
  631   HG21  THR  80          HG21      THR  80 306.711 -10.372   6.704
  632   HG22  THR  80          HG22      THR  80 307.594  -9.405   7.887
  633   HG23  THR  80          HG23      THR  80 308.183 -11.008   7.444
  634    H    GLY  81           H        GLY  81 309.784  -9.125   3.889
  635    HA2  GLY  81           HA2      GLY  81 311.737  -6.968   3.572
  636    HA3  GLY  81           HA3      GLY  81 311.101  -7.989   2.289
  637    H    GLY  82           H        GLY  82 310.906  -5.798   1.218
  638    HA2  GLY  82           HA2      GLY  82 308.355  -4.545   2.004
  639    HA3  GLY  82           HA3      GLY  82 309.712  -3.629   1.371
  640    H1   GLY   1           HT1      GLY   1 314.167   9.551  14.566
  641    H2   GLY   1           HT2      GLY   1 315.045   8.159  14.959
  642    H3   GLY   1           HT3      GLY   1 315.080   9.500  15.990
  643    HA2  GLY   1           HA3      GLY   1 313.640   7.963  17.010
  644    HA3  GLY   1           HA2      GLY   1 312.632   9.221  16.310
  645    H    SER   2           H        SER   2 312.650   8.489  13.640
  646    HA   SER   2           HA       SER   2 311.317   5.861  13.728
  647    HB2  SER   2           HB2      SER   2 310.119   8.255  13.156
  648    HB3  SER   2           HB3      SER   2 310.539   7.676  11.544
  649    HG   SER   2           HG       SER   2 309.242   5.967  11.797
  650    H    GLU   3           H        GLU   3 311.402   4.583  11.787
  651    HA   GLU   3           HA       GLU   3 313.438   5.310   9.827
  652    HB2  GLU   3           HB2      GLU   3 314.155   3.735  11.943
  653    HB3  GLU   3           HB3      GLU   3 313.675   2.527  10.759
  654    HG2  GLU   3           HG2      GLU   3 315.332   3.153   9.260
  655    HG3  GLU   3           HG3      GLU   3 315.553   4.731  10.014
  656    H    GLU   4           H        GLU   4 312.409   5.120   7.943
  657    HA   GLU   4           HA       GLU   4 310.361   3.058   7.611
  658    HB2  GLU   4           HB2      GLU   4 310.991   5.313   5.720
  659    HB3  GLU   4           HB3      GLU   4 309.513   4.369   5.826
  660    HG2  GLU   4           HG2      GLU   4 308.652   5.665   7.425
  661    HG3  GLU   4           HG3      GLU   4 310.184   5.794   8.286
  662    H    LYS   5           H        LYS   5 310.660   3.362   4.692
  663    HA   LYS   5           HA       LYS   5 311.464   2.152   2.979
  664    HB2  LYS   5           HB2      LYS   5 314.002   2.007   2.809
  665    HB3  LYS   5           HB3      LYS   5 313.232   3.579   2.750
  666    HG2  LYS   5           HG2      LYS   5 314.182   2.549   5.346
  667    HG3  LYS   5           HG3      LYS   5 315.354   3.157   4.187
  668    HD2  LYS   5           HD2      LYS   5 314.160   5.281   4.082
  669    HD3  LYS   5           HD3      LYS   5 312.959   4.682   5.215
  670    HE2  LYS   5           HE2      LYS   5 315.032   4.258   6.742
  671    HE3  LYS   5           HE3      LYS   5 315.802   5.443   5.691
  672    HZ1  LYS   5           HZ1      LYS   5 314.718   7.090   6.685
  673    HZ2  LYS   5           HZ2      LYS   5 314.244   5.981   7.871
  674    HZ3  LYS   5           HZ3      LYS   5 313.224   6.305   6.562
  675    HA   PRO   6           HA       PRO   6 311.313  -2.104   4.196
  676    HB2  PRO   6           HB2      PRO   6 312.839  -2.372   1.632
  677    HB3  PRO   6           HB3      PRO   6 311.464  -3.321   2.212
  678    HG2  PRO   6           HG2      PRO   6 311.092  -1.431   0.394
  679    HG3  PRO   6           HG3      PRO   6 309.937  -1.613   1.728
  680    HD2  PRO   6           HD2      PRO   6 312.049   0.452   1.316
  681    HD3  PRO   6           HD3      PRO   6 310.453   0.607   2.079
  682    H    LYS   7           H        LYS   7 312.746  -2.338   5.928
  683    HA   LYS   7           HA       LYS   7 315.509  -1.985   5.870
  684    HB2  LYS   7           HB2      LYS   7 314.225  -2.369   7.950
  685    HB3  LYS   7           HB3      LYS   7 313.942  -4.034   7.462
  686    HG2  LYS   7           HG2      LYS   7 315.696  -4.070   9.043
  687    HG3  LYS   7           HG3      LYS   7 316.432  -4.352   7.464
  688    HD2  LYS   7           HD2      LYS   7 317.828  -2.801   8.593
  689    HD3  LYS   7           HD3      LYS   7 316.929  -1.879   7.386
  690    HE2  LYS   7           HE2      LYS   7 315.274  -1.711   9.538
  691    HE3  LYS   7           HE3      LYS   7 316.855  -1.739  10.318
  692    HZ1  LYS   7           HZ1      LYS   7 316.223   0.093   8.079
  693    HZ2  LYS   7           HZ2      LYS   7 317.523   0.175   9.159
  694    HZ3  LYS   7           HZ3      LYS   7 315.955   0.513   9.697
  695    H    GLU   8           H        GLU   8 316.422  -2.749   3.990
  696    HA   GLU   8           HA       GLU   8 317.350  -4.252   2.543
  697    HB2  GLU   8           HB2      GLU   8 317.635  -5.377   5.082
  698    HB3  GLU   8           HB3      GLU   8 316.957  -6.675   4.110
  699    HG2  GLU   8           HG2      GLU   8 318.851  -5.876   2.429
  700    HG3  GLU   8           HG3      GLU   8 319.594  -5.347   3.937
  701    H    GLY   9           H        GLY   9 315.030  -3.665   1.641
  702    HA2  GLY   9           HA2      GLY   9 313.670  -6.217   1.144
  703    HA3  GLY   9           HA3      GLY   9 312.754  -4.757   1.450
  704    H    VAL  10           H        VAL  10 315.666  -5.013  -0.418
  705    HA   VAL  10           HA       VAL  10 314.481  -3.744  -2.706
  706    HB   VAL  10           HB       VAL  10 316.805  -3.311  -2.194
  707   HG11  VAL  10          HG11      VAL  10 317.908  -5.898  -2.917
  708   HG12  VAL  10          HG12      VAL  10 316.890  -5.978  -1.477
  709   HG13  VAL  10          HG13      VAL  10 318.258  -4.864  -1.531
  710   HG21  VAL  10          HG21      VAL  10 317.070  -5.017  -4.622
  711   HG22  VAL  10          HG22      VAL  10 317.629  -3.369  -4.334
  712   HG23  VAL  10          HG23      VAL  10 315.922  -3.679  -4.649
  713    H    LYS  11           H        LYS  11 313.095  -4.778  -3.855
  714    HA   LYS  11           HA       LYS  11 313.558  -7.591  -4.546
  715    HB2  LYS  11           HB2      LYS  11 311.178  -5.948  -4.038
  716    HB3  LYS  11           HB3      LYS  11 311.046  -7.164  -5.312
  717    HG2  LYS  11           HG2      LYS  11 310.571  -8.544  -3.640
  718    HG3  LYS  11           HG3      LYS  11 312.296  -8.582  -3.396
  719    HD2  LYS  11           HD2      LYS  11 311.154  -8.191  -1.288
  720    HD3  LYS  11           HD3      LYS  11 312.134  -6.802  -1.757
  721    HE2  LYS  11           HE2      LYS  11 309.788  -6.106  -2.868
  722    HE3  LYS  11           HE3      LYS  11 309.205  -7.070  -1.514
  723    HZ1  LYS  11           HZ3      LYS  11 311.096  -5.525  -0.377
  724    H    THR  12           H        THR  12 311.674  -5.075  -6.041
  725    HA   THR  12           HA       THR  12 313.321  -5.160  -8.473
  726    HB   THR  12           HB       THR  12 311.512  -5.688  -9.922
  727    HG1  THR  12           HG1      THR  12 309.737  -4.750  -9.172
  728   HG21  THR  12          HG21      THR  12 310.903  -7.875  -9.302
  729   HG22  THR  12          HG22      THR  12 311.087  -7.516  -7.583
  730   HG23  THR  12          HG23      THR  12 312.508  -7.595  -8.626
  731    H    GLU  13           H        GLU  13 313.768  -2.992  -7.465
  732    HA   GLU  13           HA       GLU  13 313.476  -0.738  -7.278
  733    HB2  GLU  13           HB2      GLU  13 312.048  -0.564  -9.841
  734    HB3  GLU  13           HB3      GLU  13 313.539   0.212  -9.327
  735    HG2  GLU  13           HG2      GLU  13 314.826  -1.686  -9.889
  736    HG3  GLU  13           HG3      GLU  13 313.392  -2.690 -10.091
  737    H    ASN  14           H        ASN  14 311.742   1.136  -7.900
  738    HA   ASN  14           HA       ASN  14 309.850   2.089  -7.021
  739    HB2  ASN  14           HB2      ASN  14 309.197   0.854  -9.189
  740    HB3  ASN  14           HB3      ASN  14 308.358  -0.235  -8.089
  741   HD21  ASN  14          HD21      ASN  14 306.621   0.539  -6.859
  742   HD22  ASN  14          HD22      ASN  14 305.784   1.987  -7.294
  743    H    ASP  15           H        ASP  15 311.265   0.326  -5.284
  744    HA   ASP  15           HA       ASP  15 309.159  -0.165  -3.326
  745    HB2  ASP  15           HB2      ASP  15 310.955  -2.207  -4.525
  746    HB3  ASP  15           HB3      ASP  15 310.775  -2.280  -2.775
  747    H    HIS  16           H        HIS  16 310.849   1.971  -3.607
  748    HA   HIS  16           HA       HIS  16 312.886   2.903  -2.882
  749    HB2  HIS  16           HB2      HIS  16 311.058   2.921  -0.505
  750    HB3  HIS  16           HB3      HIS  16 312.240   4.120  -0.972
  751    HD1  HIS  16           HD1      HIS  16 308.896   2.778  -2.069
  752    HD2  HIS  16           HD2      HIS  16 311.402   6.027  -2.731
  753    HE1  HIS  16           HE1      HIS  16 307.542   4.402  -3.432
  754    HE2  HIS  16           HE2      HIS  16 309.102   6.329  -3.884
  755    H    ILE  17           H        ILE  17 314.712   2.837  -1.780
  756    HA   ILE  17           HA       ILE  17 315.061   0.885   0.379
  757    HB   ILE  17           HB       ILE  17 317.116   0.051  -0.464
  758   HG12  ILE  17          HG12      ILE  17 316.835   2.105  -2.653
  759   HG13  ILE  17          HG13      ILE  17 318.112   2.001  -1.464
  760   HG21  ILE  17          HG21      ILE  17 316.248  -1.388  -1.975
  761   HG22  ILE  17          HG22      ILE  17 315.650  -0.097  -3.019
  762   HG23  ILE  17          HG23      ILE  17 314.743  -0.557  -1.575
  763   HD11  ILE  17          HD11      ILE  17 318.168   1.033  -4.048
  764   HD12  ILE  17          HD12      ILE  17 317.986  -0.402  -3.033
  765   HD13  ILE  17          HD13      ILE  17 319.329   0.715  -2.755
  766    H    ASN  18           H        ASN  18 316.959   1.361   1.732
  767    HA   ASN  18           HA       ASN  18 317.333   4.198   1.989
  768    HB2  ASN  18           HB2      ASN  18 317.305   1.947   3.701
  769    HB3  ASN  18           HB3      ASN  18 318.971   2.496   3.708
  770   HD21  ASN  18          HD21      ASN  18 318.328   5.251   3.313
  771   HD22  ASN  18          HD22      ASN  18 317.667   5.838   4.795
  772    H    LEU  19           H        LEU  19 319.161   5.230   1.262
  773    HA   LEU  19           HA       LEU  19 321.332   3.554   0.246
  774    HB2  LEU  19           HB2      LEU  19 319.850   5.730  -0.989
  775    HB3  LEU  19           HB3      LEU  19 321.567   6.071  -0.991
  776    HG   LEU  19           HG       LEU  19 320.100   3.751  -2.266
  777   HD11  LEU  19          HD11      LEU  19 321.658   4.414  -4.172
  778   HD12  LEU  19          HD12      LEU  19 321.903   5.907  -3.269
  779   HD13  LEU  19          HD13      LEU  19 320.292   5.455  -3.810
  780   HD21  LEU  19          HD21      LEU  19 322.809   3.348  -2.775
  781   HD22  LEU  19          HD22      LEU  19 321.741   2.346  -1.795
  782   HD23  LEU  19          HD23      LEU  19 322.703   3.621  -1.039
  783    H    LYS  20           H        LYS  20 323.161   3.704   1.237
  784    HA   LYS  20           HA       LYS  20 323.652   5.845   3.155
  785    HB2  LYS  20           HB2      LYS  20 324.024   3.299   3.412
  786    HB3  LYS  20           HB3      LYS  20 325.497   3.555   2.594
  787    HG2  LYS  20           HG2      LYS  20 326.433   4.486   4.325
  788    HG3  LYS  20           HG3      LYS  20 324.950   5.283   4.857
  789    HD2  LYS  20           HD2      LYS  20 325.784   3.444   6.351
  790    HD3  LYS  20           HD3      LYS  20 324.123   3.289   5.796
  791    HE2  LYS  20           HE2      LYS  20 324.528   1.367   4.751
  792    HE3  LYS  20           HE3      LYS  20 326.003   2.007   4.011
  793    HZ1  LYS  20           HZ1      LYS  20 326.981   0.508   5.346
  794    HZ2  LYS  20           HZ2      LYS  20 325.678   0.431   6.422
  795    HZ3  LYS  20           HZ3      LYS  20 326.795   1.695   6.537
  796    H    VAL  21           H        VAL  21 324.999   7.589   2.600
  797    HA   VAL  21           HA       VAL  21 326.851   7.137   0.362
  798    HB   VAL  21           HB       VAL  21 326.073   9.894   1.225
  799   HG11  VAL  21          HG11      VAL  21 326.642  10.464  -0.991
  800   HG12  VAL  21          HG12      VAL  21 326.562   8.784  -1.527
  801   HG13  VAL  21          HG13      VAL  21 327.870   9.311  -0.468
  802   HG21  VAL  21          HG21      VAL  21 324.333   7.933  -0.201
  803   HG22  VAL  21          HG22      VAL  21 324.326   9.614  -0.734
  804   HG23  VAL  21          HG23      VAL  21 323.894   9.213   0.930
  805    H    ALA  22           H        ALA  22 328.959   7.138   0.910
  806    HA   ALA  22           HA       ALA  22 329.691   8.096   3.584
  807    HB1  ALA  22           HB1      ALA  22 330.312   5.771   2.284
  808    HB2  ALA  22           HB2      ALA  22 331.182   6.432   3.671
  809    HB3  ALA  22           HB3      ALA  22 331.766   6.741   2.034
  810    H    GLY  23           H        GLY  23 330.312  10.161   3.638
  811    HA2  GLY  23           HA2      GLY  23 331.726  11.243   1.305
  812    HA3  GLY  23           HA3      GLY  23 330.886  12.199   2.502
  813    H    GLN  24           H        GLN  24 333.711  11.952   1.294
  814    HA   GLN  24           HA       GLN  24 335.841  12.372   1.919
  815    HB2  GLN  24           HB2      GLN  24 334.461  13.354   4.385
  816    HB3  GLN  24           HB3      GLN  24 336.133  13.683   3.970
  817    HG2  GLN  24           HG2      GLN  24 335.221  14.636   1.794
  818    HG3  GLN  24           HG3      GLN  24 333.645  14.610   2.582
  819   HE21  GLN  24          HE21      GLN  24 333.085  16.365   3.653
  820   HE22  GLN  24          HE22      GLN  24 334.156  17.586   4.243
  821    H    ASP  25           H        ASP  25 334.553   9.815   2.718
  822    HA   ASP  25           HA       ASP  25 334.969   7.928   3.982
  823    HB2  ASP  25           HB2      ASP  25 336.940   8.209   2.384
  824    HB3  ASP  25           HB3      ASP  25 337.842   8.800   3.773
  825    H    GLY  26           H        GLY  26 334.306  10.079   5.633
  826    HA2  GLY  26           HA2      GLY  26 336.006   9.564   7.965
  827    HA3  GLY  26           HA3      GLY  26 335.277  11.130   7.665
  828    H    SER  27           H        SER  27 332.843   9.641   6.634
  829    HA   SER  27           HA       SER  27 331.745   8.271   8.888
  830    HB2  SER  27           HB2      SER  27 330.332   9.872   9.763
  831    HB3  SER  27           HB3      SER  27 331.682  10.904   9.291
  832    HG   SER  27           HG       SER  27 330.537  11.289   7.311
  833    H    VAL  28           H        VAL  28 329.067   8.720   8.336
  834    HA   VAL  28           HA       VAL  28 328.716   8.130   5.503
  835    HB   VAL  28           HB       VAL  28 329.175   5.958   6.422
  836   HG11  VAL  28          HG11      VAL  28 326.990   6.518   8.419
  837   HG12  VAL  28          HG12      VAL  28 328.721   6.450   8.759
  838   HG13  VAL  28          HG13      VAL  28 327.863   4.996   8.240
  839   HG21  VAL  28          HG21      VAL  28 326.179   6.223   6.031
  840   HG22  VAL  28          HG22      VAL  28 327.143   4.762   5.826
  841   HG23  VAL  28          HG23      VAL  28 327.367   6.124   4.733
  842    H    VAL  29           H        VAL  29 326.518   8.089   4.849
  843    HA   VAL  29           HA       VAL  29 324.581   9.188   6.743
  844    HB   VAL  29           HB       VAL  29 323.621  10.404   4.657
  845   HG11  VAL  29          HG11      VAL  29 325.962  11.507   6.174
  846   HG12  VAL  29          HG12      VAL  29 324.277  11.481   6.703
  847   HG13  VAL  29          HG13      VAL  29 324.750  12.454   5.304
  848   HG21  VAL  29          HG21      VAL  29 326.527  10.532   3.946
  849   HG22  VAL  29          HG22      VAL  29 325.152  11.181   3.050
  850   HG23  VAL  29          HG23      VAL  29 325.383   9.439   3.170
  851    H    GLN  30           H        GLN  30 322.443   8.624   6.218
  852    HA   GLN  30           HA       GLN  30 322.316   6.466   4.228
  853    HB2  GLN  30           HB2      GLN  30 321.422   6.542   7.015
  854    HB3  GLN  30           HB3      GLN  30 320.377   5.693   5.892
  855    HG2  GLN  30           HG2      GLN  30 322.905   4.776   5.273
  856    HG3  GLN  30           HG3      GLN  30 322.938   4.942   7.029
  857   HE21  GLN  30          HE21      GLN  30 321.894   3.486   8.260
  858   HE22  GLN  30          HE22      GLN  30 320.970   2.162   7.644
  859    H    PHE  31           H        PHE  31 321.285   7.150   2.601
  860    HA   PHE  31           HA       PHE  31 319.074   9.025   2.736
  861    HB2  PHE  31           HB2      PHE  31 320.608   7.791   0.422
  862    HB3  PHE  31           HB3      PHE  31 319.389   8.993   0.238
  863    HD1  PHE  31           HD2      PHE  31 321.049   9.734   3.225
  864    HD2  PHE  31           HD1      PHE  31 321.554   9.981  -0.978
  865    HE1  PHE  31           HE2      PHE  31 322.745  11.467   3.529
  866    HE2  PHE  31           HE1      PHE  31 323.250  11.723  -0.683
  867    HZ   PHE  31           HZ       PHE  31 323.851  12.460   1.584
  868    H    LYS  32           H        LYS  32 317.096   8.537   1.515
  869    HA   LYS  32           HA       LYS  32 316.655   5.649   1.230
  870    HB2  LYS  32           HB2      LYS  32 315.362   6.121   3.124
  871    HB3  LYS  32           HB3      LYS  32 314.823   7.647   2.483
  872    HG2  LYS  32           HG2      LYS  32 313.850   5.850   0.639
  873    HG3  LYS  32           HG3      LYS  32 313.677   4.986   2.166
  874    HD2  LYS  32           HD2      LYS  32 312.830   7.728   2.447
  875    HD3  LYS  32           HD3      LYS  32 311.987   6.949   1.107
  876    HE2  LYS  32           HE2      LYS  32 312.134   5.189   3.384
  877    HE3  LYS  32           HE3      LYS  32 311.410   6.731   3.835
  878    HZ1  LYS  32           HZ1      LYS  32 309.555   6.217   2.755
  879    HZ2  LYS  32           HZ2      LYS  32 310.150   4.642   2.597
  880    HZ3  LYS  32           HZ3      LYS  32 310.388   5.762   1.353
  881    H    ILE  33           H        ILE  33 316.486   5.205  -0.719
  882    HA   ILE  33           HA       ILE  33 314.924   6.894  -2.515
  883    HB   ILE  33           HB       ILE  33 317.318   7.599  -2.673
  884   HG12  ILE  33          HG12      ILE  33 316.258   6.218  -5.163
  885   HG13  ILE  33          HG13      ILE  33 315.681   7.773  -4.581
  886   HG21  ILE  33          HG21      ILE  33 317.669   4.718  -2.996
  887   HG22  ILE  33          HG22      ILE  33 318.808   5.958  -2.485
  888   HG23  ILE  33          HG23      ILE  33 318.517   5.681  -4.203
  889   HD11  ILE  33          HD11      ILE  33 317.353   7.824  -6.455
  890   HD12  ILE  33          HD12      ILE  33 318.552   7.272  -5.283
  891   HD13  ILE  33          HD13      ILE  33 317.735   8.817  -5.048
  892    H    LYS  34           H        LYS  34 314.058   5.868  -4.244
  893    HA   LYS  34           HA       LYS  34 313.563   3.106  -4.013
  894    HB2  LYS  34           HB2      LYS  34 311.948   4.694  -4.948
  895    HB3  LYS  34           HB3      LYS  34 313.037   5.016  -6.266
  896    HG2  LYS  34           HG2      LYS  34 312.782   2.436  -6.698
  897    HG3  LYS  34           HG3      LYS  34 311.291   2.677  -5.790
  898    HD2  LYS  34           HD2      LYS  34 310.934   2.907  -8.218
  899    HD3  LYS  34           HD3      LYS  34 310.576   4.399  -7.351
  900    HE2  LYS  34           HE2      LYS  34 312.946   5.117  -7.947
  901    HE3  LYS  34           HE3      LYS  34 312.964   3.748  -9.046
  902    HZ1  LYS  34           HZ1      LYS  34 312.128   5.202 -10.495
  903    HZ2  LYS  34           HZ2      LYS  34 311.625   6.282  -9.295
  904    HZ3  LYS  34           HZ3      LYS  34 310.657   4.954  -9.696
  905    H    ARG  35           H        ARG  35 314.141   3.594  -7.286
  906    HA   ARG  35           HA       ARG  35 316.939   2.919  -7.265
  907    HB2  ARG  35           HB2      ARG  35 315.008   0.872  -8.353
  908    HB3  ARG  35           HB3      ARG  35 316.741   0.722  -8.187
  909    HG2  ARG  35           HG2      ARG  35 316.085   1.120  -5.626
  910    HG3  ARG  35           HG3      ARG  35 314.619   0.331  -6.197
  911    HD2  ARG  35           HD2      ARG  35 317.443  -0.683  -6.320
  912    HD3  ARG  35           HD3      ARG  35 316.111  -1.335  -5.371
  913    HE   ARG  35           HE       ARG  35 315.210  -1.551  -7.906
  914   HH11  ARG  35          HH11      ARG  35 318.182  -2.524  -6.355
  915   HH12  ARG  35          HH12      ARG  35 318.420  -3.893  -7.388
  916   HH21  ARG  35          HH21      ARG  35 315.522  -3.362  -9.263
  917   HH22  ARG  35          HH22      ARG  35 316.913  -4.367  -9.038
  918    H    HIS  36           H        HIS  36 314.122   2.386  -9.379
  919    HA   HIS  36           HA       HIS  36 315.313   2.886 -11.812
  920    HB2  HIS  36           HB2      HIS  36 313.162   1.910 -11.768
  921    HB3  HIS  36           HB3      HIS  36 312.475   3.237 -10.847
  922    HD1  HIS  36           HD1      HIS  36 312.234   1.896 -14.038
  923    HD2  HIS  36           HD2      HIS  36 312.894   5.742 -12.646
  924    HE1  HIS  36           HE1      HIS  36 311.535   3.412 -15.921
  925    HE2  HIS  36           HE2      HIS  36 312.024   5.741 -15.086
  926    H    THR  37           H        THR  37 314.873   5.132  -9.364
  927    HA   THR  37           HA       THR  37 314.756   7.480 -11.117
  928    HB   THR  37           HB       THR  37 314.817   7.068  -8.147
  929    HG1  THR  37           HG1      THR  37 313.015   8.205 -10.003
  930   HG21  THR  37          HG21      THR  37 315.654   9.466  -9.623
  931   HG22  THR  37          HG22      THR  37 316.007   8.954  -7.970
  932   HG23  THR  37          HG23      THR  37 314.465   9.730  -8.341
  933    HA   PRO  38           HA       PRO  38 319.068   7.925 -11.870
  934    HB2  PRO  38           HB2      PRO  38 318.482  10.781 -11.519
  935    HB3  PRO  38           HB3      PRO  38 319.101   9.935 -12.951
  936    HG2  PRO  38           HG2      PRO  38 316.469  10.858 -12.527
  937    HG3  PRO  38           HG3      PRO  38 317.017   9.803 -13.828
  938    HD2  PRO  38           HD2      PRO  38 315.314   9.246 -11.634
  939    HD3  PRO  38           HD3      PRO  38 315.857   8.147 -12.902
  940    H    LEU  39           H        LEU  39 320.826   8.177 -10.524
  941    HA   LEU  39           HA       LEU  39 320.303   8.494  -7.754
  942    HB2  LEU  39           HB2      LEU  39 322.857   8.212  -9.309
  943    HB3  LEU  39           HB3      LEU  39 322.825   8.380  -7.560
  944    HG   LEU  39           HG       LEU  39 321.214   6.241  -8.901
  945   HD11  LEU  39          HD11      LEU  39 323.621   6.169  -9.663
  946   HD12  LEU  39          HD12      LEU  39 322.982   4.718  -8.893
  947   HD13  LEU  39          HD13      LEU  39 324.032   5.807  -7.988
  948   HD21  LEU  39          HD21      LEU  39 320.777   6.686  -6.556
  949   HD22  LEU  39          HD22      LEU  39 322.489   6.481  -6.181
  950   HD23  LEU  39          HD23      LEU  39 321.540   5.108  -6.755
  951    H    SER  40           H        SER  40 321.041  10.789 -10.242
  952    HA   SER  40           HA       SER  40 322.376  12.743  -8.757
  953    HB2  SER  40           HB2      SER  40 321.584  12.544 -11.333
  954    HB3  SER  40           HB3      SER  40 320.360  13.661 -10.726
  955    HG   SER  40           HG       SER  40 322.530  14.475 -11.556
  956    H    LYS  41           H        LYS  41 319.231  11.532  -8.457
  957    HA   LYS  41           HA       LYS  41 317.967  13.834  -7.351
  958    HB2  LYS  41           HB2      LYS  41 317.380  11.012  -7.869
  959    HB3  LYS  41           HB3      LYS  41 316.510  11.733  -6.542
  960    HG2  LYS  41           HG2      LYS  41 315.053  12.271  -8.159
  961    HG3  LYS  41           HG3      LYS  41 316.142  13.620  -8.410
  962    HD2  LYS  41           HD2      LYS  41 317.087  12.696 -10.298
  963    HD3  LYS  41           HD3      LYS  41 316.645  11.048  -9.843
  964    HE2  LYS  41           HE2      LYS  41 315.359  12.208 -11.757
  965    HE3  LYS  41           HE3      LYS  41 314.465  11.305 -10.539
  966    HZ1  LYS  41           HZ1      LYS  41 313.481  13.489 -11.083
  967    HZ2  LYS  41           HZ2      LYS  41 314.866  14.243 -10.470
  968    HZ3  LYS  41           HZ3      LYS  41 313.877  13.331  -9.445
  969    H    LEU  42           H        LEU  42 319.882  11.164  -6.346
  970    HA   LEU  42           HA       LEU  42 319.471  11.469  -3.500
  971    HB2  LEU  42           HB2      LEU  42 319.659   9.299  -4.756
  972    HB3  LEU  42           HB3      LEU  42 321.342   9.684  -5.038
  973    HG   LEU  42           HG       LEU  42 320.490   9.699  -2.215
  974   HD11  LEU  42          HD11      LEU  42 319.269   7.830  -2.636
  975   HD12  LEU  42          HD12      LEU  42 320.859   7.162  -2.289
  976   HD13  LEU  42          HD13      LEU  42 320.316   7.316  -3.958
  977   HD21  LEU  42          HD21      LEU  42 322.833   8.607  -3.760
  978   HD22  LEU  42          HD22      LEU  42 322.664   8.526  -2.004
  979   HD23  LEU  42          HD23      LEU  42 322.790  10.092  -2.809
  980    H    MET  43           H        MET  43 322.001  11.941  -5.911
  981    HA   MET  43           HA       MET  43 324.155  12.445  -4.274
  982    HB2  MET  43           HB2      MET  43 323.632  13.745  -6.941
  983    HB3  MET  43           HB3      MET  43 325.198  13.530  -6.170
  984    HG2  MET  43           HG2      MET  43 324.002  10.984  -6.290
  985    HG3  MET  43           HG3      MET  43 323.755  11.735  -7.862
  986    HE1  MET  43           HE1      MET  43 325.517   9.101  -6.851
  987    HE2  MET  43           HE2      MET  43 326.898   9.166  -7.950
  988    HE3  MET  43           HE3      MET  43 325.263   9.420  -8.565
  989    H    LYS  44           H        LYS  44 321.468  14.593  -4.854
  990    HA   LYS  44           HA       LYS  44 322.953  16.919  -3.876
  991    HB2  LYS  44           HB2      LYS  44 321.314  17.285  -5.613
  992    HB3  LYS  44           HB3      LYS  44 320.039  16.640  -4.592
  993    HG2  LYS  44           HG2      LYS  44 320.386  19.215  -4.827
  994    HG3  LYS  44           HG3      LYS  44 319.953  18.526  -3.280
  995    HD2  LYS  44           HD2      LYS  44 321.687  19.668  -2.480
  996    HD3  LYS  44           HD3      LYS  44 322.704  18.490  -3.292
  997    HE2  LYS  44           HE2      LYS  44 323.510  20.530  -4.044
  998    HE3  LYS  44           HE3      LYS  44 322.477  19.961  -5.351
  999    HZ1  LYS  44           HZ1      LYS  44 322.291  22.396  -4.468
 1000    HZ2  LYS  44           HZ2      LYS  44 321.311  21.687  -3.286
 1001    HZ3  LYS  44           HZ3      LYS  44 320.903  21.540  -4.920
 1002    H    ALA  45           H        ALA  45 320.976  14.395  -2.584
 1003    HA   ALA  45           HA       ALA  45 319.896  15.670  -0.318
 1004    HB1  ALA  45           HB1      ALA  45 320.576  12.865  -0.967
 1005    HB2  ALA  45           HB2      ALA  45 319.112  13.541  -0.248
 1006    HB3  ALA  45           HB3      ALA  45 320.545  13.268   0.761
 1007    H    TYR  46           H        TYR  46 322.867  13.770  -0.574
 1008    HA   TYR  46           HA       TYR  46 323.988  14.302   1.829
 1009    HB2  TYR  46           HB2      TYR  46 324.885  13.020  -0.341
 1010    HB3  TYR  46           HB3      TYR  46 325.859  14.483  -0.462
 1011    HD1  TYR  46           HD1      TYR  46 325.061  13.862   2.926
 1012    HD2  TYR  46           HD2      TYR  46 327.663  12.630  -0.210
 1013    HE1  TYR  46           HE1      TYR  46 326.588  12.939   4.580
 1014    HE2  TYR  46           HE2      TYR  46 329.211  11.675   1.451
 1015    HH   TYR  46           HH       TYR  46 329.663  12.274   4.092
 1016    H    CYS  47           H        CYS  47 324.097  16.397  -1.041
 1017    HA   CYS  47           HA       CYS  47 325.798  18.342  -0.060
 1018    HB2  CYS  47           HB2      CYS  47 323.367  18.647  -1.807
 1019    HB3  CYS  47           HB3      CYS  47 324.762  19.683  -1.800
 1020    HG   CYS  47           HG       CYS  47 326.025  18.069  -3.175
 1021    H    GLU  48           H        GLU  48 322.237  18.419  -0.254
 1022    HA   GLU  48           HA       GLU  48 321.828  20.645   1.332
 1023    HB2  GLU  48           HB2      GLU  48 319.959  18.286   1.376
 1024    HB3  GLU  48           HB3      GLU  48 319.561  19.993   1.500
 1025    HG2  GLU  48           HG2      GLU  48 320.227  20.290  -0.877
 1026    HG3  GLU  48           HG3      GLU  48 320.546  18.571  -0.962
 1027    H    ARG  49           H        ARG  49 323.003  17.571   2.157
 1028    HA   ARG  49           HA       ARG  49 322.324  17.589   4.950
 1029    HB2  ARG  49           HB2      ARG  49 323.336  15.780   2.930
 1030    HB3  ARG  49           HB3      ARG  49 324.235  15.646   4.412
 1031    HG2  ARG  49           HG2      ARG  49 322.468  14.728   5.535
 1032    HG3  ARG  49           HG3      ARG  49 321.287  15.604   4.564
 1033    HD2  ARG  49           HD2      ARG  49 322.862  13.724   3.011
 1034    HD3  ARG  49           HD3      ARG  49 321.921  12.958   4.271
 1035    HE   ARG  49           HE       ARG  49 320.842  14.511   2.058
 1036   HH11  ARG  49          HH11      ARG  49 320.282  12.532   4.879
 1037   HH12  ARG  49          HH12      ARG  49 318.616  12.261   4.503
 1038   HH21  ARG  49          HH21      ARG  49 318.654  14.168   1.577
 1039   HH22  ARG  49          HH22      ARG  49 317.696  13.183   2.627
 1040    H    GLN  50           H        GLN  50 325.288  17.667   2.970
 1041    HA   GLN  50           HA       GLN  50 326.881  18.572   5.252
 1042    HB2  GLN  50           HB2      GLN  50 327.929  17.811   2.581
 1043    HB3  GLN  50           HB3      GLN  50 328.780  17.813   4.093
 1044    HG2  GLN  50           HG2      GLN  50 327.287  15.924   4.817
 1045    HG3  GLN  50           HG3      GLN  50 326.711  15.864   3.149
 1046   HE21  GLN  50          HE21      GLN  50 327.975  15.002   1.590
 1047   HE22  GLN  50          HE22      GLN  50 329.507  14.270   1.869
 1048    H    GLY  51           H        GLY  51 325.568  19.739   2.313
 1049    HA2  GLY  51           HA2      GLY  51 325.547  21.994   1.615
 1050    HA3  GLY  51           HA3      GLY  51 326.921  22.307   2.676
 1051    H    LEU  52           H        LEU  52 326.172  20.142  -0.027
 1052    HA   LEU  52           HA       LEU  52 328.791  20.787  -1.212
 1053    HB2  LEU  52           HB2      LEU  52 327.248  18.249  -1.652
 1054    HB3  LEU  52           HB3      LEU  52 328.928  18.575  -2.014
 1055    HG   LEU  52           HG       LEU  52 328.175  18.852   0.816
 1056   HD11  LEU  52          HD11      LEU  52 327.583  16.760   1.283
 1057   HD12  LEU  52          HD12      LEU  52 328.671  16.074   0.072
 1058   HD13  LEU  52          HD13      LEU  52 327.092  16.697  -0.415
 1059   HD21  LEU  52          HD21      LEU  52 330.395  17.212  -0.260
 1060   HD22  LEU  52          HD22      LEU  52 330.336  18.257   1.163
 1061   HD23  LEU  52          HD23      LEU  52 330.445  18.973  -0.457
 1062    H    SER  53           H        SER  53 328.907  21.302  -3.347
 1063    HA   SER  53           HA       SER  53 326.760  22.463  -4.625
 1064    HB2  SER  53           HB2      SER  53 328.702  21.318  -6.503
 1065    HB3  SER  53           HB3      SER  53 328.243  22.998  -6.232
 1066    HG   SER  53           HG       SER  53 329.845  23.226  -4.871
 1067    H    MET  54           H        MET  54 327.459  19.094  -4.420
 1068    HA   MET  54           HA       MET  54 326.129  17.299  -4.985
 1069    HB2  MET  54           HB2      MET  54 324.102  18.659  -5.025
 1070    HB3  MET  54           HB3      MET  54 324.488  19.266  -6.600
 1071    HG2  MET  54           HG2      MET  54 324.551  16.627  -7.072
 1072    HG3  MET  54           HG3      MET  54 323.322  16.716  -5.820
 1073    HE1  MET  54           HE1      MET  54 324.514  19.064  -8.540
 1074    HE2  MET  54           HE2      MET  54 323.139  19.268  -9.625
 1075    HE3  MET  54           HE3      MET  54 324.100  17.791  -9.688
 1076    H    ARG  55           H        ARG  55 326.879  19.537  -7.549
 1077    HA   ARG  55           HA       ARG  55 327.367  17.406  -9.433
 1078    HB2  ARG  55           HB2      ARG  55 328.352  19.715 -10.570
 1079    HB3  ARG  55           HB3      ARG  55 326.706  19.120 -10.752
 1080    HG2  ARG  55           HG2      ARG  55 325.948  20.516  -8.928
 1081    HG3  ARG  55           HG3      ARG  55 327.607  21.042  -8.613
 1082    HD2  ARG  55           HD2      ARG  55 325.847  21.692 -10.960
 1083    HD3  ARG  55           HD3      ARG  55 326.638  22.794  -9.836
 1084    HE   ARG  55           HE       ARG  55 328.608  22.583 -11.030
 1085   HH11  ARG  55          HH11      ARG  55 326.223  20.339 -12.248
 1086   HH12  ARG  55          HH12      ARG  55 327.118  19.979 -13.685
 1087   HH21  ARG  55          HH21      ARG  55 329.782  22.106 -12.919
 1088   HH22  ARG  55          HH22      ARG  55 329.137  20.980 -14.066
 1089    H    GLN  56           H        GLN  56 329.108  19.574  -7.307
 1090    HA   GLN  56           HA       GLN  56 331.679  19.150  -8.367
 1091    HB2  GLN  56           HB2      GLN  56 330.423  20.478  -6.060
 1092    HB3  GLN  56           HB3      GLN  56 332.108  20.006  -5.838
 1093    HG2  GLN  56           HG2      GLN  56 332.536  21.188  -8.067
 1094    HG3  GLN  56           HG3      GLN  56 330.940  21.903  -7.841
 1095   HE21  GLN  56          HE21      GLN  56 330.950  23.812  -6.916
 1096   HE22  GLN  56          HE22      GLN  56 332.131  24.405  -5.803
 1097    H    ILE  57           H        ILE  57 329.817  17.430  -5.894
 1098    HA   ILE  57           HA       ILE  57 332.115  16.124  -4.825
 1099    HB   ILE  57           HB       ILE  57 330.444  14.411  -3.926
 1100   HG12  ILE  57          HG12      ILE  57 328.667  16.294  -5.313
 1101   HG13  ILE  57          HG13      ILE  57 328.419  14.606  -4.877
 1102   HG21  ILE  57          HG21      ILE  57 330.072  17.194  -2.911
 1103   HG22  ILE  57          HG22      ILE  57 331.566  16.283  -2.683
 1104   HG23  ILE  57          HG23      ILE  57 330.050  15.675  -2.006
 1105   HD11  ILE  57          HD11      ILE  57 326.867  15.996  -3.699
 1106   HD12  ILE  57          HD12      ILE  57 328.195  16.980  -3.065
 1107   HD13  ILE  57          HD13      ILE  57 328.020  15.291  -2.564
 1108    H    ARG  58           H        ARG  58 332.230  13.714  -4.776
 1109    HA   ARG  58           HA       ARG  58 331.741  12.636  -7.458
 1110    HB2  ARG  58           HB2      ARG  58 334.067  11.610  -5.973
 1111    HB3  ARG  58           HB3      ARG  58 333.898  11.998  -7.681
 1112    HG2  ARG  58           HG2      ARG  58 334.181  14.081  -5.530
 1113    HG3  ARG  58           HG3      ARG  58 335.540  13.390  -6.401
 1114    HD2  ARG  58           HD2      ARG  58 334.788  14.297  -8.448
 1115    HD3  ARG  58           HD3      ARG  58 333.230  14.734  -7.772
 1116    HE   ARG  58           HE       ARG  58 334.173  16.683  -7.075
 1117   HH11  ARG  58          HH11      ARG  58 336.732  14.365  -7.580
 1118   HH12  ARG  58          HH12      ARG  58 337.995  15.503  -7.252
 1119   HH21  ARG  58          HH21      ARG  58 335.832  18.181  -6.651
 1120   HH22  ARG  58          HH22      ARG  58 337.485  17.669  -6.727
 1121    H    PHE  59           H        PHE  59 330.353  10.918  -7.272
 1122    HA   PHE  59           HA       PHE  59 330.290   9.521  -4.699
 1123    HB2  PHE  59           HB2      PHE  59 328.251   9.864  -6.875
 1124    HB3  PHE  59           HB3      PHE  59 328.111   8.587  -5.696
 1125    HD1  PHE  59           HD1      PHE  59 329.353  11.998  -4.947
 1126    HD2  PHE  59           HD2      PHE  59 326.109   9.254  -4.710
 1127    HE1  PHE  59           HE1      PHE  59 328.171  13.510  -3.413
 1128    HE2  PHE  59           HE2      PHE  59 324.930  10.768  -3.182
 1129    HZ   PHE  59           HZ       PHE  59 325.961  12.909  -2.539
 1130    H    ARG  60           H        ARG  60 329.804   7.223  -4.792
 1131    HA   ARG  60           HA       ARG  60 330.485   5.813  -7.206
 1132    HB2  ARG  60           HB2      ARG  60 332.587   6.335  -5.470
 1133    HB3  ARG  60           HB3      ARG  60 332.119   4.688  -5.089
 1134    HG2  ARG  60           HG2      ARG  60 332.120   4.792  -7.863
 1135    HG3  ARG  60           HG3      ARG  60 333.532   5.724  -7.376
 1136    HD2  ARG  60           HD2      ARG  60 334.451   3.904  -6.190
 1137    HD3  ARG  60           HD3      ARG  60 332.931   3.016  -6.238
 1138    HE   ARG  60           HE       ARG  60 333.549   3.253  -8.846
 1139   HH11  ARG  60          HH11      ARG  60 335.390   2.168  -6.085
 1140   HH12  ARG  60          HH12      ARG  60 336.367   1.077  -7.009
 1141   HH21  ARG  60          HH21      ARG  60 334.834   1.818 -10.061
 1142   HH22  ARG  60          HH22      ARG  60 336.052   0.878  -9.265
 1143    H    PHE  61           H        PHE  61 330.130   3.585  -7.080
 1144    HA   PHE  61           HA       PHE  61 328.595   2.622  -4.802
 1145    HB2  PHE  61           HB2      PHE  61 326.927   3.308  -6.464
 1146    HB3  PHE  61           HB3      PHE  61 327.702   2.286  -7.667
 1147    HD1  PHE  61           HD2      PHE  61 325.978   2.247  -4.405
 1148    HD2  PHE  61           HD1      PHE  61 327.221  -0.024  -7.788
 1149    HE1  PHE  61           HE2      PHE  61 324.638   0.336  -3.620
 1150    HE2  PHE  61           HE1      PHE  61 325.886  -1.934  -7.004
 1151    HZ   PHE  61           HZ       PHE  61 324.593  -1.756  -4.917
 1152    H    ASP  62           H        ASP  62 328.538   0.210  -4.802
 1153    HA   ASP  62           HA       ASP  62 330.959  -0.953  -4.863
 1154    HB2  ASP  62           HB2      ASP  62 328.298  -1.886  -4.803
 1155    HB3  ASP  62           HB3      ASP  62 329.203  -2.905  -5.903
 1156    H    GLY  63           H        GLY  63 332.292  -0.343  -6.425
 1157    HA2  GLY  63           HA2      GLY  63 333.503  -0.536  -8.345
 1158    HA3  GLY  63           HA3      GLY  63 332.479  -1.896  -8.778
 1159    H    GLN  64           H        GLN  64 331.161   1.309  -8.239
 1160    HA   GLN  64           HA       GLN  64 331.104   1.863 -11.095
 1161    HB2  GLN  64           HB2      GLN  64 329.125   0.423 -10.535
 1162    HB3  GLN  64           HB3      GLN  64 328.544   1.758  -9.558
 1163    HG2  GLN  64           HG2      GLN  64 327.936   2.984 -11.341
 1164    HG3  GLN  64           HG3      GLN  64 329.275   2.428 -12.313
 1165   HE21  GLN  64          HE21      GLN  64 326.905   0.443 -10.652
 1166   HE22  GLN  64          HE22      GLN  64 326.215  -0.248 -12.076
 1167    HA   PRO  65           HA       PRO  65 331.434   6.070  -9.631
 1168    HB2  PRO  65           HB2      PRO  65 330.576   6.805 -12.348
 1169    HB3  PRO  65           HB3      PRO  65 332.119   7.102 -11.558
 1170    HG2  PRO  65           HG2      PRO  65 331.942   5.367 -13.550
 1171    HG3  PRO  65           HG3      PRO  65 332.931   4.980 -12.123
 1172    HD2  PRO  65           HD2      PRO  65 330.090   4.164 -12.699
 1173    HD3  PRO  65           HD3      PRO  65 331.468   3.141 -12.283
 1174    H    ILE  66           H        ILE  66 328.710   4.790 -11.232
 1175    HA   ILE  66           HA       ILE  66 326.511   5.193 -11.345
 1176    HB   ILE  66           HB       ILE  66 325.484   5.717  -9.333
 1177   HG12  ILE  66          HG12      ILE  66 328.132   6.274  -8.090
 1178   HG13  ILE  66          HG13      ILE  66 327.148   7.532  -8.776
 1179   HG21  ILE  66          HG21      ILE  66 327.197   3.610  -9.761
 1180   HG22  ILE  66          HG22      ILE  66 325.972   3.690  -8.487
 1181   HG23  ILE  66          HG23      ILE  66 327.634   4.175  -8.149
 1182   HD11  ILE  66          HD11      ILE  66 326.359   5.678  -6.551
 1183   HD12  ILE  66          HD12      ILE  66 325.357   6.974  -7.218
 1184   HD13  ILE  66          HD13      ILE  66 326.852   7.364  -6.371
 1185    H    ASN  67           H        ASN  67 328.230   7.309 -12.091
 1186    HA   ASN  67           HA       ASN  67 328.015   9.844 -11.707
 1187    HB2  ASN  67           HB2      ASN  67 326.946   9.242 -14.396
 1188    HB3  ASN  67           HB3      ASN  67 328.239  10.334 -13.931
 1189   HD21  ASN  67          HD21      ASN  67 327.440   7.275 -15.142
 1190   HD22  ASN  67          HD22      ASN  67 329.034   6.608 -15.187
 1191    H    GLU  68           H        GLU  68 326.187   9.884 -10.234
 1192    HA   GLU  68           HA       GLU  68 323.993  10.236  -9.627
 1193    HB2  GLU  68           HB2      GLU  68 323.597  12.459 -11.413
 1194    HB3  GLU  68           HB3      GLU  68 323.833  12.436  -9.672
 1195    HG2  GLU  68           HG2      GLU  68 326.121  12.650  -9.838
 1196    HG3  GLU  68           HG3      GLU  68 326.141  12.117 -11.514
 1197    H    THR  69           H        THR  69 323.990  11.106 -12.979
 1198    HA   THR  69           HA       THR  69 321.393  10.647 -13.714
 1199    HB   THR  69           HB       THR  69 322.044  10.206 -15.952
 1200    HG1  THR  69           HG1      THR  69 323.591   8.784 -16.134
 1201   HG21  THR  69          HG21      THR  69 323.312  12.058 -16.443
 1202   HG22  THR  69          HG22      THR  69 324.346  11.855 -15.026
 1203   HG23  THR  69          HG23      THR  69 322.692  12.439 -14.836
 1204    H    ASP  70           H        ASP  70 323.831   8.230 -13.019
 1205    HA   ASP  70           HA       ASP  70 322.505   5.905 -13.875
 1206    HB2  ASP  70           HB2      ASP  70 324.397   6.280 -11.545
 1207    HB3  ASP  70           HB3      ASP  70 324.077   4.786 -12.367
 1208    H    THR  71           H        THR  71 320.751   4.874 -12.991
 1209    HA   THR  71           HA       THR  71 319.682   5.958 -10.488
 1210    HB   THR  71           HB       THR  71 317.615   5.058 -11.063
 1211    HG1  THR  71           HG1      THR  71 318.199   3.400 -13.121
 1212   HG21  THR  71          HG21      THR  71 317.936   6.707 -12.716
 1213   HG22  THR  71          HG22      THR  71 317.263   5.304 -13.543
 1214   HG23  THR  71          HG23      THR  71 318.988   5.658 -13.664
 1215    HA   PRO  72           HA       PRO  72 321.378   2.724  -8.106
 1216    HB2  PRO  72           HB2      PRO  72 318.847   2.180  -6.745
 1217    HB3  PRO  72           HB3      PRO  72 320.380   2.787  -6.099
 1218    HG2  PRO  72           HG2      PRO  72 318.059   4.293  -6.539
 1219    HG3  PRO  72           HG3      PRO  72 319.674   4.921  -6.204
 1220    HD2  PRO  72           HD2      PRO  72 318.155   4.999  -8.657
 1221    HD3  PRO  72           HD3      PRO  72 319.676   5.802  -8.264
 1222    H    ALA  73           H        ALA  73 318.025   2.022  -9.112
 1223    HA   ALA  73           HA       ALA  73 318.153  -0.736  -9.254
 1224    HB1  ALA  73           HB1      ALA  73 316.511   1.336 -10.524
 1225    HB2  ALA  73           HB2      ALA  73 316.034  -0.192  -9.787
 1226    HB3  ALA  73           HB3      ALA  73 316.623  -0.160 -11.448
 1227    H    GLN  74           H        GLN  74 318.697   1.490 -11.992
 1228    HA   GLN  74           HA       GLN  74 319.453  -0.210 -13.914
 1229    HB2  GLN  74           HB2      GLN  74 319.938   2.525 -13.257
 1230    HB3  GLN  74           HB3      GLN  74 321.221   1.858 -14.224
 1231    HG2  GLN  74           HG2      GLN  74 319.770   1.358 -15.994
 1232    HG3  GLN  74           HG3      GLN  74 318.342   1.565 -14.978
 1233   HE21  GLN  74          HE21      GLN  74 317.275   3.181 -15.919
 1234   HE22  GLN  74          HE22      GLN  74 317.928   4.744 -16.260
 1235    H    LEU  75           H        LEU  75 321.444   0.949 -11.246
 1236    HA   LEU  75           HA       LEU  75 323.752  -0.513 -12.168
 1237    HB2  LEU  75           HB2      LEU  75 323.413   0.952  -9.558
 1238    HB3  LEU  75           HB3      LEU  75 324.904   0.598 -10.407
 1239    HG   LEU  75           HG       LEU  75 322.889   2.762 -10.958
 1240   HD11  LEU  75          HD11      LEU  75 325.689   2.500 -10.196
 1241   HD12  LEU  75          HD12      LEU  75 324.539   3.803  -9.892
 1242   HD13  LEU  75          HD13      LEU  75 325.380   3.708 -11.440
 1243   HD21  LEU  75          HD21      LEU  75 323.008   1.830 -13.122
 1244   HD22  LEU  75          HD22      LEU  75 324.739   1.520 -12.977
 1245   HD23  LEU  75          HD23      LEU  75 324.147   3.182 -13.106
 1246    H    GLU  76           H        GLU  76 321.158  -0.765  -9.895
 1247    HA   GLU  76           HA       GLU  76 320.268  -2.649  -9.028
 1248    HB2  GLU  76           HB2      GLU  76 322.968  -3.949  -9.339
 1249    HB3  GLU  76           HB3      GLU  76 321.501  -4.744  -8.796
 1250    HG2  GLU  76           HG2      GLU  76 320.446  -4.397 -10.913
 1251    HG3  GLU  76           HG3      GLU  76 321.806  -3.429 -11.478
 1252    H    MET  77           H        MET  77 321.181  -0.496  -7.565
 1253    HA   MET  77           HA       MET  77 322.742  -1.152  -5.304
 1254    HB2  MET  77           HB2      MET  77 320.592   0.920  -5.730
 1255    HB3  MET  77           HB3      MET  77 321.613   0.871  -4.288
 1256    HG2  MET  77           HG2      MET  77 323.468   0.718  -6.256
 1257    HG3  MET  77           HG3      MET  77 322.237   1.691  -7.040
 1258    HE1  MET  77           HE1      MET  77 323.769   4.809  -6.410
 1259    HE2  MET  77           HE2      MET  77 323.335   3.488  -7.495
 1260    HE3  MET  77           HE3      MET  77 324.936   3.520  -6.731
 1261    H    GLU  78           H        GLU  78 321.613  -0.899  -2.989
 1262    HA   GLU  78           HA       GLU  78 319.156  -2.449  -2.853
 1263    HB2  GLU  78           HB2      GLU  78 321.836  -3.377  -1.879
 1264    HB3  GLU  78           HB3      GLU  78 320.371  -3.887  -1.056
 1265    HG2  GLU  78           HG2      GLU  78 319.907  -5.387  -2.620
 1266    HG3  GLU  78           HG3      GLU  78 320.164  -4.230  -3.919
 1267    H    ASP  79           H        ASP  79 318.743  -2.857  -0.340
 1268    HA   ASP  79           HA       ASP  79 318.486  -0.263   0.807
 1269    HB2  ASP  79           HB2      ASP  79 317.335  -2.822   1.209
 1270    HB3  ASP  79           HB3      ASP  79 317.993  -2.291   2.753
 1271    H    GLU  80           H        GLU  80 319.738   0.781   2.161
 1272    HA   GLU  80           HA       GLU  80 321.345   1.280   3.695
 1273    HB2  GLU  80           HB2      GLU  80 322.065  -1.600   4.083
 1274    HB3  GLU  80           HB3      GLU  80 322.154  -0.271   5.222
 1275    HG2  GLU  80           HG2      GLU  80 319.791  -0.265   5.527
 1276    HG3  GLU  80           HG3      GLU  80 319.565  -1.429   4.227
 1277    H    ASP  81           H        ASP  81 321.799  -0.092   0.750
 1278    HA   ASP  81           HA       ASP  81 324.503  -0.719   0.656
 1279    HB2  ASP  81           HB2      ASP  81 322.531   0.328  -1.322
 1280    HB3  ASP  81           HB3      ASP  81 324.224   0.432  -1.754
 1281    H    THR  82           H        THR  82 326.133   0.786  -0.377
 1282    HA   THR  82           HA       THR  82 325.751   3.479   0.722
 1283    HB   THR  82           HB       THR  82 328.481   2.250   0.679
 1284    HG1  THR  82           HG1      THR  82 327.908   0.927   2.183
 1285   HG21  THR  82          HG21      THR  82 328.912   3.777   2.490
 1286   HG22  THR  82          HG22      THR  82 327.214   4.271   2.516
 1287   HG23  THR  82          HG23      THR  82 328.235   4.668   1.121
 1288    H    ILE  83           H        ILE  83 327.074   5.189  -0.254
 1289    HA   ILE  83           HA       ILE  83 328.135   4.588  -2.891
 1290    HB   ILE  83           HB       ILE  83 326.000   6.606  -2.185
 1291   HG12  ILE  83          HG12      ILE  83 326.026   4.735  -4.534
 1292   HG13  ILE  83          HG13      ILE  83 325.514   4.189  -2.937
 1293   HG21  ILE  83          HG21      ILE  83 327.602   7.853  -3.468
 1294   HG22  ILE  83          HG22      ILE  83 326.260   7.453  -4.537
 1295   HG23  ILE  83          HG23      ILE  83 327.765   6.549  -4.641
 1296   HD11  ILE  83          HD11      ILE  83 324.148   5.894  -4.868
 1297   HD12  ILE  83          HD12      ILE  83 324.074   6.452  -3.195
 1298   HD13  ILE  83          HD13      ILE  83 323.513   4.835  -3.611
 1299    H    ASP  84           H        ASP  84 330.245   5.123  -2.287
 1300    HA   ASP  84           HA       ASP  84 330.813   7.055  -0.362
 1301    HB2  ASP  84           HB2      ASP  84 332.844   6.157  -0.416
 1302    HB3  ASP  84           HB3      ASP  84 332.176   5.029  -1.584
 1303    H    VAL  85           H        VAL  85 331.188   9.107  -0.354
 1304    HA   VAL  85           HA       VAL  85 331.309  10.672  -2.853
 1305    HB   VAL  85           HB       VAL  85 330.538  11.488  -0.042
 1306   HG11  VAL  85          HG11      VAL  85 330.951  13.158  -2.505
 1307   HG12  VAL  85          HG12      VAL  85 331.638  13.383  -0.896
 1308   HG13  VAL  85          HG13      VAL  85 329.921  13.691  -1.172
 1309   HG21  VAL  85          HG21      VAL  85 328.573  12.140  -1.935
 1310   HG22  VAL  85          HG22      VAL  85 328.485  10.982  -0.607
 1311   HG23  VAL  85          HG23      VAL  85 329.026  10.455  -2.202
 1312    H    PHE  86           H        PHE  86 333.290  11.541  -3.320
 1313    HA   PHE  86           HA       PHE  86 335.067  12.198  -1.073
 1314    HB2  PHE  86           HB2      PHE  86 335.855  10.679  -3.575
 1315    HB3  PHE  86           HB3      PHE  86 337.003  11.413  -2.466
 1316    HD1  PHE  86           HD2      PHE  86 335.307  10.634   0.052
 1317    HD2  PHE  86           HD1      PHE  86 336.762   8.480  -3.317
 1318    HE1  PHE  86           HE2      PHE  86 335.308   8.565   1.379
 1319    HE2  PHE  86           HE1      PHE  86 336.771   6.407  -1.993
 1320    HZ   PHE  86           HZ       PHE  86 336.043   6.448   0.359
 1321    H    GLN  87           H        GLN  87 335.032  14.341  -1.261
 1322    HA   GLN  87           HA       GLN  87 335.970  15.478  -3.768
 1323    HB2  GLN  87           HB2      GLN  87 333.371  15.328  -3.556
 1324    HB3  GLN  87           HB3      GLN  87 333.551  16.748  -2.547
 1325    HG2  GLN  87           HG2      GLN  87 335.075  17.059  -4.963
 1326    HG3  GLN  87           HG3      GLN  87 333.430  16.595  -5.333
 1327   HE21  GLN  87          HE21      GLN  87 331.719  17.838  -3.908
 1328   HE22  GLN  87          HE22      GLN  87 331.987  19.545  -3.824
 1329    H    GLN  88           H        GLN  88 337.720  16.568  -3.159
 1330    HA   GLN  88           HA       GLN  88 337.931  17.804  -0.568
 1331    HB2  GLN  88           HB2      GLN  88 339.751  17.836  -2.973
 1332    HB3  GLN  88           HB3      GLN  88 340.140  18.609  -1.444
 1333    HG2  GLN  88           HG2      GLN  88 339.430  15.713  -1.507
 1334    HG3  GLN  88           HG3      GLN  88 341.047  16.237  -1.977
 1335   HE21  GLN  88          HE21      GLN  88 339.058  15.375   0.570
 1336   HE22  GLN  88          HE22      GLN  88 340.056  15.909   1.875
 1337    H    GLN  89           H        GLN  89 338.903  20.197  -0.639
 1338    HA   GLN  89           HA       GLN  89 336.886  21.745  -2.061
 1339    HB2  GLN  89           HB2      GLN  89 338.547  22.219   0.361
 1340    HB3  GLN  89           HB3      GLN  89 338.040  23.625  -0.566
 1341    HG2  GLN  89           HG2      GLN  89 335.679  22.541  -0.394
 1342    HG3  GLN  89           HG3      GLN  89 336.392  21.671   0.965
 1343   HE21  GLN  89          HE21      GLN  89 334.457  24.096   0.394
 1344   HE22  GLN  89          HE22      GLN  89 334.903  25.206   1.640
 1345    H    THR  90           H        THR  90 339.165  20.606  -3.362
 1346    HA   THR  90           HA       THR  90 340.303  23.066  -4.510
 1347    HB   THR  90           HB       THR  90 342.062  22.045  -3.233
 1348    HG1  THR  90           HG1      THR  90 342.949  22.743  -5.072
 1349   HG21  THR  90          HG21      THR  90 340.889  19.575  -4.084
 1350   HG22  THR  90          HG22      THR  90 342.082  19.877  -2.822
 1351   HG23  THR  90          HG23      THR  90 342.606  19.615  -4.485
 1352    H1   THR   2           HT1      THR   2 324.393   9.045  10.969
 1353    H2   THR   2           HT2      THR   2 322.995   8.618  11.868
 1354    H3   THR   2           HT3      THR   2 323.800  10.101  12.182
 1355    HA   THR   2           HA       THR   2 323.319  10.688   9.819
 1356    HB   THR   2           HB       THR   2 321.492   9.489   8.777
 1357    HG1  THR   2           HG1      THR   2 320.188   8.675  10.235
 1358   HG21  THR   2          HG21      THR   2 322.987   7.111   9.609
 1359   HG22  THR   2          HG22      THR   2 323.968   8.433   8.977
 1360   HG23  THR   2          HG23      THR   2 322.668   7.754   7.999
 1361    H    VAL   3           H        VAL   3 320.829   9.368  12.008
 1362    HA   VAL   3           HA       VAL   3 318.943  10.336  12.878
 1363    HB   VAL   3           HB       VAL   3 319.483  12.426  14.246
 1364   HG11  VAL   3          HG11      VAL   3 319.766   9.801  14.773
 1365   HG12  VAL   3          HG12      VAL   3 320.071  11.076  15.952
 1366   HG13  VAL   3          HG13      VAL   3 321.414  10.357  15.063
 1367   HG21  VAL   3          HG21      VAL   3 321.390  13.192  12.913
 1368   HG22  VAL   3          HG22      VAL   3 322.285  11.739  13.360
 1369   HG23  VAL   3          HG23      VAL   3 321.844  12.918  14.595
 1370    H    GLY   4           H        GLY   4 317.630  10.860  11.154
 1371    HA2  GLY   4           HA2      GLY   4 316.520  13.228  10.792
 1372    HA3  GLY   4           HA3      GLY   4 317.990  13.456   9.858
 1373    H    ASP   5           H        ASP   5 315.107  13.371   9.081
 1374    HA   ASP   5           HA       ASP   5 314.490  11.027   7.686
 1375    HB2  ASP   5           HB2      ASP   5 313.166  13.331   8.159
 1376    HB3  ASP   5           HB3      ASP   5 313.619  13.589   6.476
 1377    H    GLU   6           H        GLU   6 314.080  11.398   5.101
 1378    HA   GLU   6           HA       GLU   6 316.556  12.380   3.899
 1379    HB2  GLU   6           HB2      GLU   6 315.480   9.626   3.296
 1380    HB3  GLU   6           HB3      GLU   6 316.962  10.347   2.682
 1381    HG2  GLU   6           HG2      GLU   6 317.962   9.226   4.325
 1382    HG3  GLU   6           HG3      GLU   6 317.345  10.500   5.375
 1383    H    ILE   7           H        ILE   7 315.876  13.822   2.468
 1384    HA   ILE   7           HA       ILE   7 313.326  13.506   1.116
 1385    HB   ILE   7           HB       ILE   7 313.972  15.714   1.982
 1386   HG12  ILE   7          HG12      ILE   7 313.981  15.914  -1.019
 1387   HG13  ILE   7          HG13      ILE   7 312.566  15.313  -0.160
 1388   HG21  ILE   7          HG21      ILE   7 316.437  15.106   0.625
 1389   HG22  ILE   7          HG22      ILE   7 316.086  16.371   1.803
 1390   HG23  ILE   7          HG23      ILE   7 315.797  16.659   0.087
 1391   HD11  ILE   7          HD11      ILE   7 312.051  17.526  -0.350
 1392   HD12  ILE   7          HD12      ILE   7 313.733  18.043  -0.221
 1393   HD13  ILE   7          HD13      ILE   7 312.858  17.520   1.218
 1394    H    VAL   8           H        VAL   8 313.045  13.288  -1.099
 1395    HA   VAL   8           HA       VAL   8 315.062  13.425  -3.026
 1396    HB   VAL   8           HB       VAL   8 315.991  11.475  -1.843
 1397   HG11  VAL   8          HG11      VAL   8 313.289  10.333  -2.407
 1398   HG12  VAL   8          HG12      VAL   8 314.241  10.284  -0.926
 1399   HG13  VAL   8          HG13      VAL   8 314.694   9.274  -2.299
 1400   HG21  VAL   8          HG21      VAL   8 315.017  11.184  -4.660
 1401   HG22  VAL   8          HG22      VAL   8 316.011   9.938  -3.905
 1402   HG23  VAL   8          HG23      VAL   8 316.633  11.580  -4.075
 1403    H    ASP   9           H        ASP   9 312.013  11.992  -2.029
 1404    HA   ASP   9           HA       ASP   9 310.116  11.421  -3.159
 1405    HB2  ASP   9           HB2      ASP   9 309.243  13.161  -4.614
 1406    HB3  ASP   9           HB3      ASP   9 310.036  13.884  -3.219
 1407    H    LEU  10           H        LEU  10 310.130   9.573  -4.257
 1408    HA   LEU  10           HA       LEU  10 311.455   9.500  -6.887
 1409    HB2  LEU  10           HB2      LEU  10 310.782   7.296  -4.943
 1410    HB3  LEU  10           HB3      LEU  10 311.362   7.003  -6.567
 1411    HG   LEU  10           HG       LEU  10 312.925   7.166  -4.331
 1412   HD11  LEU  10          HD11      LEU  10 314.529   7.917  -6.538
 1413   HD12  LEU  10          HD12      LEU  10 313.241   6.870  -7.134
 1414   HD13  LEU  10          HD13      LEU  10 314.304   6.312  -5.849
 1415   HD21  LEU  10          HD21      LEU  10 313.083   9.825  -5.738
 1416   HD22  LEU  10          HD22      LEU  10 314.303   9.204  -4.628
 1417   HD23  LEU  10          HD23      LEU  10 312.672   9.534  -4.048
 1418    H    THR  11           H        THR  11 310.364   7.500  -8.183
 1419    HA   THR  11           HA       THR  11 307.917   8.451  -9.140
 1420    HB   THR  11           HB       THR  11 307.791   6.387 -10.428
 1421    HG1  THR  11           HG1      THR  11 308.610   4.607  -9.711
 1422   HG21  THR  11          HG21      THR  11 310.266   6.220 -11.202
 1423   HG22  THR  11          HG22      THR  11 310.484   7.633 -10.166
 1424   HG23  THR  11          HG23      THR  11 309.339   7.690 -11.506
 1425    H    CYS  12           H        CYS  12 306.196   6.291  -9.365
 1426    HA   CYS  12           HA       CYS  12 304.634   6.487  -7.084
 1427    HB2  CYS  12           HB2      CYS  12 303.413   4.505  -7.954
 1428    HB3  CYS  12           HB3      CYS  12 303.695   5.733  -9.183
 1429    HG   CYS  12           HG       CYS  12 304.702   2.887  -9.266
 1430    H    GLU  13           H        GLU  13 303.867   4.194  -6.031
 1431    HA   GLU  13           HA       GLU  13 306.303   2.922  -4.976
 1432    HB2  GLU  13           HB2      GLU  13 305.195   2.829  -2.753
 1433    HB3  GLU  13           HB3      GLU  13 305.539   4.466  -3.295
 1434    HG2  GLU  13           HG2      GLU  13 303.012   4.108  -4.228
 1435    HG3  GLU  13           HG3      GLU  13 302.982   3.158  -2.744
 1436    H    SER  14           H        SER  14 302.812   2.608  -5.522
 1437    HA   SER  14           HA       SER  14 303.199  -0.244  -5.973
 1438    HB2  SER  14           HB2      SER  14 302.610  -0.461  -3.729
 1439    HB3  SER  14           HB3      SER  14 301.506   0.912  -3.782
 1440    HG   SER  14           HG       SER  14 300.234  -0.879  -3.779
 1441    H    LEU  15           H        LEU  15 301.251  -1.285  -6.880
 1442    HA   LEU  15           HA       LEU  15 299.438   0.580  -8.241
 1443    HB2  LEU  15           HB2      LEU  15 300.589  -1.793  -9.677
 1444    HB3  LEU  15           HB3      LEU  15 299.756  -0.405 -10.351
 1445    HG   LEU  15           HG       LEU  15 301.786   0.959  -9.526
 1446   HD11  LEU  15          HD11      LEU  15 302.646  -1.818  -9.020
 1447   HD12  LEU  15          HD12      LEU  15 303.129  -0.315  -8.233
 1448   HD13  LEU  15          HD13      LEU  15 303.825  -0.757  -9.792
 1449   HD21  LEU  15          HD21      LEU  15 301.609  -0.872 -11.862
 1450   HD22  LEU  15          HD22      LEU  15 303.124  -0.014 -11.579
 1451   HD23  LEU  15          HD23      LEU  15 301.627   0.891 -11.804
 1452    H    GLU  16           H        GLU  16 297.350  -0.098  -8.325
 1453    HA   GLU  16           HA       GLU  16 296.802  -2.790  -7.264
 1454    HB2  GLU  16           HB2      GLU  16 294.561  -1.777  -6.619
 1455    HB3  GLU  16           HB3      GLU  16 295.963  -1.228  -5.713
 1456    HG2  GLU  16           HG2      GLU  16 295.080   0.318  -8.098
 1457    HG3  GLU  16           HG3      GLU  16 294.183   0.468  -6.588
 1458    HA   PRO  17           HA       PRO  17 295.351  -3.344 -11.554
 1459    HB2  PRO  17           HB2      PRO  17 294.894  -6.069 -10.470
 1460    HB3  PRO  17           HB3      PRO  17 295.750  -5.568 -11.932
 1461    HG2  PRO  17           HG2      PRO  17 297.080  -6.433  -9.783
 1462    HG3  PRO  17           HG3      PRO  17 297.711  -5.116 -10.790
 1463    HD2  PRO  17           HD2      PRO  17 296.364  -4.988  -8.124
 1464    HD3  PRO  17           HD3      PRO  17 297.719  -4.029  -8.751
 1465    H    VAL  18           H        VAL  18 293.744  -5.336  -9.063
 1466    HA   VAL  18           HA       VAL  18 291.166  -4.271 -10.005
 1467    HB   VAL  18           HB       VAL  18 290.114  -6.289  -9.177
 1468   HG11  VAL  18          HG11      VAL  18 291.181  -7.962 -10.667
 1469   HG12  VAL  18          HG12      VAL  18 292.527  -6.842 -10.887
 1470   HG13  VAL  18          HG13      VAL  18 290.911  -6.396 -11.434
 1471   HG21  VAL  18          HG21      VAL  18 292.614  -6.604  -7.757
 1472   HG22  VAL  18          HG22      VAL  18 292.156  -8.080  -8.608
 1473   HG23  VAL  18          HG23      VAL  18 291.049  -7.345  -7.457
 1474    H    VAL  19           H        VAL  19 289.536  -3.759  -8.420
 1475    HA   VAL  19           HA       VAL  19 290.713  -2.710  -5.963
 1476    HB   VAL  19           HB       VAL  19 288.592  -1.469  -5.716
 1477   HG11  VAL  19          HG11      VAL  19 288.897  -0.320  -8.133
 1478   HG12  VAL  19          HG12      VAL  19 290.396  -1.244  -8.035
 1479   HG13  VAL  19          HG13      VAL  19 290.001  -0.067  -6.782
 1480   HG21  VAL  19          HG21      VAL  19 286.879  -1.539  -7.358
 1481   HG22  VAL  19          HG22      VAL  19 287.217  -3.212  -6.911
 1482   HG23  VAL  19          HG23      VAL  19 287.848  -2.558  -8.423
 1483    H    VAL  20           H        VAL  20 288.914  -2.576  -4.109
 1484    HA   VAL  20           HA       VAL  20 287.136  -4.673  -3.652
 1485    HB   VAL  20           HB       VAL  20 289.084  -6.147  -3.756
 1486   HG11  VAL  20          HG11      VAL  20 290.508  -4.126  -2.693
 1487   HG12  VAL  20          HG12      VAL  20 291.043  -5.806  -2.698
 1488   HG13  VAL  20          HG13      VAL  20 290.274  -5.130  -1.262
 1489   HG21  VAL  20          HG21      VAL  20 288.700  -6.341  -0.883
 1490   HG22  VAL  20          HG22      VAL  20 288.217  -7.449  -2.166
 1491   HG23  VAL  20          HG23      VAL  20 287.185  -6.091  -1.745
 1492    H    ASP  21           H        ASP  21 286.258  -4.666  -1.506
 1493    HA   ASP  21           HA       ASP  21 286.770  -2.171  -0.084
 1494    HB2  ASP  21           HB2      ASP  21 284.444  -3.567  -0.703
 1495    HB3  ASP  21           HB3      ASP  21 284.666  -3.860   1.019
 1496    H    LEU  22           H        LEU  22 285.857  -2.952   2.478
 1497    HA   LEU  22           HA       LEU  22 288.065  -4.702   3.352
 1498    HB2  LEU  22           HB2      LEU  22 286.801  -2.562   5.045
 1499    HB3  LEU  22           HB3      LEU  22 288.310  -3.410   5.322
 1500    HG   LEU  22           HG       LEU  22 288.891  -1.220   4.649
 1501   HD11  LEU  22          HD11      LEU  22 289.192  -3.230   2.444
 1502   HD12  LEU  22          HD12      LEU  22 290.383  -2.695   3.628
 1503   HD13  LEU  22          HD13      LEU  22 289.886  -1.614   2.327
 1504   HD21  LEU  22          HD21      LEU  22 287.544  -1.255   2.033
 1505   HD22  LEU  22          HD22      LEU  22 287.783   0.068   3.175
 1506   HD23  LEU  22          HD23      LEU  22 286.484  -1.097   3.434
 1507    H    THR  23           H        THR  23 287.439  -5.144   5.942
 1508    HA   THR  23           HA       THR  23 284.686  -6.104   6.075
 1509    HB   THR  23           HB       THR  23 285.422  -8.357   6.807
 1510    HG1  THR  23           HG1      THR  23 287.477  -8.893   6.860
 1511   HG21  THR  23          HG21      THR  23 284.820  -7.968   4.432
 1512   HG22  THR  23          HG22      THR  23 285.966  -9.288   4.682
 1513   HG23  THR  23          HG23      THR  23 286.533  -7.726   4.087
 1514    H    HIS  24           H        HIS  24 284.405  -7.285   8.314
 1515    HA   HIS  24           HA       HIS  24 285.419  -5.410  10.308
 1516    HB2  HIS  24           HB2      HIS  24 283.205  -7.463  10.504
 1517    HB3  HIS  24           HB3      HIS  24 283.621  -6.285  11.745
 1518    HD1  HIS  24           HD1      HIS  24 281.557  -6.743   8.776
 1519    HD2  HIS  24           HD2      HIS  24 283.129  -3.533  10.896
 1520    HE1  HIS  24           HE1      HIS  24 280.243  -4.734   8.026
 1521    HE2  HIS  24           HE2      HIS  24 281.268  -2.791   9.260
 1522    H    ASN  25           H        ASN  25 284.418  -8.188  11.884
 1523    HA   ASN  25           HA       ASN  25 285.483  -9.815  13.052
 1524    HB2  ASN  25           HB2      ASN  25 286.924  -9.712  10.490
 1525    HB3  ASN  25           HB3      ASN  25 287.857 -10.399  11.816
 1526   HD21  ASN  25          HD21      ASN  25 284.703 -10.604  10.232
 1527   HD22  ASN  25          HD22      ASN  25 284.494 -12.301  10.480
 1528    H    ASP  26           H        ASP  26 287.569 -10.311  14.258
 1529    HA   ASP  26           HA       ASP  26 289.166  -9.672  15.744
 1530    HB2  ASP  26           HB2      ASP  26 290.055  -8.687  13.427
 1531    HB3  ASP  26           HB3      ASP  26 289.787  -7.162  14.265
  Start of MODEL    2
    1    H1   GLY   1           HT1      GLY   1 291.174 -20.501  -7.913
    2    H2   GLY   1           HT2      GLY   1 291.292 -19.649  -6.457
    3    H3   GLY   1           HT3      GLY   1 291.042 -18.814  -7.906
    4    HA2  GLY   1           HA3      GLY   1 289.109 -20.809  -6.892
    5    HA3  GLY   1           HA2      GLY   1 289.036 -19.121  -6.412
    6    H    THR   2           H        THR   2 288.502 -17.536  -7.962
    7    HA   THR   2           HA       THR   2 287.257 -18.641 -10.391
    8    HB   THR   2           HB       THR   2 285.405 -17.824  -9.338
    9    HG1  THR   2           HG1      THR   2 284.946 -15.729 -10.104
   10   HG21  THR   2          HG21      THR   2 286.021 -17.085  -7.270
   11   HG22  THR   2          HG22      THR   2 285.544 -15.567  -8.030
   12   HG23  THR   2          HG23      THR   2 287.251 -15.991  -7.902
   13    H    GLU   3           H        GLU   3 287.779 -15.229  -9.611
   14    HA   GLU   3           HA       GLU   3 289.983 -15.040 -11.479
   15    HB2  GLU   3           HB2      GLU   3 287.632 -14.880 -12.654
   16    HB3  GLU   3           HB3      GLU   3 287.659 -13.239 -12.025
   17    HG2  GLU   3           HG2      GLU   3 289.942 -13.036 -13.144
   18    HG3  GLU   3           HG3      GLU   3 289.518 -14.520 -13.996
   19    H    ASN   4           H        ASN   4 289.083 -12.023 -11.652
   20    HA   ASN   4           HA       ASN   4 290.615 -11.298  -9.323
   21    HB2  ASN   4           HB2      ASN   4 291.099  -9.340 -10.374
   22    HB3  ASN   4           HB3      ASN   4 290.653 -10.285 -11.786
   23   HD21  ASN   4          HD21      ASN   4 290.136  -7.474 -10.062
   24   HD22  ASN   4          HD22      ASN   4 288.705  -6.935 -10.867
   25    H    ASP   5           H        ASP   5 288.294 -12.415  -8.461
   26    HA   ASP   5           HA       ASP   5 286.523 -10.226  -7.665
   27    HB2  ASP   5           HB2      ASP   5 285.867 -12.745  -8.349
   28    HB3  ASP   5           HB3      ASP   5 286.147 -12.996  -6.628
   29    H    HIS   6           H        HIS   6 285.894 -10.913  -5.032
   30    HA   HIS   6           HA       HIS   6 288.573 -10.843  -3.829
   31    HB2  HIS   6           HB2      HIS   6 287.572  -9.759  -1.801
   32    HB3  HIS   6           HB3      HIS   6 287.675  -8.762  -3.224
   33    HD1  HIS   6           HD1      HIS   6 284.937  -9.675  -4.526
   34    HD2  HIS   6           HD2      HIS   6 285.608  -8.481  -0.609
   35    HE1  HIS   6           HE1      HIS   6 282.698  -8.897  -3.682
   36    HE2  HIS   6           HE2      HIS   6 283.102  -8.261  -1.274
   37    H    ILE   7           H        ILE   7 289.059 -11.881  -2.022
   38    HA   ILE   7           HA       ILE   7 287.215 -13.998  -1.195
   39    HB   ILE   7           HB       ILE   7 288.905 -15.617  -1.231
   40   HG12  ILE   7          HG12      ILE   7 290.930 -13.395  -1.573
   41   HG13  ILE   7          HG13      ILE   7 290.687 -14.364  -0.118
   42   HG21  ILE   7          HG21      ILE   7 289.997 -14.250  -3.595
   43   HG22  ILE   7          HG22      ILE   7 288.236 -14.391  -3.527
   44   HG23  ILE   7          HG23      ILE   7 289.238 -15.838  -3.437
   45   HD11  ILE   7          HD11      ILE   7 292.207 -14.948  -2.517
   46   HD12  ILE   7          HD12      ILE   7 291.098 -16.246  -2.072
   47   HD13  ILE   7          HD13      ILE   7 292.296 -15.670  -0.909
   48    H    ASN   8           H        ASN   8 287.421 -14.518   1.079
   49    HA   ASN   8           HA       ASN   8 288.310 -12.202   2.553
   50    HB2  ASN   8           HB2      ASN   8 286.351 -14.208   2.924
   51    HB3  ASN   8           HB3      ASN   8 287.476 -14.360   4.270
   52   HD21  ASN   8          HD21      ASN   8 288.174 -12.051   5.078
   53   HD22  ASN   8          HD22      ASN   8 286.848 -10.999   5.425
   54    H    LEU   9           H        LEU   9 290.177 -12.095   3.828
   55    HA   LEU   9           HA       LEU   9 291.754 -14.552   4.001
   56    HB2  LEU   9           HB2      LEU   9 292.538 -11.756   3.454
   57    HB3  LEU   9           HB3      LEU   9 293.593 -12.677   4.411
   58    HG   LEU   9           HG       LEU   9 294.490 -13.641   2.613
   59   HD11  LEU   9          HD11      LEU   9 293.182 -14.982   1.024
   60   HD12  LEU   9          HD12      LEU   9 291.691 -14.359   1.730
   61   HD13  LEU   9          HD13      LEU   9 292.771 -15.365   2.695
   62   HD21  LEU   9          HD21      LEU   9 293.390 -12.815   0.338
   63   HD22  LEU   9          HD22      LEU   9 294.446 -11.790   1.316
   64   HD23  LEU   9          HD23      LEU   9 292.692 -11.625   1.436
   65    H    LYS  10           H        LYS  10 292.590 -15.125   5.891
   66    HA   LYS  10           HA       LYS  10 291.657 -13.634   8.240
   67    HB2  LYS  10           HB2      LYS  10 292.419 -16.429   7.639
   68    HB3  LYS  10           HB3      LYS  10 292.690 -15.883   9.251
   69    HG2  LYS  10           HG2      LYS  10 290.420 -15.620   9.671
   70    HG3  LYS  10           HG3      LYS  10 290.029 -15.531   7.949
   71    HD2  LYS  10           HD2      LYS  10 289.339 -17.673   8.821
   72    HD3  LYS  10           HD3      LYS  10 290.690 -17.882   7.702
   73    HE2  LYS  10           HE2      LYS  10 291.443 -19.201   9.401
   74    HE3  LYS  10           HE3      LYS  10 292.092 -17.654   9.955
   75    HZ1  LYS  10           HZ1      LYS  10 289.680 -17.598  11.065
   76    HZ2  LYS  10           HZ2      LYS  10 291.038 -18.246  11.838
   77    HZ3  LYS  10           HZ3      LYS  10 289.940 -19.270  11.058
   78    H    VAL  11           H        VAL  11 293.235 -12.140   8.822
   79    HA   VAL  11           HA       VAL  11 295.989 -12.959   8.417
   80    HB   VAL  11           HB       VAL  11 295.720 -10.788   7.648
   81   HG11  VAL  11          HG11      VAL  11 293.524 -10.460   8.948
   82   HG12  VAL  11          HG12      VAL  11 294.511  -9.066   8.522
   83   HG13  VAL  11          HG13      VAL  11 294.556  -9.714  10.166
   84   HG21  VAL  11          HG21      VAL  11 297.114  -9.417   9.058
   85   HG22  VAL  11          HG22      VAL  11 297.689 -11.085   9.013
   86   HG23  VAL  11          HG23      VAL  11 296.811 -10.493  10.426
   87    H    ALA  12           H        ALA  12 296.945 -14.002   9.887
   88    HA   ALA  12           HA       ALA  12 296.008 -13.998  12.659
   89    HB1  ALA  12           HB1      ALA  12 297.380 -15.945  10.956
   90    HB2  ALA  12           HB2      ALA  12 296.222 -16.193  12.266
   91    HB3  ALA  12           HB3      ALA  12 297.926 -15.900  12.634
   92    H    GLY  13           H        GLY  13 297.070 -13.069  14.289
   93    HA2  GLY  13           HA2      GLY  13 299.517 -11.645  13.622
   94    HA3  GLY  13           HA3      GLY  13 298.532 -11.414  15.056
   95    H    GLN  14           H        GLN  14 301.222 -11.512  15.235
   96    HA   GLN  14           HA       GLN  14 302.340 -14.033  15.753
   97    HB2  GLN  14           HB2      GLN  14 303.017 -11.273  16.755
   98    HB3  GLN  14           HB3      GLN  14 304.014 -12.689  17.074
   99    HG2  GLN  14           HG2      GLN  14 303.356 -12.350  14.258
  100    HG3  GLN  14           HG3      GLN  14 304.245 -10.987  14.938
  101   HE21  GLN  14          HE21      GLN  14 304.405 -14.450  15.651
  102   HE22  GLN  14          HE22      GLN  14 306.081 -14.629  15.273
  103    H    ASP  15           H        ASP  15 300.073 -12.177  17.506
  104    HA   ASP  15           HA       ASP  15 300.681 -13.439  20.058
  105    HB2  ASP  15           HB2      ASP  15 298.699 -11.337  19.204
  106    HB3  ASP  15           HB3      ASP  15 298.640 -12.075  20.802
  107    H    GLY  16           H        GLY  16 299.155 -14.476  17.371
  108    HA2  GLY  16           HA2      GLY  16 297.970 -16.495  17.205
  109    HA3  GLY  16           HA3      GLY  16 297.545 -16.362  18.903
  110    H    SER  17           H        SER  17 296.976 -13.432  17.419
  111    HA   SER  17           HA       SER  17 294.127 -14.038  17.186
  112    HB2  SER  17           HB2      SER  17 295.581 -11.426  17.656
  113    HB3  SER  17           HB3      SER  17 293.840 -11.553  17.404
  114    HG   SER  17           HG       SER  17 295.190 -11.860  19.660
  115    H    VAL  18           H        VAL  18 293.374 -14.265  15.211
  116    HA   VAL  18           HA       VAL  18 294.763 -13.009  12.949
  117    HB   VAL  18           HB       VAL  18 294.608 -15.154  12.248
  118   HG11  VAL  18          HG11      VAL  18 293.907 -16.284  14.123
  119   HG12  VAL  18          HG12      VAL  18 292.668 -16.690  12.936
  120   HG13  VAL  18          HG13      VAL  18 292.343 -15.467  14.164
  121   HG21  VAL  18          HG21      VAL  18 292.561 -15.636  10.948
  122   HG22  VAL  18          HG22      VAL  18 293.251 -14.041  10.654
  123   HG23  VAL  18          HG23      VAL  18 291.817 -14.209  11.664
  124    H    VAL  19           H        VAL  19 293.237 -12.255  11.147
  125    HA   VAL  19           HA       VAL  19 290.689 -11.219  12.154
  126    HB   VAL  19           HB       VAL  19 292.713  -9.456  10.823
  127   HG11  VAL  19          HG11      VAL  19 291.213  -7.638  11.290
  128   HG12  VAL  19          HG12      VAL  19 290.126  -8.714  12.169
  129   HG13  VAL  19          HG13      VAL  19 290.323  -8.894  10.427
  130   HG21  VAL  19          HG21      VAL  19 293.085  -8.409  12.942
  131   HG22  VAL  19          HG22      VAL  19 293.372 -10.140  13.108
  132   HG23  VAL  19          HG23      VAL  19 291.869  -9.434  13.705
  133    H    GLN  20           H        GLN  20 289.187 -10.678  10.477
  134    HA   GLN  20           HA       GLN  20 289.836 -12.040   7.983
  135    HB2  GLN  20           HB2      GLN  20 287.175 -11.054   9.017
  136    HB3  GLN  20           HB3      GLN  20 287.416 -11.983   7.541
  137    HG2  GLN  20           HG2      GLN  20 288.633 -13.271   9.817
  138    HG3  GLN  20           HG3      GLN  20 286.912 -12.979  10.079
  139   HE21  GLN  20          HE21      GLN  20 288.420 -15.468   9.663
  140   HE22  GLN  20          HE22      GLN  20 287.679 -16.247   8.312
  141    H    PHE  21           H        PHE  21 289.930 -11.166   6.061
  142    HA   PHE  21           HA       PHE  21 289.085  -8.428   5.586
  143    HB2  PHE  21           HB2      PHE  21 291.960  -9.320   5.366
  144    HB3  PHE  21           HB3      PHE  21 291.334  -7.840   4.643
  145    HD1  PHE  21           HD1      PHE  21 290.138  -6.204   6.267
  146    HD2  PHE  21           HD2      PHE  21 292.772  -9.300   7.508
  147    HE1  PHE  21           HE1      PHE  21 290.492  -5.041   8.406
  148    HE2  PHE  21           HE2      PHE  21 293.141  -8.122   9.648
  149    HZ   PHE  21           HZ       PHE  21 291.995  -5.998  10.096
  150    H    LYS  22           H        LYS  22 288.009  -8.535   3.751
  151    HA   LYS  22           HA       LYS  22 288.857 -10.512   1.770
  152    HB2  LYS  22           HB2      LYS  22 286.359 -10.137   2.692
  153    HB3  LYS  22           HB3      LYS  22 286.338  -9.064   1.297
  154    HG2  LYS  22           HG2      LYS  22 287.328 -11.054   0.023
  155    HG3  LYS  22           HG3      LYS  22 286.743 -12.002   1.386
  156    HD2  LYS  22           HD2      LYS  22 284.726 -10.235   0.663
  157    HD3  LYS  22           HD3      LYS  22 285.292 -10.990  -0.827
  158    HE2  LYS  22           HE2      LYS  22 285.131 -13.167   0.635
  159    HE3  LYS  22           HE3      LYS  22 284.021 -12.183   1.586
  160    HZ1  LYS  22           HZ1      LYS  22 283.678 -13.329  -1.054
  161    HZ2  LYS  22           HZ2      LYS  22 283.108 -11.746  -0.881
  162    HZ3  LYS  22           HZ3      LYS  22 282.523 -12.969   0.129
  163    H    ILE  23           H        ILE  23 289.533  -9.995  -0.139
  164    HA   ILE  23           HA       ILE  23 289.114  -7.387  -1.243
  165    HB   ILE  23           HB       ILE  23 290.912  -6.410  -0.373
  166   HG12  ILE  23          HG12      ILE  23 291.893  -7.895  -2.544
  167   HG13  ILE  23          HG13      ILE  23 292.560  -6.443  -1.834
  168   HG21  ILE  23          HG21      ILE  23 292.638  -7.673   0.943
  169   HG22  ILE  23          HG22      ILE  23 291.711  -9.132   0.595
  170   HG23  ILE  23          HG23      ILE  23 290.977  -7.815   1.513
  171   HD11  ILE  23          HD11      ILE  23 293.915  -7.767  -0.322
  172   HD12  ILE  23          HD12      ILE  23 294.238  -8.191  -2.008
  173   HD13  ILE  23          HD13      ILE  23 293.239  -9.245  -1.009
  174    H    LYS  24           H        LYS  24 289.236  -7.379  -3.323
  175    HA   LYS  24           HA       LYS  24 289.073  -9.681  -4.796
  176    HB2  LYS  24           HB2      LYS  24 290.008  -7.074  -5.873
  177    HB3  LYS  24           HB3      LYS  24 289.380  -8.404  -6.822
  178    HG2  LYS  24           HG2      LYS  24 287.461  -7.988  -4.874
  179    HG3  LYS  24           HG3      LYS  24 287.948  -6.372  -5.338
  180    HD2  LYS  24           HD2      LYS  24 286.911  -8.555  -7.124
  181    HD3  LYS  24           HD3      LYS  24 286.101  -7.046  -6.709
  182    HE2  LYS  24           HE2      LYS  24 287.733  -5.777  -7.919
  183    HE3  LYS  24           HE3      LYS  24 288.710  -7.222  -8.195
  184    HZ1  LYS  24           HZ1      LYS  24 285.933  -7.201  -9.140
  185    HZ2  LYS  24           HZ2      LYS  24 287.282  -7.988  -9.788
  186    HZ3  LYS  24           HZ3      LYS  24 287.082  -6.324 -10.018
  187    H    ARG  25           H        ARG  25 290.420 -11.065  -5.824
  188    HA   ARG  25           HA       ARG  25 292.827 -11.604  -4.726
  189    HB2  ARG  25           HB2      ARG  25 291.756 -12.301  -7.434
  190    HB3  ARG  25           HB3      ARG  25 293.263 -12.925  -6.815
  191    HG2  ARG  25           HG2      ARG  25 292.117 -13.969  -4.958
  192    HG3  ARG  25           HG3      ARG  25 290.587 -13.289  -5.511
  193    HD2  ARG  25           HD2      ARG  25 291.426 -14.546  -7.756
  194    HD3  ARG  25           HD3      ARG  25 292.108 -15.598  -6.518
  195    HE   ARG  25           HE       ARG  25 289.277 -15.107  -7.038
  196   HH11  ARG  25          HH11      ARG  25 291.715 -16.677  -5.082
  197   HH12  ARG  25          HH12      ARG  25 290.603 -17.810  -4.394
  198   HH21  ARG  25          HH21      ARG  25 287.823 -16.594  -6.121
  199   HH22  ARG  25          HH22      ARG  25 288.399 -17.764  -4.981
  200    H    HIS  26           H        HIS  26 292.333  -9.797  -7.765
  201    HA   HIS  26           HA       HIS  26 295.141  -9.576  -8.174
  202    HB2  HIS  26           HB2      HIS  26 292.909  -8.050  -9.507
  203    HB3  HIS  26           HB3      HIS  26 294.597  -8.079 -10.017
  204    HD1  HIS  26           HD1      HIS  26 294.269  -9.226 -12.247
  205    HD2  HIS  26           HD2      HIS  26 292.612 -11.340  -9.077
  206    HE1  HIS  26           HE1      HIS  26 293.623 -11.464 -13.195
  207    HE2  HIS  26           HE2      HIS  26 292.705 -12.757 -11.238
  208    H    THR  27           H        THR  27 294.046  -8.390  -5.589
  209    HA   THR  27           HA       THR  27 295.081  -5.675  -6.063
  210    HB   THR  27           HB       THR  27 292.930  -6.653  -4.328
  211    HG1  THR  27           HG1      THR  27 293.817  -4.159  -5.351
  212   HG21  THR  27          HG21      THR  27 295.069  -4.862  -3.192
  213   HG22  THR  27          HG22      THR  27 294.423  -6.348  -2.502
  214   HG23  THR  27          HG23      THR  27 293.417  -4.904  -2.581
  215    HA   PRO  28           HA       PRO  28 298.637  -6.836  -3.765
  216    HB2  PRO  28           HB2      PRO  28 298.859  -4.099  -2.778
  217    HB3  PRO  28           HB3      PRO  28 299.908  -4.963  -3.898
  218    HG2  PRO  28           HG2      PRO  28 298.307  -2.904  -4.650
  219    HG3  PRO  28           HG3      PRO  28 298.787  -4.217  -5.740
  220    HD2  PRO  28           HD2      PRO  28 296.210  -3.782  -4.305
  221    HD3  PRO  28           HD3      PRO  28 296.509  -4.458  -5.920
  222    H    LEU  29           H        LEU  29 298.612  -7.830  -1.878
  223    HA   LEU  29           HA       LEU  29 296.626  -7.613   0.029
  224    HB2  LEU  29           HB2      LEU  29 299.469  -8.580   0.287
  225    HB3  LEU  29           HB3      LEU  29 298.253  -8.781   1.540
  226    HG   LEU  29           HG       LEU  29 297.744  -9.756  -1.243
  227   HD11  LEU  29          HD11      LEU  29 299.446 -11.012   0.853
  228   HD12  LEU  29          HD12      LEU  29 299.682 -10.926  -0.894
  229   HD13  LEU  29          HD13      LEU  29 298.467 -12.010  -0.220
  230   HD21  LEU  29          HD21      LEU  29 295.792  -9.873  -0.075
  231   HD22  LEU  29          HD22      LEU  29 296.595 -10.184   1.477
  232   HD23  LEU  29          HD23      LEU  29 296.477 -11.463   0.258
  233    H    SER  30           H        SER  30 299.248  -5.447  -0.533
  234    HA   SER  30           HA       SER  30 299.844  -4.433   1.946
  235    HB2  SER  30           HB2      SER  30 300.512  -2.427   0.860
  236    HB3  SER  30           HB3      SER  30 300.765  -3.691  -0.338
  237    HG   SER  30           HG       SER  30 299.585  -2.414  -1.528
  238    H    LYS  31           H        LYS  31 296.852  -4.375   0.251
  239    HA   LYS  31           HA       LYS  31 295.727  -2.177   1.745
  240    HB2  LYS  31           HB2      LYS  31 295.143  -2.946  -0.667
  241    HB3  LYS  31           HB3      LYS  31 294.135  -4.143   0.133
  242    HG2  LYS  31           HG2      LYS  31 292.668  -2.570   0.933
  243    HG3  LYS  31           HG3      LYS  31 293.867  -1.274   0.889
  244    HD2  LYS  31           HD2      LYS  31 292.944  -2.559  -1.651
  245    HD3  LYS  31           HD3      LYS  31 291.959  -1.317  -0.877
  246    HE2  LYS  31           HE2      LYS  31 294.677  -0.443  -0.955
  247    HE3  LYS  31           HE3      LYS  31 294.197  -0.977  -2.565
  248    HZ1  LYS  31           HZ1      LYS  31 292.071   0.480  -1.765
  249    HZ2  LYS  31           HZ2      LYS  31 293.326   1.056  -2.740
  250    HZ3  LYS  31           HZ3      LYS  31 293.356   1.335  -1.072
  251    H    LEU  32           H        LEU  32 295.458  -5.736   1.613
  252    HA   LEU  32           HA       LEU  32 293.523  -6.061   3.595
  253    HB2  LEU  32           HB2      LEU  32 294.093  -7.858   2.132
  254    HB3  LEU  32           HB3      LEU  32 295.771  -7.784   2.586
  255    HG   LEU  32           HG       LEU  32 293.749  -8.571   4.651
  256   HD11  LEU  32          HD11      LEU  32 294.617 -10.113   2.266
  257   HD12  LEU  32          HD12      LEU  32 293.048 -10.059   3.068
  258   HD13  LEU  32          HD13      LEU  32 294.387 -10.946   3.802
  259   HD21  LEU  32          HD21      LEU  32 295.537  -9.466   5.746
  260   HD22  LEU  32          HD22      LEU  32 296.378  -8.196   4.843
  261   HD23  LEU  32          HD23      LEU  32 296.386  -9.854   4.233
  262    H    MET  33           H        MET  33 297.073  -5.982   3.760
  263    HA   MET  33           HA       MET  33 297.221  -6.318   6.554
  264    HB2  MET  33           HB2      MET  33 299.531  -4.929   5.872
  265    HB3  MET  33           HB3      MET  33 299.355  -6.661   6.043
  266    HG2  MET  33           HG2      MET  33 299.087  -7.001   3.804
  267    HG3  MET  33           HG3      MET  33 298.668  -5.322   3.534
  268    HE1  MET  33           HE1      MET  33 302.297  -7.225   4.862
  269    HE2  MET  33           HE2      MET  33 302.482  -7.396   3.112
  270    HE3  MET  33           HE3      MET  33 301.014  -7.975   3.909
  271    H    LYS  34           H        LYS  34 296.917  -3.559   4.482
  272    HA   LYS  34           HA       LYS  34 297.509  -1.556   6.387
  273    HB2  LYS  34           HB2      LYS  34 296.039  -1.643   3.791
  274    HB3  LYS  34           HB3      LYS  34 295.770  -0.255   4.837
  275    HG2  LYS  34           HG2      LYS  34 298.546  -1.120   4.186
  276    HG3  LYS  34           HG3      LYS  34 297.622  -0.156   3.039
  277    HD2  LYS  34           HD2      LYS  34 297.185   1.216   5.334
  278    HD3  LYS  34           HD3      LYS  34 298.811   0.598   5.617
  279    HE2  LYS  34           HE2      LYS  34 298.697   1.556   2.949
  280    HE3  LYS  34           HE3      LYS  34 297.992   2.788   3.994
  281    HZ1  LYS  34           HZ1      LYS  34 300.045   2.465   5.419
  282    HZ2  LYS  34           HZ2      LYS  34 300.265   3.255   3.939
  283    HZ3  LYS  34           HZ3      LYS  34 300.711   1.631   4.105
  284    H    ALA  35           H        ALA  35 294.793  -3.608   5.839
  285    HA   ALA  35           HA       ALA  35 292.940  -2.092   7.448
  286    HB1  ALA  35           HB1      ALA  35 292.610  -4.973   6.691
  287    HB2  ALA  35           HB2      ALA  35 292.455  -3.709   5.476
  288    HB3  ALA  35           HB3      ALA  35 291.383  -3.722   6.874
  289    H    TYR  36           H        TYR  36 294.906  -5.020   7.745
  290    HA   TYR  36           HA       TYR  36 294.144  -5.729  10.419
  291    HB2  TYR  36           HB2      TYR  36 295.335  -7.224   8.783
  292    HB3  TYR  36           HB3      TYR  36 296.769  -6.234   8.990
  293    HD1  TYR  36           HD1      TYR  36 294.271  -7.570  11.403
  294    HD2  TYR  36           HD2      TYR  36 298.360  -7.426  10.182
  295    HE1  TYR  36           HE1      TYR  36 294.919  -8.961  13.320
  296    HE2  TYR  36           HE2      TYR  36 299.010  -8.787  12.080
  297    HH   TYR  36           HH       TYR  36 297.072 -10.644  13.763
  298    H    CYS  37           H        CYS  37 296.586  -3.623   8.984
  299    HA   CYS  37           HA       CYS  37 297.881  -3.000  11.463
  300    HB2  CYS  37           HB2      CYS  37 297.930  -1.872   8.672
  301    HB3  CYS  37           HB3      CYS  37 298.698  -0.996   9.990
  302    HG   CYS  37           HG       CYS  37 300.533  -2.659  10.064
  303    H    GLU  38           H        GLU  38 295.331  -1.768   9.461
  304    HA   GLU  38           HA       GLU  38 294.770   0.631  10.890
  305    HB2  GLU  38           HB2      GLU  38 294.017   0.382   8.623
  306    HB3  GLU  38           HB3      GLU  38 293.173  -1.108   9.015
  307    HG2  GLU  38           HG2      GLU  38 292.126   0.840  10.719
  308    HG3  GLU  38           HG3      GLU  38 292.280   1.576   9.137
  309    H    ARG  39           H        ARG  39 293.623  -2.695  10.910
  310    HA   ARG  39           HA       ARG  39 291.594  -2.441  12.844
  311    HB2  ARG  39           HB2      ARG  39 291.178  -4.548  12.140
  312    HB3  ARG  39           HB3      ARG  39 292.458  -4.302  10.987
  313    HG2  ARG  39           HG2      ARG  39 293.300  -6.149  11.876
  314    HG3  ARG  39           HG3      ARG  39 293.848  -5.135  13.165
  315    HD2  ARG  39           HD2      ARG  39 291.324  -5.604  13.959
  316    HD3  ARG  39           HD3      ARG  39 291.671  -7.078  13.068
  317    HE   ARG  39           HE       ARG  39 293.565  -7.420  14.581
  318   HH11  ARG  39          HH11      ARG  39 291.071  -5.182  15.598
  319   HH12  ARG  39          HH12      ARG  39 291.430  -5.365  17.279
  320   HH21  ARG  39          HH21      ARG  39 294.021  -7.652  16.798
  321   HH22  ARG  39          HH22      ARG  39 293.098  -6.760  17.960
  322    H    GLN  40           H        GLN  40 294.925  -3.625  12.893
  323    HA   GLN  40           HA       GLN  40 294.824  -4.223  15.679
  324    HB2  GLN  40           HB2      GLN  40 296.988  -4.383  13.609
  325    HB3  GLN  40           HB3      GLN  40 297.308  -4.702  15.306
  326    HG2  GLN  40           HG2      GLN  40 295.063  -6.222  14.689
  327    HG3  GLN  40           HG3      GLN  40 296.144  -6.395  13.307
  328   HE21  GLN  40          HE21      GLN  40 295.331  -8.269  15.478
  329   HE22  GLN  40          HE22      GLN  40 296.814  -8.841  16.153
  330    H    GLY  41           H        GLY  41 296.660  -1.911  13.670
  331    HA2  GLY  41           HA2      GLY  41 296.905   0.365  14.574
  332    HA3  GLY  41           HA3      GLY  41 297.254  -0.391  16.125
  333    H    LEU  42           H        LEU  42 298.579  -2.343  13.835
  334    HA   LEU  42           HA       LEU  42 301.230  -1.871  14.532
  335    HB2  LEU  42           HB2      LEU  42 300.001  -3.246  12.152
  336    HB3  LEU  42           HB3      LEU  42 301.739  -3.203  12.400
  337    HG   LEU  42           HG       LEU  42 300.007  -4.227  14.605
  338   HD11  LEU  42          HD11      LEU  42 300.828  -6.435  13.060
  339   HD12  LEU  42          HD12      LEU  42 300.010  -5.322  11.963
  340   HD13  LEU  42          HD13      LEU  42 299.183  -5.903  13.409
  341   HD21  LEU  42          HD21      LEU  42 301.942  -5.029  15.409
  342   HD22  LEU  42          HD22      LEU  42 302.690  -3.880  14.297
  343   HD23  LEU  42          HD23      LEU  42 302.491  -5.568  13.822
  344    H    SER  43           H        SER  43 302.919  -1.537  12.720
  345    HA   SER  43           HA       SER  43 302.453   1.132  11.632
  346    HB2  SER  43           HB2      SER  43 304.500   0.520  13.032
  347    HB3  SER  43           HB3      SER  43 305.045  -0.420  11.645
  348    HG   SER  43           HG       SER  43 305.926   1.653  11.557
  349    H    MET  44           H        MET  44 302.735  -2.141  10.662
  350    HA   MET  44           HA       MET  44 302.347  -3.157   8.659
  351    HB2  MET  44           HB2      MET  44 301.037  -0.966   8.188
  352    HB3  MET  44           HB3      MET  44 302.427  -0.539   7.196
  353    HG2  MET  44           HG2      MET  44 302.028  -2.959   6.237
  354    HG3  MET  44           HG3      MET  44 300.389  -2.655   6.813
  355    HE1  MET  44           HE1      MET  44 301.746  -3.079   3.750
  356    HE2  MET  44           HE2      MET  44 300.645  -2.067   2.813
  357    HE3  MET  44           HE3      MET  44 300.009  -3.159   4.043
  358    H    ARG  45           H        ARG  45 304.930  -1.150   9.427
  359    HA   ARG  45           HA       ARG  45 306.586  -2.164   7.240
  360    HB2  ARG  45           HB2      ARG  45 306.425   0.364   8.565
  361    HB3  ARG  45           HB3      ARG  45 308.051  -0.277   8.676
  362    HG2  ARG  45           HG2      ARG  45 306.736  -0.383   6.034
  363    HG3  ARG  45           HG3      ARG  45 307.202   1.210   6.638
  364    HD2  ARG  45           HD2      ARG  45 309.432  -0.123   7.206
  365    HD3  ARG  45           HD3      ARG  45 308.879  -1.092   5.841
  366    HE   ARG  45           HE       ARG  45 310.036   1.487   5.718
  367   HH11  ARG  45          HH11      ARG  45 307.579  -0.491   4.229
  368   HH12  ARG  45          HH12      ARG  45 307.635   0.356   2.719
  369   HH21  ARG  45          HH21      ARG  45 310.106   2.607   3.736
  370   HH22  ARG  45          HH22      ARG  45 309.071   2.113   2.439
  371    H    GLN  46           H        GLN  46 306.255  -1.734  10.673
  372    HA   GLN  46           HA       GLN  46 308.591  -3.308  11.380
  373    HB2  GLN  46           HB2      GLN  46 307.721  -1.361  12.712
  374    HB3  GLN  46           HB3      GLN  46 306.332  -2.347  13.145
  375    HG2  GLN  46           HG2      GLN  46 308.913  -3.626  13.634
  376    HG3  GLN  46           HG3      GLN  46 308.640  -2.164  14.580
  377   HE21  GLN  46          HE21      GLN  46 308.692  -5.134  15.168
  378   HE22  GLN  46          HE22      GLN  46 307.249  -5.401  16.074
  379    H    ILE  47           H        ILE  47 305.697  -3.926  10.173
  380    HA   ILE  47           HA       ILE  47 305.329  -6.554  11.453
  381    HB   ILE  47           HB       ILE  47 303.567  -4.921  11.975
  382   HG12  ILE  47          HG12      ILE  47 302.748  -7.151  11.963
  383   HG13  ILE  47          HG13      ILE  47 301.590  -6.128  11.056
  384   HG21  ILE  47          HG21      ILE  47 303.834  -3.623   9.950
  385   HG22  ILE  47          HG22      ILE  47 302.153  -4.028  10.301
  386   HG23  ILE  47          HG23      ILE  47 303.030  -4.901   9.039
  387   HD11  ILE  47          HD11      ILE  47 302.807  -6.999   9.035
  388   HD12  ILE  47          HD12      ILE  47 301.555  -7.940   9.878
  389   HD13  ILE  47          HD13      ILE  47 303.282  -8.312  10.125
  390    H    ARG  48           H        ARG  48 305.308  -8.227  10.094
  391    HA   ARG  48           HA       ARG  48 305.135  -7.715   7.202
  392    HB2  ARG  48           HB2      ARG  48 307.156  -9.274   8.752
  393    HB3  ARG  48           HB3      ARG  48 306.677  -9.853   7.165
  394    HG2  ARG  48           HG2      ARG  48 307.756  -7.121   7.787
  395    HG3  ARG  48           HG3      ARG  48 308.658  -8.454   7.057
  396    HD2  ARG  48           HD2      ARG  48 307.964  -7.726   5.097
  397    HD3  ARG  48           HD3      ARG  48 306.354  -8.258   5.533
  398    HE   ARG  48           HE       ARG  48 305.735  -6.070   5.774
  399   HH11  ARG  48          HH11      ARG  48 309.220  -6.241   5.727
  400   HH12  ARG  48          HH12      ARG  48 309.428  -4.523   5.668
  401   HH21  ARG  48          HH21      ARG  48 306.006  -3.812   5.700
  402   HH22  ARG  48          HH22      ARG  48 307.603  -3.143   5.654
  403    H    PHE  49           H        PHE  49 303.488  -8.767   6.331
  404    HA   PHE  49           HA       PHE  49 302.122 -10.731   7.949
  405    HB2  PHE  49           HB2      PHE  49 301.468  -9.535   5.242
  406    HB3  PHE  49           HB3      PHE  49 300.497 -10.747   6.000
  407    HD1  PHE  49           HD1      PHE  49 302.165  -7.852   7.646
  408    HD2  PHE  49           HD2      PHE  49 298.524  -9.650   6.369
  409    HE1  PHE  49           HE1      PHE  49 300.940  -6.133   8.784
  410    HE2  PHE  49           HE2      PHE  49 297.286  -7.889   7.559
  411    HZ   PHE  49           HZ       PHE  49 298.537  -6.146   8.793
  412    H    ARG  50           H        ARG  50 302.253 -12.937   7.575
  413    HA   ARG  50           HA       ARG  50 303.566 -13.738   5.083
  414    HB2  ARG  50           HB2      ARG  50 304.658 -14.391   7.315
  415    HB3  ARG  50           HB3      ARG  50 303.359 -15.541   7.469
  416    HG2  ARG  50           HG2      ARG  50 304.342 -15.812   4.927
  417    HG3  ARG  50           HG3      ARG  50 305.764 -15.616   5.902
  418    HD2  ARG  50           HD2      ARG  50 303.594 -17.543   6.634
  419    HD3  ARG  50           HD3      ARG  50 304.875 -17.966   5.522
  420    HE   ARG  50           HE       ARG  50 306.277 -17.075   7.609
  421   HH11  ARG  50          HH11      ARG  50 303.622 -19.333   7.410
  422   HH12  ARG  50          HH12      ARG  50 304.138 -20.252   8.783
  423   HH21  ARG  50          HH21      ARG  50 306.954 -18.283   9.417
  424   HH22  ARG  50          HH22      ARG  50 306.028 -19.655   9.923
  425    H    PHE  51           H        PHE  51 302.473 -15.201   3.867
  426    HA   PHE  51           HA       PHE  51 299.684 -15.511   4.598
  427    HB2  PHE  51           HB2      PHE  51 299.711 -14.871   2.386
  428    HB3  PHE  51           HB3      PHE  51 301.206 -15.703   2.056
  429    HD1  PHE  51           HD2      PHE  51 297.701 -16.500   2.989
  430    HD2  PHE  51           HD1      PHE  51 301.097 -17.551   0.666
  431    HE1  PHE  51           HE2      PHE  51 296.426 -18.338   1.966
  432    HE2  PHE  51           HE1      PHE  51 299.834 -19.389  -0.366
  433    HZ   PHE  51           HZ       PHE  51 297.492 -19.786   0.284
  434    H    ASP  52           H        ASP  52 298.704 -17.635   4.347
  435    HA   ASP  52           HA       ASP  52 299.644 -19.449   6.136
  436    HB2  ASP  52           HB2      ASP  52 297.467 -19.589   4.719
  437    HB3  ASP  52           HB3      ASP  52 298.441 -20.534   3.599
  438    H    GLY  53           H        GLY  53 301.756 -19.657   6.198
  439    HA2  GLY  53           HA2      GLY  53 303.869 -20.340   5.744
  440    HA3  GLY  53           HA3      GLY  53 303.113 -21.614   4.816
  441    H    GLN  54           H        GLN  54 303.609 -18.009   4.373
  442    HA   GLN  54           HA       GLN  54 305.327 -18.426   2.170
  443    HB2  GLN  54           HB2      GLN  54 302.735 -18.945   1.462
  444    HB3  GLN  54           HB3      GLN  54 302.852 -17.227   1.114
  445    HG2  GLN  54           HG2      GLN  54 303.578 -17.941  -0.878
  446    HG3  GLN  54           HG3      GLN  54 305.123 -18.093  -0.037
  447   HE21  GLN  54          HE21      GLN  54 302.991 -19.640  -2.000
  448   HE22  GLN  54          HE22      GLN  54 303.449 -21.278  -1.695
  449    HA   PRO  55           HA       PRO  55 306.097 -14.434   4.168
  450    HB2  PRO  55           HB2      PRO  55 307.834 -13.877   1.955
  451    HB3  PRO  55           HB3      PRO  55 308.280 -14.282   3.611
  452    HG2  PRO  55           HG2      PRO  55 308.128 -16.020   1.226
  453    HG3  PRO  55           HG3      PRO  55 309.081 -16.222   2.706
  454    HD2  PRO  55           HD2      PRO  55 306.945 -17.750   2.157
  455    HD3  PRO  55           HD3      PRO  55 307.330 -17.263   3.819
  456    H    ILE  56           H        ILE  56 305.324 -12.378   3.739
  457    HA   ILE  56           HA       ILE  56 303.856 -12.122   1.205
  458    HB   ILE  56           HB       ILE  56 303.245 -11.019   3.902
  459   HG12  ILE  56          HG12      ILE  56 302.155 -13.188   2.190
  460   HG13  ILE  56          HG13      ILE  56 302.489 -13.184   3.899
  461   HG21  ILE  56          HG21      ILE  56 301.922 -10.399   1.289
  462   HG22  ILE  56          HG22      ILE  56 302.707  -9.281   2.409
  463   HG23  ILE  56          HG23      ILE  56 301.198 -10.075   2.877
  464   HD11  ILE  56          HD11      ILE  56 300.308 -13.044   4.153
  465   HD12  ILE  56          HD12      ILE  56 300.055 -12.537   2.484
  466   HD13  ILE  56          HD13      ILE  56 300.491 -11.348   3.713
  467    H    ASN  57           H        ASN  57 303.613 -10.261   0.230
  468    HA   ASN  57           HA       ASN  57 305.427  -8.042   0.877
  469    HB2  ASN  57           HB2      ASN  57 305.104  -9.632  -1.560
  470    HB3  ASN  57           HB3      ASN  57 305.181  -7.896  -1.819
  471   HD21  ASN  57          HD21      ASN  57 306.886  -9.368   0.851
  472   HD22  ASN  57          HD22      ASN  57 308.467  -9.169   0.196
  473    H    GLU  58           H        GLU  58 304.618  -5.979   0.445
  474    HA   GLU  58           HA       GLU  58 301.918  -5.555   0.809
  475    HB2  GLU  58           HB2      GLU  58 304.241  -3.939   0.019
  476    HB3  GLU  58           HB3      GLU  58 302.702  -3.299  -0.532
  477    HG2  GLU  58           HG2      GLU  58 301.883  -3.469   1.817
  478    HG3  GLU  58           HG3      GLU  58 303.525  -3.893   2.295
  479    H    THR  59           H        THR  59 303.729  -5.980  -2.171
  480    HA   THR  59           HA       THR  59 301.462  -5.302  -3.812
  481    HB   THR  59           HB       THR  59 302.963  -5.853  -5.696
  482    HG1  THR  59           HG1      THR  59 304.175  -7.449  -4.390
  483   HG21  THR  59          HG21      THR  59 303.291  -3.779  -3.778
  484   HG22  THR  59          HG22      THR  59 303.609  -3.750  -5.517
  485   HG23  THR  59          HG23      THR  59 304.878  -4.248  -4.397
  486    H    ASP  60           H        ASP  60 302.823  -8.184  -2.480
  487    HA   ASP  60           HA       ASP  60 301.921 -10.115  -4.271
  488    HB2  ASP  60           HB2      ASP  60 302.423 -10.116  -1.326
  489    HB3  ASP  60           HB3      ASP  60 301.588 -11.491  -2.035
  490    H    THR  61           H        THR  61 299.974 -10.964  -4.775
  491    HA   THR  61           HA       THR  61 297.655 -10.063  -3.202
  492    HB   THR  61           HB       THR  61 296.388  -9.685  -5.077
  493    HG1  THR  61           HG1      THR  61 296.396 -11.158  -6.544
  494   HG21  THR  61          HG21      THR  61 298.191  -8.040  -5.091
  495   HG22  THR  61          HG22      THR  61 297.619  -8.416  -6.723
  496   HG23  THR  61          HG23      THR  61 299.139  -9.103  -6.132
  497    HA   PRO  62           HA       PRO  62 296.119 -14.052  -2.237
  498    HB2  PRO  62           HB2      PRO  62 293.839 -13.274  -4.019
  499    HB3  PRO  62           HB3      PRO  62 293.793 -13.949  -2.390
  500    HG2  PRO  62           HG2      PRO  62 293.363 -11.325  -2.940
  501    HG3  PRO  62           HG3      PRO  62 294.066 -11.894  -1.413
  502    HD2  PRO  62           HD2      PRO  62 295.320 -10.419  -3.595
  503    HD3  PRO  62           HD3      PRO  62 295.915 -10.706  -1.951
  504    H    ALA  63           H        ALA  63 295.467 -13.033  -5.652
  505    HA   ALA  63           HA       ALA  63 295.390 -15.630  -6.769
  506    HB1  ALA  63           HB1      ALA  63 296.217 -12.994  -7.969
  507    HB2  ALA  63           HB2      ALA  63 294.553 -13.609  -7.893
  508    HB3  ALA  63           HB3      ALA  63 295.759 -14.443  -8.873
  509    H    GLN  64           H        GLN  64 297.776 -13.173  -6.386
  510    HA   GLN  64           HA       GLN  64 299.955 -14.394  -7.690
  511    HB2  GLN  64           HB2      GLN  64 299.247 -11.994  -6.330
  512    HB3  GLN  64           HB3      GLN  64 300.711 -12.584  -5.624
  513    HG2  GLN  64           HG2      GLN  64 300.313 -12.204  -8.563
  514    HG3  GLN  64           HG3      GLN  64 300.999 -10.976  -7.503
  515   HE21  GLN  64          HE21      GLN  64 303.098 -10.860  -7.865
  516   HE22  GLN  64          HE22      GLN  64 304.180 -12.198  -8.022
  517    H    LEU  65           H        LEU  65 298.355 -14.926  -4.798
  518    HA   LEU  65           HA       LEU  65 300.583 -16.415  -3.614
  519    HB2  LEU  65           HB2      LEU  65 298.386 -14.733  -2.480
  520    HB3  LEU  65           HB3      LEU  65 299.242 -15.860  -1.479
  521    HG   LEU  65           HG       LEU  65 300.255 -13.391  -2.853
  522   HD11  LEU  65          HD11      LEU  65 300.842 -14.200  -0.047
  523   HD12  LEU  65          HD12      LEU  65 299.265 -13.534  -0.458
  524   HD13  LEU  65          HD13      LEU  65 300.725 -12.592  -0.762
  525   HD21  LEU  65          HD21      LEU  65 301.856 -15.702  -1.793
  526   HD22  LEU  65          HD22      LEU  65 302.526 -14.084  -2.002
  527   HD23  LEU  65          HD23      LEU  65 301.914 -14.974  -3.397
  528    H    GLU  66           H        GLU  66 297.916 -16.869  -5.327
  529    HA   GLU  66           HA       GLU  66 296.271 -18.431  -5.526
  530    HB2  GLU  66           HB2      GLU  66 298.599 -19.986  -4.408
  531    HB3  GLU  66           HB3      GLU  66 297.084 -20.783  -4.812
  532    HG2  GLU  66           HG2      GLU  66 297.688 -19.255  -7.050
  533    HG3  GLU  66           HG3      GLU  66 299.235 -19.921  -6.530
  534    H    MET  67           H        MET  67 295.647 -16.887  -3.518
  535    HA   MET  67           HA       MET  67 295.199 -18.417  -1.093
  536    HB2  MET  67           HB2      MET  67 294.757 -15.552  -1.883
  537    HB3  MET  67           HB3      MET  67 294.107 -16.188  -0.392
  538    HG2  MET  67           HG2      MET  67 296.675 -17.012  -0.225
  539    HG3  MET  67           HG3      MET  67 296.862 -15.498  -1.101
  540    HE1  MET  67           HE1      MET  67 296.916 -12.950   1.363
  541    HE2  MET  67           HE2      MET  67 297.300 -13.621  -0.222
  542    HE3  MET  67           HE3      MET  67 298.202 -14.147   1.201
  543    H    GLU  68           H        GLU  68 292.968 -18.257  -0.087
  544    HA   GLU  68           HA       GLU  68 290.918 -18.664  -2.168
  545    HB2  GLU  68           HB2      GLU  68 291.757 -20.403  -0.035
  546    HB3  GLU  68           HB3      GLU  68 290.061 -19.972   0.151
  547    HG2  GLU  68           HG2      GLU  68 289.480 -20.936  -1.891
  548    HG3  GLU  68           HG3      GLU  68 291.144 -20.949  -2.473
  549    H    ASP  69           H        ASP  69 288.728 -18.891  -0.899
  550    HA   ASP  69           HA       ASP  69 288.302 -16.278   0.264
  551    HB2  ASP  69           HB2      ASP  69 286.132 -16.446  -0.429
  552    HB3  ASP  69           HB3      ASP  69 286.916 -17.505  -1.593
  553    H    GLU  70           H        GLU  70 288.562 -16.054   2.177
  554    HA   GLU  70           HA       GLU  70 288.081 -16.154   4.485
  555    HB2  GLU  70           HB2      GLU  70 286.370 -18.087   3.711
  556    HB3  GLU  70           HB3      GLU  70 287.591 -19.082   4.494
  557    HG2  GLU  70           HG2      GLU  70 287.044 -18.367   6.550
  558    HG3  GLU  70           HG3      GLU  70 286.740 -16.716   6.012
  559    H    ASP  71           H        ASP  71 290.261 -17.466   2.518
  560    HA   ASP  71           HA       ASP  71 291.843 -19.223   3.827
  561    HB2  ASP  71           HB2      ASP  71 292.118 -17.723   1.567
  562    HB3  ASP  71           HB3      ASP  71 293.354 -17.017   2.592
  563    H    THR  72           H        THR  72 294.306 -18.093   4.357
  564    HA   THR  72           HA       THR  72 293.784 -16.238   6.551
  565    HB   THR  72           HB       THR  72 295.185 -18.871   6.872
  566    HG1  THR  72           HG1      THR  72 293.486 -19.408   7.999
  567   HG21  THR  72          HG21      THR  72 295.757 -16.444   8.216
  568   HG22  THR  72          HG22      THR  72 296.397 -18.057   8.532
  569   HG23  THR  72          HG23      THR  72 294.922 -17.520   9.336
  570    H    ILE  73           H        ILE  73 295.117 -14.744   6.726
  571    HA   ILE  73           HA       ILE  73 297.677 -14.805   5.294
  572    HB   ILE  73           HB       ILE  73 295.820 -12.553   6.093
  573   HG12  ILE  73          HG12      ILE  73 295.860 -13.114   3.810
  574   HG13  ILE  73          HG13      ILE  73 296.838 -11.677   4.002
  575   HG21  ILE  73          HG21      ILE  73 298.722 -12.552   6.616
  576   HG22  ILE  73          HG22      ILE  73 297.496 -11.394   7.122
  577   HG23  ILE  73          HG23      ILE  73 298.234 -11.258   5.524
  578   HD11  ILE  73          HD11      ILE  73 298.289 -12.763   2.775
  579   HD12  ILE  73          HD12      ILE  73 297.638 -14.342   3.228
  580   HD13  ILE  73          HD13      ILE  73 298.703 -13.470   4.333
  581    H    ASP  74           H        ASP  74 299.409 -14.978   6.543
  582    HA   ASP  74           HA       ASP  74 298.975 -15.127   9.431
  583    HB2  ASP  74           HB2      ASP  74 301.496 -15.937   7.938
  584    HB3  ASP  74           HB3      ASP  74 301.032 -16.357   9.586
  585    H    VAL  75           H        VAL  75 300.239 -13.918  10.876
  586    HA   VAL  75           HA       VAL  75 301.645 -11.710   9.560
  587    HB   VAL  75           HB       VAL  75 299.579 -11.521  11.687
  588   HG11  VAL  75          HG11      VAL  75 302.134  -9.914  11.638
  589   HG12  VAL  75          HG12      VAL  75 301.302 -10.627  13.025
  590   HG13  VAL  75          HG13      VAL  75 300.631  -9.206  12.222
  591   HG21  VAL  75          HG21      VAL  75 298.797  -9.834  10.353
  592   HG22  VAL  75          HG22      VAL  75 299.603 -10.826   9.148
  593   HG23  VAL  75          HG23      VAL  75 300.395  -9.384   9.779
  594    H    PHE  76           H        PHE  76 303.438 -11.086  10.205
  595    HA   PHE  76           HA       PHE  76 304.617 -12.022  12.690
  596    HB2  PHE  76           HB2      PHE  76 305.926 -12.206   9.993
  597    HB3  PHE  76           HB3      PHE  76 306.717 -12.555  11.505
  598    HD1  PHE  76           HD1      PHE  76 305.494 -14.315  13.002
  599    HD2  PHE  76           HD2      PHE  76 305.065 -14.091   8.747
  600    HE1  PHE  76           HE1      PHE  76 304.764 -16.657  12.951
  601    HE2  PHE  76           HE2      PHE  76 304.329 -16.430   8.727
  602    HZ   PHE  76           HZ       PHE  76 304.181 -17.717  10.811
  603    H    GLN  77           H        GLN  77 305.913 -10.460  13.521
  604    HA   GLN  77           HA       GLN  77 305.764  -7.903  12.128
  605    HB2  GLN  77           HB2      GLN  77 305.475  -8.669  14.830
  606    HB3  GLN  77           HB3      GLN  77 306.891  -7.624  14.744
  607    HG2  GLN  77           HG2      GLN  77 305.672  -5.803  14.172
  608    HG3  GLN  77           HG3      GLN  77 304.475  -6.748  13.281
  609   HE21  GLN  77          HE21      GLN  77 303.320  -8.367  14.877
  610   HE22  GLN  77          HE22      GLN  77 302.663  -7.613  16.285
  611    H    GLN  78           H        GLN  78 307.468  -7.413  10.882
  612    HA   GLN  78           HA       GLN  78 309.566  -7.300  10.048
  613    HB2  GLN  78           HB2      GLN  78 309.546  -6.235  12.674
  614    HB3  GLN  78           HB3      GLN  78 311.073  -7.082  12.467
  615    HG2  GLN  78           HG2      GLN  78 310.764  -5.663  10.111
  616    HG3  GLN  78           HG3      GLN  78 310.184  -4.563  11.362
  617   HE21  GLN  78          HE21      GLN  78 311.652  -3.375  12.343
  618   HE22  GLN  78          HE22      GLN  78 313.347  -3.699  12.409
  619    H    GLN  79           H        GLN  79 310.323  -9.078   9.138
  620    HA   GLN  79           HA       GLN  79 312.329 -10.622  10.179
  621    HB2  GLN  79           HB2      GLN  79 311.138 -12.816  10.550
  622    HB3  GLN  79           HB3      GLN  79 310.900 -11.604  11.800
  623    HG2  GLN  79           HG2      GLN  79 308.706 -11.634  11.509
  624    HG3  GLN  79           HG3      GLN  79 308.873 -11.377   9.772
  625   HE21  GLN  79          HE21      GLN  79 308.565 -13.733  12.310
  626   HE22  GLN  79          HE22      GLN  79 308.185 -15.078  11.294
  627    H    THR  80           H        THR  80 309.625 -10.390   8.038
  628    HA   THR  80           HA       THR  80 310.595 -12.393   6.213
  629    HB   THR  80           HB       THR  80 308.672 -11.961   4.919
  630    HG1  THR  80           HG1      THR  80 308.161  -9.967   4.597
  631   HG21  THR  80          HG21      THR  80 307.837 -11.333   7.737
  632   HG22  THR  80          HG22      THR  80 308.182 -12.949   7.117
  633   HG23  THR  80          HG23      THR  80 306.838 -12.017   6.452
  634    H    GLY  81           H        GLY  81 309.757  -8.998   5.503
  635    HA2  GLY  81           HA2      GLY  81 311.482  -7.431   4.782
  636    HA3  GLY  81           HA3      GLY  81 312.307  -8.785   4.029
  637    H    GLY  82           H        GLY  82 309.212  -7.023   3.900
  638    HA2  GLY  82           HA2      GLY  82 309.357  -7.211   0.972
  639    HA3  GLY  82           HA3      GLY  82 307.873  -7.617   1.808
  640    H1   GLY   1           HT1      GLY   1 305.547   7.372  14.401
  641    H2   GLY   1           HT2      GLY   1 304.210   6.826  15.281
  642    H3   GLY   1           HT3      GLY   1 304.193   6.762  13.591
  643    HA2  GLY   1           HA3      GLY   1 305.890   5.163  15.424
  644    HA3  GLY   1           HA2      GLY   1 304.583   4.566  14.412
  645    H    SER   2           H        SER   2 307.866   5.764  14.462
  646    HA   SER   2           HA       SER   2 309.603   5.539  13.011
  647    HB2  SER   2           HB2      SER   2 307.871   3.210  12.433
  648    HB3  SER   2           HB3      SER   2 309.045   3.617  11.183
  649    HG   SER   2           HG       SER   2 309.569   3.069  13.916
  650    H    GLU   3           H        GLU   3 310.226   5.692  10.658
  651    HA   GLU   3           HA       GLU   3 308.272   7.394   9.262
  652    HB2  GLU   3           HB2      GLU   3 310.957   7.862   9.983
  653    HB3  GLU   3           HB3      GLU   3 310.950   7.658   8.236
  654    HG2  GLU   3           HG2      GLU   3 309.703   9.532   7.879
  655    HG3  GLU   3           HG3      GLU   3 308.902   9.433   9.447
  656    H    GLU   4           H        GLU   4 309.317   7.503   6.766
  657    HA   GLU   4           HA       GLU   4 308.679   4.867   5.738
  658    HB2  GLU   4           HB2      GLU   4 309.540   7.120   3.979
  659    HB3  GLU   4           HB3      GLU   4 308.334   5.873   3.682
  660    HG2  GLU   4           HG2      GLU   4 307.644   7.698   5.868
  661    HG3  GLU   4           HG3      GLU   4 307.784   8.466   4.289
  662    H    LYS   5           H        LYS   5 310.314   3.419   5.694
  663    HA   LYS   5           HA       LYS   5 312.481   3.685   3.979
  664    HB2  LYS   5           HB2      LYS   5 312.911   5.118   6.281
  665    HB3  LYS   5           HB3      LYS   5 313.822   3.644   6.551
  666    HG2  LYS   5           HG2      LYS   5 315.310   5.157   5.543
  667    HG3  LYS   5           HG3      LYS   5 314.837   4.028   4.274
  668    HD2  LYS   5           HD2      LYS   5 314.708   6.117   3.249
  669    HD3  LYS   5           HD3      LYS   5 313.033   5.753   3.672
  670    HE2  LYS   5           HE2      LYS   5 313.311   7.101   5.732
  671    HE3  LYS   5           HE3      LYS   5 314.932   7.541   5.192
  672    HZ1  LYS   5           HZ1      LYS   5 313.198   9.215   4.686
  673    HZ2  LYS   5           HZ2      LYS   5 312.460   8.101   3.650
  674    HZ3  LYS   5           HZ3      LYS   5 314.017   8.662   3.314
  675    HA   PRO   6           HA       PRO   6 311.706  -0.644   4.979
  676    HB2  PRO   6           HB2      PRO   6 313.368  -1.015   2.565
  677    HB3  PRO   6           HB3      PRO   6 311.729  -1.592   2.890
  678    HG2  PRO   6           HG2      PRO   6 312.162   0.398   1.168
  679    HG3  PRO   6           HG3      PRO   6 310.768   0.449   2.264
  680    HD2  PRO   6           HD2      PRO   6 313.424   1.845   2.518
  681    HD3  PRO   6           HD3      PRO   6 311.795   2.511   2.775
  682    H    LYS   7           H        LYS   7 312.943  -1.344   6.665
  683    HA   LYS   7           HA       LYS   7 315.775  -1.122   6.770
  684    HB2  LYS   7           HB2      LYS   7 313.831  -2.919   8.244
  685    HB3  LYS   7           HB3      LYS   7 315.559  -2.900   8.572
  686    HG2  LYS   7           HG2      LYS   7 313.879  -0.420   8.735
  687    HG3  LYS   7           HG3      LYS   7 314.069  -1.525  10.098
  688    HD2  LYS   7           HD2      LYS   7 315.866  -0.281  10.604
  689    HD3  LYS   7           HD3      LYS   7 316.656  -1.164   9.297
  690    HE2  LYS   7           HE2      LYS   7 315.195   0.965   8.132
  691    HE3  LYS   7           HE3      LYS   7 316.099   1.624   9.495
  692    HZ1  LYS   7           HZ1      LYS   7 317.647   1.766   7.846
  693    HZ2  LYS   7           HZ2      LYS   7 317.090   0.395   7.026
  694    HZ3  LYS   7           HZ3      LYS   7 318.014   0.221   8.432
  695    H    GLU   8           H        GLU   8 316.452  -1.852   4.732
  696    HA   GLU   8           HA       GLU   8 317.224  -3.381   3.216
  697    HB2  GLU   8           HB2      GLU   8 317.752  -4.534   5.604
  698    HB3  GLU   8           HB3      GLU   8 316.639  -5.722   4.942
  699    HG2  GLU   8           HG2      GLU   8 318.901  -4.770   3.259
  700    HG3  GLU   8           HG3      GLU   8 319.217  -5.923   4.555
  701    H    GLY   9           H        GLY   9 314.958  -2.613   2.382
  702    HA2  GLY   9           HA2      GLY   9 313.272  -4.995   2.075
  703    HA3  GLY   9           HA3      GLY   9 312.600  -3.385   2.195
  704    H    VAL  10           H        VAL  10 315.436  -4.263   0.424
  705    HA   VAL  10           HA       VAL  10 314.538  -3.070  -1.997
  706    HB   VAL  10           HB       VAL  10 316.886  -3.087  -1.482
  707   HG11  VAL  10          HG11      VAL  10 317.545  -5.843  -1.919
  708   HG12  VAL  10          HG12      VAL  10 316.371  -5.704  -0.607
  709   HG13  VAL  10          HG13      VAL  10 317.893  -4.815  -0.528
  710   HG21  VAL  10          HG21      VAL  10 316.829  -5.044  -3.724
  711   HG22  VAL  10          HG22      VAL  10 317.677  -3.503  -3.590
  712   HG23  VAL  10          HG23      VAL  10 315.944  -3.531  -3.916
  713    H    LYS  11           H        LYS  11 312.714  -4.025  -2.821
  714    HA   LYS  11           HA       LYS  11 312.956  -6.874  -3.501
  715    HB2  LYS  11           HB2      LYS  11 310.618  -5.218  -2.842
  716    HB3  LYS  11           HB3      LYS  11 310.426  -6.564  -3.942
  717    HG2  LYS  11           HG2      LYS  11 310.148  -7.735  -2.078
  718    HG3  LYS  11           HG3      LYS  11 311.891  -7.755  -2.069
  719    HD2  LYS  11           HD2      LYS  11 311.063  -7.148   0.118
  720    HD3  LYS  11           HD3      LYS  11 311.922  -5.801  -0.629
  721    HE2  LYS  11           HE2      LYS  11 309.755  -4.850  -1.325
  722    HE3  LYS  11           HE3      LYS  11 308.934  -6.155  -0.473
  723    HZ1  LYS  11           HZ3      LYS  11 310.348  -5.319   1.514
  724    H    THR  12           H        THR  12 314.313  -6.074  -5.304
  725    HA   THR  12           HA       THR  12 314.441  -6.115  -7.589
  726    HB   THR  12           HB       THR  12 312.600  -6.248  -8.978
  727    HG1  THR  12           HG1      THR  12 311.228  -4.684  -8.860
  728   HG21  THR  12          HG21      THR  12 311.233  -7.832  -8.083
  729   HG22  THR  12          HG22      THR  12 311.070  -6.988  -6.536
  730   HG23  THR  12          HG23      THR  12 312.561  -7.856  -6.921
  731    H    GLU  13           H        GLU  13 312.116  -3.516  -6.785
  732    HA   GLU  13           HA       GLU  13 313.793  -1.364  -6.777
  733    HB2  GLU  13           HB2      GLU  13 313.119  -0.590  -9.226
  734    HB3  GLU  13           HB3      GLU  13 314.599  -1.471  -8.920
  735    HG2  GLU  13           HG2      GLU  13 313.862  -3.325  -9.991
  736    HG3  GLU  13           HG3      GLU  13 312.184  -3.063  -9.521
  737    H    ASN  14           H        ASN  14 312.435   0.632  -8.025
  738    HA   ASN  14           HA       ASN  14 310.683   2.022  -7.582
  739    HB2  ASN  14           HB2      ASN  14 309.984   0.751  -9.569
  740    HB3  ASN  14           HB3      ASN  14 309.111  -0.335  -8.501
  741   HD21  ASN  14          HD21      ASN  14 309.259   2.871  -9.821
  742   HD22  ASN  14          HD22      ASN  14 307.647   3.335  -9.409
  743    H    ASP  15           H        ASP  15 311.530   0.793  -5.261
  744    HA   ASP  15           HA       ASP  15 309.108   0.957  -3.663
  745    HB2  ASP  15           HB2      ASP  15 310.677  -1.521  -4.063
  746    HB3  ASP  15           HB3      ASP  15 310.275  -1.140  -2.392
  747    H    HIS  16           H        HIS  16 310.742   2.920  -3.728
  748    HA   HIS  16           HA       HIS  16 312.789   3.798  -2.921
  749    HB2  HIS  16           HB2      HIS  16 310.756   4.063  -0.751
  750    HB3  HIS  16           HB3      HIS  16 312.081   5.135  -1.102
  751    HD1  HIS  16           HD1      HIS  16 308.627   4.352  -2.163
  752    HD2  HIS  16           HD2      HIS  16 311.800   6.761  -3.373
  753    HE1  HIS  16           HE1      HIS  16 307.638   5.986  -3.798
  754    HE2  HIS  16           HE2      HIS  16 309.584   7.387  -4.572
  755    H    ILE  17           H        ILE  17 314.530   3.506  -1.894
  756    HA   ILE  17           HA       ILE  17 314.611   1.874   0.544
  757    HB   ILE  17           HB       ILE  17 316.829   1.025  -0.069
  758   HG12  ILE  17          HG12      ILE  17 316.297   2.190  -2.786
  759   HG13  ILE  17          HG13      ILE  17 317.433   2.855  -1.640
  760   HG21  ILE  17          HG21      ILE  17 315.872  -0.803  -0.902
  761   HG22  ILE  17          HG22      ILE  17 315.484   0.014  -2.418
  762   HG23  ILE  17          HG23      ILE  17 314.381   0.129  -1.046
  763   HD11  ILE  17          HD11      ILE  17 319.013   1.342  -2.109
  764   HD12  ILE  17          HD12      ILE  17 318.112   1.176  -3.620
  765   HD13  ILE  17          HD13      ILE  17 317.847   0.028  -2.304
  766    H    ASN  18           H        ASN  18 316.654   2.329   1.762
  767    HA   ASN  18           HA       ASN  18 317.171   5.191   1.603
  768    HB2  ASN  18           HB2      ASN  18 318.581   4.331   3.810
  769    HB3  ASN  18           HB3      ASN  18 316.954   5.003   3.849
  770   HD21  ASN  18          HD21      ASN  18 318.611   2.811   5.290
  771   HD22  ASN  18          HD22      ASN  18 317.485   1.507   5.420
  772    H    LEU  19           H        LEU  19 319.246   5.965   1.305
  773    HA   LEU  19           HA       LEU  19 321.244   3.980   0.548
  774    HB2  LEU  19           HB2      LEU  19 320.123   6.142  -1.049
  775    HB3  LEU  19           HB3      LEU  19 321.864   6.283  -0.922
  776    HG   LEU  19           HG       LEU  19 320.262   3.971  -2.023
  777   HD11  LEU  19          HD11      LEU  19 322.417   5.705  -3.172
  778   HD12  LEU  19          HD12      LEU  19 320.709   5.717  -3.593
  779   HD13  LEU  19          HD13      LEU  19 321.698   4.314  -3.977
  780   HD21  LEU  19          HD21      LEU  19 323.043   3.460  -2.277
  781   HD22  LEU  19          HD22      LEU  19 321.812   2.504  -1.449
  782   HD23  LEU  19          HD23      LEU  19 322.703   3.753  -0.570
  783    H    LYS  20           H        LYS  20 323.454   4.868   0.582
  784    HA   LYS  20           HA       LYS  20 323.772   6.927   2.663
  785    HB2  LYS  20           HB2      LYS  20 324.346   4.157   2.877
  786    HB3  LYS  20           HB3      LYS  20 325.858   4.987   2.846
  787    HG2  LYS  20           HG2      LYS  20 325.281   6.271   4.688
  788    HG3  LYS  20           HG3      LYS  20 323.618   5.811   4.595
  789    HD2  LYS  20           HD2      LYS  20 325.873   4.459   5.867
  790    HD3  LYS  20           HD3      LYS  20 324.155   4.414   6.265
  791    HE2  LYS  20           HE2      LYS  20 323.734   2.719   4.696
  792    HE3  LYS  20           HE3      LYS  20 325.305   2.940   3.918
  793    HZ1  LYS  20           HZ1      LYS  20 326.341   1.702   5.461
  794    HZ2  LYS  20           HZ2      LYS  20 324.804   1.038   5.700
  795    HZ3  LYS  20           HZ3      LYS  20 325.372   2.248   6.736
  796    H    VAL  21           H        VAL  21 325.440   8.387   2.134
  797    HA   VAL  21           HA       VAL  21 327.178   7.613  -0.098
  798    HB   VAL  21           HB       VAL  21 326.481  10.483   0.463
  799   HG11  VAL  21          HG11      VAL  21 327.072   9.157  -2.162
  800   HG12  VAL  21          HG12      VAL  21 328.357   9.666  -1.068
  801   HG13  VAL  21          HG13      VAL  21 327.231  10.857  -1.719
  802   HG21  VAL  21          HG21      VAL  21 324.359   9.127   0.150
  803   HG22  VAL  21          HG22      VAL  21 324.945   8.741  -1.464
  804   HG23  VAL  21          HG23      VAL  21 324.617  10.415  -1.028
  805    H    ALA  22           H        ALA  22 329.317   7.687   0.361
  806    HA   ALA  22           HA       ALA  22 330.062   8.723   2.995
  807    HB1  ALA  22           HB1      ALA  22 330.719   6.387   1.614
  808    HB2  ALA  22           HB2      ALA  22 331.367   6.947   3.158
  809    HB3  ALA  22           HB3      ALA  22 332.198   7.350   1.653
  810    H    GLY  23           H        GLY  23 330.642  10.782   2.967
  811    HA2  GLY  23           HA2      GLY  23 332.143  11.823   0.678
  812    HA3  GLY  23           HA3      GLY  23 331.352  12.787   1.894
  813    H    GLN  24           H        GLN  24 333.860  13.417   1.113
  814    HA   GLN  24           HA       GLN  24 336.022  12.263   2.392
  815    HB2  GLN  24           HB2      GLN  24 335.837  15.228   2.137
  816    HB3  GLN  24           HB3      GLN  24 337.225  14.187   1.906
  817    HG2  GLN  24           HG2      GLN  24 335.726  13.274  -0.074
  818    HG3  GLN  24           HG3      GLN  24 335.060  14.904   0.030
  819   HE21  GLN  24          HE21      GLN  24 337.381  13.037  -1.378
  820   HE22  GLN  24          HE22      GLN  24 338.492  14.271  -1.854
  821    H    ASP  25           H        ASP  25 333.402  13.887   3.811
  822    HA   ASP  25           HA       ASP  25 334.549  15.140   6.005
  823    HB2  ASP  25           HB2      ASP  25 332.128  15.203   5.219
  824    HB3  ASP  25           HB3      ASP  25 331.909  13.704   6.115
  825    H    GLY  26           H        GLY  26 334.826  11.894   5.318
  826    HA2  GLY  26           HA2      GLY  26 335.682  10.164   6.571
  827    HA3  GLY  26           HA3      GLY  26 335.903  11.310   7.890
  828    H    SER  27           H        SER  27 333.026  10.232   6.132
  829    HA   SER  27           HA       SER  27 331.987   8.625   8.224
  830    HB2  SER  27           HB2      SER  27 331.809  11.034   9.151
  831    HB3  SER  27           HB3      SER  27 330.532  11.251   7.954
  832    HG   SER  27           HG       SER  27 329.522  10.555   9.771
  833    H    VAL  28           H        VAL  28 329.222   9.408   7.681
  834    HA   VAL  28           HA       VAL  28 328.961   8.866   4.837
  835    HB   VAL  28           HB       VAL  28 329.151   6.648   5.703
  836   HG11  VAL  28          HG11      VAL  28 327.904   5.785   7.543
  837   HG12  VAL  28          HG12      VAL  28 326.953   7.266   7.664
  838   HG13  VAL  28          HG13      VAL  28 328.677   7.286   8.062
  839   HG21  VAL  28          HG21      VAL  28 327.294   7.174   4.056
  840   HG22  VAL  28          HG22      VAL  28 326.178   7.095   5.422
  841   HG23  VAL  28          HG23      VAL  28 327.112   5.671   4.957
  842    H    VAL  29           H        VAL  29 326.775   9.027   4.110
  843    HA   VAL  29           HA       VAL  29 324.967  10.464   5.919
  844    HB   VAL  29           HB       VAL  29 324.153  11.561   3.666
  845   HG11  VAL  29          HG11      VAL  29 324.894  12.716   5.688
  846   HG12  VAL  29          HG12      VAL  29 325.412  13.541   4.213
  847   HG13  VAL  29          HG13      VAL  29 326.567  12.581   5.140
  848   HG21  VAL  29          HG21      VAL  29 325.804  11.972   2.062
  849   HG22  VAL  29          HG22      VAL  29 325.916  10.255   2.417
  850   HG23  VAL  29          HG23      VAL  29 327.090  11.371   3.108
  851    H    GLN  30           H        GLN  30 322.755  10.113   5.440
  852    HA   GLN  30           HA       GLN  30 322.377   7.653   3.871
  853    HB2  GLN  30           HB2      GLN  30 321.710   8.354   6.550
  854    HB3  GLN  30           HB3      GLN  30 320.295   7.758   5.703
  855    HG2  GLN  30           HG2      GLN  30 321.729   5.788   5.038
  856    HG3  GLN  30           HG3      GLN  30 322.932   6.397   6.183
  857   HE21  GLN  30          HE21      GLN  30 319.725   5.047   5.828
  858   HE22  GLN  30          HE22      GLN  30 319.538   4.552   7.473
  859    H    PHE  31           H        PHE  31 321.193   7.770   2.211
  860    HA   PHE  31           HA       PHE  31 319.263   9.918   1.777
  861    HB2  PHE  31           HB2      PHE  31 320.810   8.098  -0.101
  862    HB3  PHE  31           HB3      PHE  31 319.636   9.253  -0.635
  863    HD1  PHE  31           HD1      PHE  31 322.406   9.390   1.837
  864    HD2  PHE  31           HD2      PHE  31 320.622  11.092  -1.625
  865    HE1  PHE  31           HE1      PHE  31 324.091  11.154   1.835
  866    HE2  PHE  31           HE2      PHE  31 322.336  12.851  -1.626
  867    HZ   PHE  31           HZ       PHE  31 324.071  12.892   0.106
  868    H    LYS  32           H        LYS  32 317.423   9.221   0.287
  869    HA   LYS  32           HA       LYS  32 316.666   6.426   0.677
  870    HB2  LYS  32           HB2      LYS  32 315.324   7.513   2.357
  871    HB3  LYS  32           HB3      LYS  32 314.858   8.768   1.238
  872    HG2  LYS  32           HG2      LYS  32 313.947   6.617  -0.092
  873    HG3  LYS  32           HG3      LYS  32 313.779   6.050   1.571
  874    HD2  LYS  32           HD2      LYS  32 312.793   8.595   1.731
  875    HD3  LYS  32           HD3      LYS  32 312.286   8.110   0.112
  876    HE2  LYS  32           HE2      LYS  32 311.864   6.033   2.107
  877    HE3  LYS  32           HE3      LYS  32 310.989   7.519   2.470
  878    HZ1  LYS  32           HZ1      LYS  32 310.847   6.587  -0.280
  879    HZ2  LYS  32           HZ2      LYS  32 309.646   7.267   0.697
  880    HZ3  LYS  32           HZ3      LYS  32 310.047   5.633   0.866
  881    H    ILE  33           H        ILE  33 316.735   5.700  -1.280
  882    HA   ILE  33           HA       ILE  33 315.488   7.303  -3.388
  883    HB   ILE  33           HB       ILE  33 317.935   7.491  -3.494
  884   HG12  ILE  33          HG12      ILE  33 317.150   5.645  -5.741
  885   HG13  ILE  33          HG13      ILE  33 316.399   7.225  -5.584
  886   HG21  ILE  33          HG21      ILE  33 318.994   5.727  -2.624
  887   HG22  ILE  33          HG22      ILE  33 318.984   5.153  -4.294
  888   HG23  ILE  33          HG23      ILE  33 317.768   4.575  -3.157
  889   HD11  ILE  33          HD11      ILE  33 318.236   7.318  -7.135
  890   HD12  ILE  33          HD12      ILE  33 319.335   6.684  -5.911
  891   HD13  ILE  33          HD13      ILE  33 318.605   8.275  -5.701
  892    H    LYS  34           H        LYS  34 314.156   6.306  -4.668
  893    HA   LYS  34           HA       LYS  34 313.049   3.859  -4.079
  894    HB2  LYS  34           HB2      LYS  34 311.710   5.359  -5.249
  895    HB3  LYS  34           HB3      LYS  34 312.936   5.623  -6.464
  896    HG2  LYS  34           HG2      LYS  34 312.493   3.045  -6.918
  897    HG3  LYS  34           HG3      LYS  34 310.929   3.476  -6.232
  898    HD2  LYS  34           HD2      LYS  34 310.681   3.809  -8.544
  899    HD3  LYS  34           HD3      LYS  34 310.950   5.427  -7.889
  900    HE2  LYS  34           HE2      LYS  34 313.387   5.123  -8.426
  901    HE3  LYS  34           HE3      LYS  34 312.939   3.652  -9.283
  902    HZ1  LYS  34           HZ1      LYS  34 312.240   6.443  -9.943
  903    HZ2  LYS  34           HZ2      LYS  34 311.361   5.144 -10.577
  904    HZ3  LYS  34           HZ3      LYS  34 313.009   5.295 -10.915
  905    H    ARG  35           H        ARG  35 315.342   4.653  -6.643
  906    HA   ARG  35           HA       ARG  35 317.108   2.796  -6.802
  907    HB2  ARG  35           HB2      ARG  35 314.564   1.342  -7.512
  908    HB3  ARG  35           HB3      ARG  35 316.141   0.788  -8.021
  909    HG2  ARG  35           HG2      ARG  35 315.997   1.299  -5.165
  910    HG3  ARG  35           HG3      ARG  35 314.861   0.079  -5.734
  911    HD2  ARG  35           HD2      ARG  35 317.842   0.094  -6.069
  912    HD3  ARG  35           HD3      ARG  35 316.872  -0.997  -5.080
  913    HE   ARG  35           HE       ARG  35 316.154  -1.121  -7.832
  914   HH11  ARG  35          HH11      ARG  35 318.432  -2.276  -5.456
  915   HH12  ARG  35          HH12      ARG  35 318.847  -3.694  -6.359
  916   HH21  ARG  35          HH21      ARG  35 316.712  -2.982  -9.029
  917   HH22  ARG  35          HH22      ARG  35 317.873  -4.094  -8.384
  918    H    HIS  36           H        HIS  36 314.447   2.537  -9.126
  919    HA   HIS  36           HA       HIS  36 316.016   2.891 -11.413
  920    HB2  HIS  36           HB2      HIS  36 313.803   1.816 -11.384
  921    HB3  HIS  36           HB3      HIS  36 313.052   3.376 -11.086
  922    HD1  HIS  36           HD1      HIS  36 313.880   1.134 -13.757
  923    HD2  HIS  36           HD2      HIS  36 313.655   5.247 -13.307
  924    HE1  HIS  36           HE1      HIS  36 313.681   2.048 -16.092
  925    HE2  HIS  36           HE2      HIS  36 313.639   4.552 -15.802
  926    H    THR  37           H        THR  37 315.241   5.222  -9.173
  927    HA   THR  37           HA       THR  37 315.065   7.426 -11.068
  928    HB   THR  37           HB       THR  37 315.202   7.374  -8.058
  929    HG1  THR  37           HG1      THR  37 313.152   8.296  -9.780
  930   HG21  THR  37          HG21      THR  37 315.792   9.505  -8.023
  931   HG22  THR  37          HG22      THR  37 314.367   9.906  -8.980
  932   HG23  THR  37          HG23      THR  37 315.899   9.537  -9.785
  933    HA   PRO  38           HA       PRO  38 319.394   7.779 -11.978
  934    HB2  PRO  38           HB2      PRO  38 318.652  10.632 -11.831
  935    HB3  PRO  38           HB3      PRO  38 319.410   9.732 -13.154
  936    HG2  PRO  38           HG2      PRO  38 316.681  10.458 -12.914
  937    HG3  PRO  38           HG3      PRO  38 317.401   9.398 -14.132
  938    HD2  PRO  38           HD2      PRO  38 315.587   8.707 -12.126
  939    HD3  PRO  38           HD3      PRO  38 316.516   7.593 -13.138
  940    H    LEU  39           H        LEU  39 321.203   8.210 -10.739
  941    HA   LEU  39           HA       LEU  39 320.758   8.736  -7.994
  942    HB2  LEU  39           HB2      LEU  39 323.183   8.259  -9.649
  943    HB3  LEU  39           HB3      LEU  39 323.371   8.919  -8.030
  944    HG   LEU  39           HG       LEU  39 321.829   6.394  -8.601
  945   HD11  LEU  39          HD11      LEU  39 324.656   6.819  -8.630
  946   HD12  LEU  39          HD12      LEU  39 323.744   5.348  -8.955
  947   HD13  LEU  39          HD13      LEU  39 324.210   5.755  -7.302
  948   HD21  LEU  39          HD21      LEU  39 323.081   6.792  -5.992
  949   HD22  LEU  39          HD22      LEU  39 321.442   6.284  -6.397
  950   HD23  LEU  39          HD23      LEU  39 321.854   7.998  -6.379
  951    H    SER  40           H        SER  40 321.360  10.888 -10.689
  952    HA   SER  40           HA       SER  40 322.634  12.986  -9.456
  953    HB2  SER  40           HB2      SER  40 322.250  13.848 -11.494
  954    HB3  SER  40           HB3      SER  40 321.094  12.560 -11.829
  955    HG   SER  40           HG       SER  40 319.471  13.853 -11.301
  956    H    LYS  41           H        LYS  41 319.485  11.717  -8.883
  957    HA   LYS  41           HA       LYS  41 318.302  13.977  -7.660
  958    HB2  LYS  41           HB2      LYS  41 317.780  11.089  -7.908
  959    HB3  LYS  41           HB3      LYS  41 316.918  11.987  -6.690
  960    HG2  LYS  41           HG2      LYS  41 315.496  12.091  -8.491
  961    HG3  LYS  41           HG3      LYS  41 316.363  13.607  -8.621
  962    HD2  LYS  41           HD2      LYS  41 317.589  12.924 -10.432
  963    HD3  LYS  41           HD3      LYS  41 317.451  11.215 -10.015
  964    HE2  LYS  41           HE2      LYS  41 316.124  12.204 -12.043
  965    HE3  LYS  41           HE3      LYS  41 315.392  11.001 -10.986
  966    HZ1  LYS  41           HZ1      LYS  41 314.103  13.150 -11.605
  967    HZ2  LYS  41           HZ2      LYS  41 315.032  13.853 -10.379
  968    HZ3  LYS  41           HZ3      LYS  41 314.018  12.546 -10.026
  969    H    LEU  42           H        LEU  42 320.328  11.349  -6.795
  970    HA   LEU  42           HA       LEU  42 320.213  11.630  -3.941
  971    HB2  LEU  42           HB2      LEU  42 320.550   9.527  -5.373
  972    HB3  LEU  42           HB3      LEU  42 322.190  10.087  -5.608
  973    HG   LEU  42           HG       LEU  42 321.225   9.760  -2.807
  974   HD11  LEU  42          HD11      LEU  42 322.347   7.388  -4.140
  975   HD12  LEU  42          HD12      LEU  42 320.649   7.758  -4.443
  976   HD13  LEU  42          HD13      LEU  42 321.218   7.514  -2.792
  977   HD21  LEU  42          HD21      LEU  42 323.760   9.767  -4.344
  978   HD22  LEU  42          HD22      LEU  42 323.674   8.721  -2.924
  979   HD23  LEU  42          HD23      LEU  42 323.397  10.456  -2.759
  980    H    MET  43           H        MET  43 322.465  12.425  -6.570
  981    HA   MET  43           HA       MET  43 324.710  13.164  -5.132
  982    HB2  MET  43           HB2      MET  43 323.627  14.406  -7.650
  983    HB3  MET  43           HB3      MET  43 325.245  14.681  -7.018
  984    HG2  MET  43           HG2      MET  43 324.642  11.849  -7.245
  985    HG3  MET  43           HG3      MET  43 324.440  12.682  -8.783
  986    HE1  MET  43           HE1      MET  43 327.085  11.316  -9.966
  987    HE2  MET  43           HE2      MET  43 325.913  10.596  -8.856
  988    HE3  MET  43           HE3      MET  43 327.634  10.539  -8.476
  989    H    LYS  44           H        LYS  44 321.938  15.139  -6.038
  990    HA   LYS  44           HA       LYS  44 322.977  17.542  -4.997
  991    HB2  LYS  44           HB2      LYS  44 321.338  17.519  -6.729
  992    HB3  LYS  44           HB3      LYS  44 320.161  16.812  -5.643
  993    HG2  LYS  44           HG2      LYS  44 319.546  18.909  -5.339
  994    HG3  LYS  44           HG3      LYS  44 320.852  18.951  -4.212
  995    HD2  LYS  44           HD2      LYS  44 320.486  20.878  -5.893
  996    HD3  LYS  44           HD3      LYS  44 322.111  20.320  -5.522
  997    HE2  LYS  44           HE2      LYS  44 322.438  19.926  -7.696
  998    HE3  LYS  44           HE3      LYS  44 321.108  18.790  -7.707
  999    HZ1  LYS  44           HZ1      LYS  44 321.149  20.994  -9.170
 1000    HZ2  LYS  44           HZ2      LYS  44 320.377  21.593  -7.789
 1001    HZ3  LYS  44           HZ3      LYS  44 319.717  20.278  -8.622
 1002    H    ALA  45           H        ALA  45 321.366  14.899  -3.419
 1003    HA   ALA  45           HA       ALA  45 320.398  16.443  -1.213
 1004    HB1  ALA  45           HB1      ALA  45 321.018  13.977  -0.119
 1005    HB2  ALA  45           HB2      ALA  45 320.626  13.602  -1.809
 1006    HB3  ALA  45           HB3      ALA  45 319.457  14.456  -0.804
 1007    H    TYR  46           H        TYR  46 323.284  14.413  -1.684
 1008    HA   TYR  46           HA       TYR  46 324.562  15.038   0.668
 1009    HB2  TYR  46           HB2      TYR  46 325.287  13.470  -1.363
 1010    HB3  TYR  46           HB3      TYR  46 326.312  14.860  -1.716
 1011    HD1  TYR  46           HD1      TYR  46 325.633  14.672   1.757
 1012    HD2  TYR  46           HD2      TYR  46 328.097  13.011  -1.289
 1013    HE1  TYR  46           HE1      TYR  46 327.188  13.904   3.460
 1014    HE2  TYR  46           HE2      TYR  46 329.671  12.212   0.426
 1015    HH   TYR  46           HH       TYR  46 328.932  12.269   3.781
 1016    H    CYS  47           H        CYS  47 325.052  16.728  -2.499
 1017    HA   CYS  47           HA       CYS  47 326.730  18.686  -1.704
 1018    HB2  CYS  47           HB2      CYS  47 324.370  18.558  -3.557
 1019    HB3  CYS  47           HB3      CYS  47 325.302  20.037  -3.417
 1020    HG   CYS  47           HG       CYS  47 326.883  19.039  -4.985
 1021    H    GLU  48           H        GLU  48 323.180  19.165  -1.874
 1022    HA   GLU  48           HA       GLU  48 323.043  21.500  -0.406
 1023    HB2  GLU  48           HB2      GLU  48 320.943  19.346  -0.161
 1024    HB3  GLU  48           HB3      GLU  48 320.722  21.087  -0.097
 1025    HG2  GLU  48           HG2      GLU  48 320.960  21.308  -2.436
 1026    HG3  GLU  48           HG3      GLU  48 321.667  19.714  -2.589
 1027    H    ARG  49           H        ARG  49 323.730  18.305   0.660
 1028    HA   ARG  49           HA       ARG  49 323.133  18.651   3.437
 1029    HB2  ARG  49           HB2      ARG  49 323.949  16.581   1.597
 1030    HB3  ARG  49           HB3      ARG  49 324.885  16.509   3.056
 1031    HG2  ARG  49           HG2      ARG  49 323.043  15.955   4.344
 1032    HG3  ARG  49           HG3      ARG  49 321.914  16.643   3.174
 1033    HD2  ARG  49           HD2      ARG  49 323.425  14.568   1.909
 1034    HD3  ARG  49           HD3      ARG  49 322.748  13.956   3.394
 1035    HE   ARG  49           HE       ARG  49 320.992  15.312   1.501
 1036   HH11  ARG  49          HH11      ARG  49 321.944  12.419   3.229
 1037   HH12  ARG  49          HH12      ARG  49 320.491  11.564   2.844
 1038   HH21  ARG  49          HH21      ARG  49 319.079  14.161   0.997
 1039   HH22  ARG  49          HH22      ARG  49 318.879  12.542   1.575
 1040    H    GLN  50           H        GLN  50 326.041  18.471   1.407
 1041    HA   GLN  50           HA       GLN  50 327.739  19.336   3.629
 1042    HB2  GLN  50           HB2      GLN  50 328.530  18.216   0.991
 1043    HB3  GLN  50           HB3      GLN  50 329.588  18.485   2.339
 1044    HG2  GLN  50           HG2      GLN  50 328.184  16.808   3.607
 1045    HG3  GLN  50           HG3      GLN  50 327.430  16.432   2.055
 1046   HE21  GLN  50          HE21      GLN  50 328.696  15.568   0.394
 1047   HE22  GLN  50          HE22      GLN  50 330.188  14.761   0.715
 1048    H    GLY  51           H        GLY  51 326.393  20.509   0.734
 1049    HA2  GLY  51           HA2      GLY  51 326.554  22.662  -0.156
 1050    HA3  GLY  51           HA3      GLY  51 327.896  22.984   0.940
 1051    H    LEU  52           H        LEU  52 327.229  20.606  -1.616
 1052    HA   LEU  52           HA       LEU  52 329.886  21.182  -2.785
 1053    HB2  LEU  52           HB2      LEU  52 328.416  18.624  -3.220
 1054    HB3  LEU  52           HB3      LEU  52 330.121  18.953  -3.331
 1055    HG   LEU  52           HG       LEU  52 328.992  19.269  -0.650
 1056   HD11  LEU  52          HD11      LEU  52 328.108  17.089  -2.113
 1057   HD12  LEU  52          HD12      LEU  52 328.150  17.240  -0.344
 1058   HD13  LEU  52          HD13      LEU  52 329.493  16.475  -1.196
 1059   HD21  LEU  52          HD21      LEU  52 331.385  19.395  -1.521
 1060   HD22  LEU  52          HD22      LEU  52 331.312  17.625  -1.567
 1061   HD23  LEU  52          HD23      LEU  52 331.082  18.478  -0.034
 1062    H    SER  53           H        SER  53 330.086  20.897  -5.076
 1063    HA   SER  53           HA       SER  53 327.814  21.802  -6.576
 1064    HB2  SER  53           HB2      SER  53 329.852  20.710  -8.289
 1065    HB3  SER  53           HB3      SER  53 329.418  22.401  -8.044
 1066    HG   SER  53           HG       SER  53 331.231  22.599  -7.027
 1067    H    MET  54           H        MET  54 326.200  20.482  -7.118
 1068    HA   MET  54           HA       MET  54 326.329  17.648  -6.847
 1069    HB2  MET  54           HB2      MET  54 324.180  19.379  -8.161
 1070    HB3  MET  54           HB3      MET  54 323.960  17.701  -7.703
 1071    HG2  MET  54           HG2      MET  54 322.969  18.914  -6.061
 1072    HG3  MET  54           HG3      MET  54 324.476  18.319  -5.413
 1073    HE1  MET  54           HE1      MET  54 324.509  22.630  -7.059
 1074    HE2  MET  54           HE2      MET  54 323.078  21.641  -7.337
 1075    HE3  MET  54           HE3      MET  54 324.639  21.136  -7.989
 1076    H    ARG  55           H        ARG  55 328.313  17.942  -8.374
 1077    HA   ARG  55           HA       ARG  55 327.879  16.429 -10.660
 1078    HB2  ARG  55           HB2      ARG  55 328.635  18.367 -12.269
 1079    HB3  ARG  55           HB3      ARG  55 326.933  18.152 -11.882
 1080    HG2  ARG  55           HG2      ARG  55 326.979  19.954 -10.313
 1081    HG3  ARG  55           HG3      ARG  55 328.741  20.065 -10.421
 1082    HD2  ARG  55           HD2      ARG  55 326.689  20.792 -12.496
 1083    HD3  ARG  55           HD3      ARG  55 327.891  21.832 -11.739
 1084    HE   ARG  55           HE       ARG  55 328.492  19.717 -13.704
 1085   HH11  ARG  55          HH11      ARG  55 329.278  22.760 -12.163
 1086   HH12  ARG  55          HH12      ARG  55 330.622  23.074 -13.204
 1087   HH21  ARG  55          HH21      ARG  55 330.261  20.140 -15.062
 1088   HH22  ARG  55          HH22      ARG  55 331.181  21.591 -14.846
 1089    H    GLN  56           H        GLN  56 329.847  18.837  -8.949
 1090    HA   GLN  56           HA       GLN  56 332.278  18.052 -10.207
 1091    HB2  GLN  56           HB2      GLN  56 331.566  19.831  -7.896
 1092    HB3  GLN  56           HB3      GLN  56 333.241  19.455  -8.277
 1093    HG2  GLN  56           HG2      GLN  56 333.051  20.463 -10.431
 1094    HG3  GLN  56           HG3      GLN  56 331.309  20.658 -10.242
 1095   HE21  GLN  56          HE21      GLN  56 330.956  22.765 -10.160
 1096   HE22  GLN  56          HE22      GLN  56 331.772  23.886  -9.129
 1097    H    ILE  57           H        ILE  57 330.486  16.963  -7.418
 1098    HA   ILE  57           HA       ILE  57 332.763  15.771  -6.159
 1099    HB   ILE  57           HB       ILE  57 331.016  14.216  -5.047
 1100   HG12  ILE  57          HG12      ILE  57 329.276  16.125  -6.493
 1101   HG13  ILE  57          HG13      ILE  57 328.945  14.494  -5.901
 1102   HG21  ILE  57          HG21      ILE  57 330.804  15.670  -3.244
 1103   HG22  ILE  57          HG22      ILE  57 330.924  17.096  -4.282
 1104   HG23  ILE  57          HG23      ILE  57 332.337  16.070  -4.025
 1105   HD11  ILE  57          HD11      ILE  57 327.580  16.048  -4.725
 1106   HD12  ILE  57          HD12      ILE  57 328.997  17.025  -4.303
 1107   HD13  ILE  57          HD13      ILE  57 328.800  15.404  -3.622
 1108    H    ARG  58           H        ARG  58 332.630  13.242  -5.772
 1109    HA   ARG  58           HA       ARG  58 332.064  12.011  -8.365
 1110    HB2  ARG  58           HB2      ARG  58 334.413  10.961  -6.961
 1111    HB3  ARG  58           HB3      ARG  58 334.181  11.316  -8.668
 1112    HG2  ARG  58           HG2      ARG  58 334.609  13.482  -6.633
 1113    HG3  ARG  58           HG3      ARG  58 335.945  12.656  -7.423
 1114    HD2  ARG  58           HD2      ARG  58 335.206  13.411  -9.562
 1115    HD3  ARG  58           HD3      ARG  58 333.734  14.073  -8.888
 1116    HE   ARG  58           HE       ARG  58 334.909  15.956  -8.378
 1117   HH11  ARG  58          HH11      ARG  58 337.175  13.332  -8.779
 1118   HH12  ARG  58          HH12      ARG  58 338.568  14.341  -8.586
 1119   HH21  ARG  58          HH21      ARG  58 336.741  17.285  -8.131
 1120   HH22  ARG  58          HH22      ARG  58 338.323  16.585  -8.220
 1121    H    PHE  59           H        PHE  59 330.628  10.442  -7.988
 1122    HA   PHE  59           HA       PHE  59 330.573   9.231  -5.327
 1123    HB2  PHE  59           HB2      PHE  59 328.512   9.302  -7.517
 1124    HB3  PHE  59           HB3      PHE  59 328.364   8.294  -6.111
 1125    HD1  PHE  59           HD1      PHE  59 329.885  11.560  -5.624
 1126    HD2  PHE  59           HD2      PHE  59 326.225   9.386  -5.677
 1127    HE1  PHE  59           HE1      PHE  59 328.786  13.380  -4.403
 1128    HE2  PHE  59           HE2      PHE  59 325.124  11.212  -4.458
 1129    HZ   PHE  59           HZ       PHE  59 326.405  13.215  -3.821
 1130    H    ARG  60           H        ARG  60 330.294   7.021  -5.068
 1131    HA   ARG  60           HA       ARG  60 330.697   5.230  -7.274
 1132    HB2  ARG  60           HB2      ARG  60 333.031   5.984  -6.495
 1133    HB3  ARG  60           HB3      ARG  60 332.690   5.062  -5.035
 1134    HG2  ARG  60           HG2      ARG  60 332.011   3.300  -6.990
 1135    HG3  ARG  60           HG3      ARG  60 333.379   4.139  -7.705
 1136    HD2  ARG  60           HD2      ARG  60 333.708   2.021  -6.220
 1137    HD3  ARG  60           HD3      ARG  60 334.840   3.362  -6.135
 1138    HE   ARG  60           HE       ARG  60 332.646   3.331  -4.217
 1139   HH11  ARG  60          HH11      ARG  60 336.030   2.718  -4.855
 1140   HH12  ARG  60          HH12      ARG  60 336.467   2.706  -3.181
 1141   HH21  ARG  60          HH21      ARG  60 333.228   3.301  -2.018
 1142   HH22  ARG  60          HH22      ARG  60 334.880   3.036  -1.573
 1143    H    PHE  61           H        PHE  61 329.530   3.452  -6.881
 1144    HA   PHE  61           HA       PHE  61 328.515   3.119  -4.169
 1145    HB2  PHE  61           HB2      PHE  61 326.738   3.135  -5.706
 1146    HB3  PHE  61           HB3      PHE  61 327.586   2.123  -6.860
 1147    HD1  PHE  61           HD2      PHE  61 325.930   2.207  -3.588
 1148    HD2  PHE  61           HD1      PHE  61 327.436  -0.254  -6.714
 1149    HE1  PHE  61           HE2      PHE  61 324.819   0.241  -2.603
 1150    HE2  PHE  61           HE1      PHE  61 326.333  -2.215  -5.728
 1151    HZ   PHE  61           HZ       PHE  61 325.020  -1.968  -3.660
 1152    H    ASP  62           H        ASP  62 328.652   0.965  -3.197
 1153    HA   ASP  62           HA       ASP  62 331.114  -0.051  -3.003
 1154    HB2  ASP  62           HB2      ASP  62 328.433  -1.091  -2.463
 1155    HB3  ASP  62           HB3      ASP  62 329.673  -2.327  -2.628
 1156    H    GLY  63           H        GLY  63 332.048  -0.015  -5.190
 1157    HA2  GLY  63           HA2      GLY  63 333.093  -1.975  -6.317
 1158    HA3  GLY  63           HA3      GLY  63 331.457  -2.513  -6.649
 1159    H    GLN  64           H        GLN  64 330.637   0.328  -7.289
 1160    HA   GLN  64           HA       GLN  64 332.158   0.733  -9.765
 1161    HB2  GLN  64           HB2      GLN  64 330.569   0.002 -11.111
 1162    HB3  GLN  64           HB3      GLN  64 329.702  -0.578  -9.696
 1163    HG2  GLN  64           HG2      GLN  64 329.153   2.157  -9.870
 1164    HG3  GLN  64           HG3      GLN  64 329.032   1.537 -11.496
 1165   HE21  GLN  64          HE21      GLN  64 328.081   0.760  -8.199
 1166   HE22  GLN  64          HE22      GLN  64 326.518   0.145  -8.591
 1167    HA   PRO  65           HA       PRO  65 331.412   5.062  -9.055
 1168    HB2  PRO  65           HB2      PRO  65 331.938   5.522 -11.869
 1169    HB3  PRO  65           HB3      PRO  65 333.022   5.820 -10.510
 1170    HG2  PRO  65           HG2      PRO  65 333.504   3.938 -12.380
 1171    HG3  PRO  65           HG3      PRO  65 333.962   3.709 -10.678
 1172    HD2  PRO  65           HD2      PRO  65 331.475   2.757 -12.090
 1173    HD3  PRO  65           HD3      PRO  65 332.614   1.834 -11.112
 1174    H    ILE  66           H        ILE  66 329.542   6.304  -9.147
 1175    HA   ILE  66           HA       ILE  66 327.613   5.498 -11.192
 1176    HB   ILE  66           HB       ILE  66 325.871   6.091  -9.811
 1177   HG12  ILE  66          HG12      ILE  66 327.949   7.528  -8.318
 1178   HG13  ILE  66          HG13      ILE  66 326.240   7.851  -8.494
 1179   HG21  ILE  66          HG21      ILE  66 327.296   3.923  -9.551
 1180   HG22  ILE  66          HG22      ILE  66 326.034   4.283  -8.361
 1181   HG23  ILE  66          HG23      ILE  66 327.723   4.618  -7.982
 1182   HD11  ILE  66          HD11      ILE  66 327.661   6.293  -6.438
 1183   HD12  ILE  66          HD12      ILE  66 326.058   5.735  -6.909
 1184   HD13  ILE  66          HD13      ILE  66 326.274   7.374  -6.288
 1185    H    ASN  67           H        ASN  67 328.580   6.751 -12.572
 1186    HA   ASN  67           HA       ASN  67 329.085   9.413 -12.750
 1187    HB2  ASN  67           HB2      ASN  67 327.668   8.140 -15.041
 1188    HB3  ASN  67           HB3      ASN  67 329.009   9.274 -15.077
 1189   HD21  ASN  67          HD21      ASN  67 328.311   6.292 -15.882
 1190   HD22  ASN  67          HD22      ASN  67 329.797   5.481 -15.537
 1191    H    GLU  68           H        GLU  68 327.222   9.916 -11.177
 1192    HA   GLU  68           HA       GLU  68 325.311  11.048 -10.667
 1193    HB2  GLU  68           HB2      GLU  68 326.296  12.943 -11.376
 1194    HB3  GLU  68           HB3      GLU  68 326.589  12.315 -12.992
 1195    HG2  GLU  68           HG2      GLU  68 324.109  12.530 -13.339
 1196    HG3  GLU  68           HG3      GLU  68 324.084  13.488 -11.884
 1197    H    THR  69           H        THR  69 325.099   9.392 -13.702
 1198    HA   THR  69           HA       THR  69 322.220   9.880 -13.771
 1199    HB   THR  69           HB       THR  69 322.251   9.186 -16.068
 1200    HG1  THR  69           HG1      THR  69 323.804   7.550 -15.967
 1201   HG21  THR  69          HG21      THR  69 324.705  10.723 -16.269
 1202   HG22  THR  69          HG22      THR  69 323.522  11.436 -15.169
 1203   HG23  THR  69          HG23      THR  69 323.078  11.094 -16.844
 1204    H    ASP  70           H        ASP  70 324.532   7.499 -12.982
 1205    HA   ASP  70           HA       ASP  70 323.089   5.153 -13.562
 1206    HB2  ASP  70           HB2      ASP  70 324.973   5.549 -11.242
 1207    HB3  ASP  70           HB3      ASP  70 324.640   4.073 -12.093
 1208    H    THR  71           H        THR  71 321.240   4.435 -12.642
 1209    HA   THR  71           HA       THR  71 320.381   5.707 -10.151
 1210    HB   THR  71           HB       THR  71 318.209   5.118 -10.660
 1211    HG1  THR  71           HG1      THR  71 318.833   3.174 -12.570
 1212   HG21  THR  71          HG21      THR  71 317.944   6.252 -12.545
 1213   HG22  THR  71          HG22      THR  71 318.535   4.879 -13.482
 1214   HG23  THR  71          HG23      THR  71 319.670   6.082 -12.869
 1215    HA   PRO  72           HA       PRO  72 321.687   2.454  -7.563
 1216    HB2  PRO  72           HB2      PRO  72 318.970   2.240  -6.412
 1217    HB3  PRO  72           HB3      PRO  72 320.521   2.584  -5.636
 1218    HG2  PRO  72           HG2      PRO  72 318.571   4.462  -6.180
 1219    HG3  PRO  72           HG3      PRO  72 320.272   4.809  -5.848
 1220    HD2  PRO  72           HD2      PRO  72 318.796   5.056  -8.331
 1221    HD3  PRO  72           HD3      PRO  72 320.419   5.633  -7.930
 1222    H    ALA  73           H        ALA  73 318.318   1.885  -8.633
 1223    HA   ALA  73           HA       ALA  73 318.310  -0.862  -8.726
 1224    HB1  ALA  73           HB1      ALA  73 317.006  -0.029 -11.099
 1225    HB2  ALA  73           HB2      ALA  73 316.731   1.214  -9.882
 1226    HB3  ALA  73           HB3      ALA  73 316.276  -0.457  -9.550
 1227    H    GLN  74           H        GLN  74 319.125   1.244 -11.469
 1228    HA   GLN  74           HA       GLN  74 319.832  -0.545 -13.336
 1229    HB2  GLN  74           HB2      GLN  74 320.429   2.164 -12.735
 1230    HB3  GLN  74           HB3      GLN  74 321.771   1.416 -13.545
 1231    HG2  GLN  74           HG2      GLN  74 320.482   0.907 -15.436
 1232    HG3  GLN  74           HG3      GLN  74 318.972   1.217 -14.578
 1233   HE21  GLN  74          HE21      GLN  74 318.340   2.652 -16.225
 1234   HE22  GLN  74          HE22      GLN  74 319.002   4.244 -16.335
 1235    H    LEU  75           H        LEU  75 321.796   0.489 -10.593
 1236    HA   LEU  75           HA       LEU  75 324.014  -1.170 -11.410
 1237    HB2  LEU  75           HB2      LEU  75 323.735   0.377  -8.842
 1238    HB3  LEU  75           HB3      LEU  75 325.206  -0.079  -9.676
 1239    HG   LEU  75           HG       LEU  75 323.285   2.138 -10.359
 1240   HD11  LEU  75          HD11      LEU  75 325.651   2.068  -8.968
 1241   HD12  LEU  75          HD12      LEU  75 324.901   3.490  -9.693
 1242   HD13  LEU  75          HD13      LEU  75 326.136   2.597 -10.579
 1243   HD21  LEU  75          HD21      LEU  75 325.154   2.236 -12.342
 1244   HD22  LEU  75          HD22      LEU  75 323.512   1.613 -12.520
 1245   HD23  LEU  75          HD23      LEU  75 324.849   0.503 -12.213
 1246    H    GLU  76           H        GLU  76 321.370  -1.116  -9.164
 1247    HA   GLU  76           HA       GLU  76 320.312  -2.906  -8.253
 1248    HB2  GLU  76           HB2      GLU  76 322.921  -4.414  -8.428
 1249    HB3  GLU  76           HB3      GLU  76 321.380  -5.068  -7.901
 1250    HG2  GLU  76           HG2      GLU  76 320.434  -4.860 -10.048
 1251    HG3  GLU  76           HG3      GLU  76 321.777  -3.874 -10.621
 1252    H    MET  77           H        MET  77 321.397  -0.734  -6.954
 1253    HA   MET  77           HA       MET  77 322.876  -1.328  -4.618
 1254    HB2  MET  77           HB2      MET  77 320.929   0.853  -5.329
 1255    HB3  MET  77           HB3      MET  77 321.800   0.831  -3.797
 1256    HG2  MET  77           HG2      MET  77 323.861   0.487  -5.422
 1257    HG3  MET  77           HG3      MET  77 322.787   1.309  -6.548
 1258    HE1  MET  77           HE1      MET  77 324.834   4.256  -5.975
 1259    HE2  MET  77           HE2      MET  77 323.193   4.176  -6.636
 1260    HE3  MET  77           HE3      MET  77 324.349   2.887  -6.980
 1261    H    GLU  78           H        GLU  78 321.649  -0.691  -2.395
 1262    HA   GLU  78           HA       GLU  78 319.084  -2.016  -2.182
 1263    HB2  GLU  78           HB2      GLU  78 321.648  -3.097  -1.072
 1264    HB3  GLU  78           HB3      GLU  78 320.145  -3.354  -0.201
 1265    HG2  GLU  78           HG2      GLU  78 319.514  -4.967  -1.581
 1266    HG3  GLU  78           HG3      GLU  78 319.880  -4.002  -3.005
 1267    H    ASP  79           H        ASP  79 318.453  -2.027   0.245
 1268    HA   ASP  79           HA       ASP  79 318.420   0.638   1.146
 1269    HB2  ASP  79           HB2      ASP  79 317.527  -1.987   2.235
 1270    HB3  ASP  79           HB3      ASP  79 317.593  -0.615   3.335
 1271    H    GLU  80           H        GLU  80 319.698   1.754   2.508
 1272    HA   GLU  80           HA       GLU  80 321.339   2.283   4.008
 1273    HB2  GLU  80           HB2      GLU  80 321.725  -0.632   4.612
 1274    HB3  GLU  80           HB3      GLU  80 322.054   0.753   5.638
 1275    HG2  GLU  80           HG2      GLU  80 319.654   1.204   5.796
 1276    HG3  GLU  80           HG3      GLU  80 319.333  -0.216   4.804
 1277    H    ASP  81           H        ASP  81 321.815   0.827   1.152
 1278    HA   ASP  81           HA       ASP  81 324.495  -0.017   1.325
 1279    HB2  ASP  81           HB2      ASP  81 322.911   1.042  -1.035
 1280    HB3  ASP  81           HB3      ASP  81 324.532   0.394  -1.166
 1281    H    THR  82           H        THR  82 326.275   1.239   0.229
 1282    HA   THR  82           HA       THR  82 326.055   4.075   1.026
 1283    HB   THR  82           HB       THR  82 328.671   2.592   0.958
 1284    HG1  THR  82           HG1      THR  82 327.147   2.980   3.301
 1285   HG21  THR  82          HG21      THR  82 327.712   5.050   2.403
 1286   HG22  THR  82          HG22      THR  82 328.836   5.002   1.033
 1287   HG23  THR  82          HG23      THR  82 329.307   4.315   2.593
 1288    H    ILE  83           H        ILE  83 327.442   5.584  -0.167
 1289    HA   ILE  83           HA       ILE  83 328.340   4.697  -2.795
 1290    HB   ILE  83           HB       ILE  83 326.316   6.862  -2.226
 1291   HG12  ILE  83          HG12      ILE  83 326.349   4.623  -4.263
 1292   HG13  ILE  83          HG13      ILE  83 325.503   4.566  -2.720
 1293   HG21  ILE  83          HG21      ILE  83 326.590   7.584  -4.581
 1294   HG22  ILE  83          HG22      ILE  83 327.970   6.500  -4.731
 1295   HG23  ILE  83          HG23      ILE  83 328.041   7.868  -3.624
 1296   HD11  ILE  83          HD11      ILE  83 324.893   6.176  -5.148
 1297   HD12  ILE  83          HD12      ILE  83 324.334   6.705  -3.558
 1298   HD13  ILE  83          HD13      ILE  83 323.842   5.137  -4.190
 1299    H    ASP  84           H        ASP  84 330.478   5.180  -2.399
 1300    HA   ASP  84           HA       ASP  84 331.319   7.248  -0.716
 1301    HB2  ASP  84           HB2      ASP  84 332.489   5.096  -2.122
 1302    HB3  ASP  84           HB3      ASP  84 333.435   6.546  -2.435
 1303    H    VAL  85           H        VAL  85 331.637   9.248  -0.937
 1304    HA   VAL  85           HA       VAL  85 331.768  10.570  -3.585
 1305    HB   VAL  85           HB       VAL  85 331.189  11.727  -0.849
 1306   HG11  VAL  85          HG11      VAL  85 330.765  13.870  -2.015
 1307   HG12  VAL  85          HG12      VAL  85 331.386  13.145  -3.502
 1308   HG13  VAL  85          HG13      VAL  85 332.454  13.356  -2.115
 1309   HG21  VAL  85          HG21      VAL  85 329.188  12.297  -2.758
 1310   HG22  VAL  85          HG22      VAL  85 329.078  11.362  -1.263
 1311   HG23  VAL  85          HG23      VAL  85 329.501  10.557  -2.773
 1312    H    PHE  86           H        PHE  86 333.725  11.468  -4.186
 1313    HA   PHE  86           HA       PHE  86 335.632  12.124  -2.090
 1314    HB2  PHE  86           HB2      PHE  86 336.130  10.137  -4.301
 1315    HB3  PHE  86           HB3      PHE  86 337.446  11.059  -3.581
 1316    HD1  PHE  86           HD2      PHE  86 337.721  10.905  -1.031
 1317    HD2  PHE  86           HD1      PHE  86 335.417   8.160  -3.326
 1318    HE1  PHE  86           HE2      PHE  86 337.881   9.256   0.789
 1319    HE2  PHE  86           HE1      PHE  86 335.572   6.506  -1.511
 1320    HZ   PHE  86           HZ       PHE  86 336.805   7.053   0.550
 1321    H    GLN  87           H        GLN  87 335.704  14.166  -2.494
 1322    HA   GLN  87           HA       GLN  87 336.635  15.060  -5.108
 1323    HB2  GLN  87           HB2      GLN  87 334.035  15.062  -4.807
 1324    HB3  GLN  87           HB3      GLN  87 334.315  16.548  -3.927
 1325    HG2  GLN  87           HG2      GLN  87 335.752  16.558  -6.429
 1326    HG3  GLN  87           HG3      GLN  87 334.060  16.192  -6.673
 1327   HE21  GLN  87          HE21      GLN  87 332.568  17.656  -5.147
 1328   HE22  GLN  87          HE22      GLN  87 332.935  19.343  -5.274
 1329    H    GLN  88           H        GLN  88 338.444  16.122  -4.655
 1330    HA   GLN  88           HA       GLN  88 338.793  17.479  -2.131
 1331    HB2  GLN  88           HB2      GLN  88 340.629  17.210  -4.506
 1332    HB3  GLN  88           HB3      GLN  88 341.076  17.938  -2.972
 1333    HG2  GLN  88           HG2      GLN  88 339.961  15.232  -2.780
 1334    HG3  GLN  88           HG3      GLN  88 341.499  15.351  -3.632
 1335   HE21  GLN  88          HE21      GLN  88 340.423  14.476  -0.834
 1336   HE22  GLN  88          HE22      GLN  88 341.618  15.115   0.238
 1337    H    GLN  89           H        GLN  89 339.250  19.672  -1.850
 1338    HA   GLN  89           HA       GLN  89 338.179  21.399  -3.975
 1339    HB2  GLN  89           HB2      GLN  89 338.556  22.144  -1.076
 1340    HB3  GLN  89           HB3      GLN  89 337.592  22.979  -2.285
 1341    HG2  GLN  89           HG2      GLN  89 335.829  21.613  -2.019
 1342    HG3  GLN  89           HG3      GLN  89 336.835  20.185  -1.780
 1343   HE21  GLN  89          HE21      GLN  89 338.066  20.196   0.338
 1344   HE22  GLN  89          HE22      GLN  89 337.186  20.703   1.736
 1345    H    THR  90           H        THR  90 339.306  23.258  -4.614
 1346    HA   THR  90           HA       THR  90 341.968  23.676  -3.484
 1347    HB   THR  90           HB       THR  90 343.077  23.593  -5.597
 1348    HG1  THR  90           HG1      THR  90 340.509  23.209  -6.735
 1349   HG21  THR  90          HG21      THR  90 341.429  21.229  -6.126
 1350   HG22  THR  90          HG22      THR  90 342.092  21.335  -4.496
 1351   HG23  THR  90          HG23      THR  90 343.170  21.378  -5.891
 1352    H1   THR   2           HT1      THR   2 291.480 -10.261  19.699
 1353    H2   THR   2           HT2      THR   2 289.915 -10.790  19.233
 1354    H3   THR   2           HT3      THR   2 290.103  -9.329  20.114
 1355    HA   THR   2           HA       THR   2 291.053  -8.235  18.351
 1356    HB   THR   2           HB       THR   2 292.611  -9.917  17.644
 1357    HG1  THR   2           HG1      THR   2 292.565  -9.170  15.699
 1358   HG21  THR   2          HG21      THR   2 291.866 -11.848  16.251
 1359   HG22  THR   2          HG22      THR   2 290.217 -11.510  16.777
 1360   HG23  THR   2          HG23      THR   2 291.447 -11.956  17.961
 1361    H    VAL   3           H        VAL   3 289.621  -7.100  17.188
 1362    HA   VAL   3           HA       VAL   3 287.334  -8.479  15.983
 1363    HB   VAL   3           HB       VAL   3 285.858  -6.573  16.786
 1364   HG11  VAL   3          HG11      VAL   3 285.080  -7.927  18.406
 1365   HG12  VAL   3          HG12      VAL   3 286.641  -8.019  19.223
 1366   HG13  VAL   3          HG13      VAL   3 286.321  -9.032  17.815
 1367   HG21  VAL   3          HG21      VAL   3 287.541  -5.022  17.520
 1368   HG22  VAL   3          HG22      VAL   3 288.183  -6.196  18.668
 1369   HG23  VAL   3          HG23      VAL   3 286.577  -5.510  18.914
 1370    H    GLY   4           H        GLY   4 286.554  -7.552  14.126
 1371    HA2  GLY   4           HA2      GLY   4 287.096  -4.902  13.293
 1372    HA3  GLY   4           HA3      GLY   4 288.263  -5.999  12.568
 1373    H    ASP   5           H        ASP   5 286.549  -8.229  12.257
 1374    HA   ASP   5           HA       ASP   5 285.342  -9.121  10.535
 1375    HB2  ASP   5           HB2      ASP   5 283.004  -8.422  10.517
 1376    HB3  ASP   5           HB3      ASP   5 283.603  -8.524  12.169
 1377    H    GLU   6           H        GLU   6 287.084  -8.049   9.117
 1378    HA   GLU   6           HA       GLU   6 287.610  -7.108   7.115
 1379    HB2  GLU   6           HB2      GLU   6 285.033  -8.098   6.835
 1380    HB3  GLU   6           HB3      GLU   6 284.910  -6.451   6.234
 1381    HG2  GLU   6           HG2      GLU   6 287.156  -7.226   4.988
 1382    HG3  GLU   6           HG3      GLU   6 286.329  -8.777   5.122
 1383    H    ILE   7           H        ILE   7 287.817  -5.092   6.038
 1384    HA   ILE   7           HA       ILE   7 286.344  -2.784   6.636
 1385    HB   ILE   7           HB       ILE   7 287.422  -3.151   8.883
 1386   HG12  ILE   7          HG12      ILE   7 288.355  -0.580   7.619
 1387   HG13  ILE   7          HG13      ILE   7 286.649  -0.911   7.907
 1388   HG21  ILE   7          HG21      ILE   7 289.971  -2.015   8.004
 1389   HG22  ILE   7          HG22      ILE   7 289.679  -3.666   7.466
 1390   HG23  ILE   7          HG23      ILE   7 289.638  -3.282   9.188
 1391   HD11  ILE   7          HD11      ILE   7 286.824  -0.457  10.079
 1392   HD12  ILE   7          HD12      ILE   7 288.365   0.291   9.660
 1393   HD13  ILE   7          HD13      ILE   7 288.322  -1.373  10.245
 1394    H    VAL   8           H        VAL   8 287.635  -4.139   4.415
 1395    HA   VAL   8           HA       VAL   8 288.773  -1.864   3.104
 1396    HB   VAL   8           HB       VAL   8 290.911  -3.147   2.479
 1397   HG11  VAL   8          HG11      VAL   8 290.930  -2.289   5.341
 1398   HG12  VAL   8          HG12      VAL   8 290.588  -1.120   4.065
 1399   HG13  VAL   8          HG13      VAL   8 292.120  -1.993   4.074
 1400   HG21  VAL   8          HG21      VAL   8 291.732  -4.785   3.986
 1401   HG22  VAL   8          HG22      VAL   8 290.093  -5.272   3.556
 1402   HG23  VAL   8          HG23      VAL   8 290.405  -4.509   5.115
 1403    H    ASP   9           H        ASP   9 289.851  -2.783   0.893
 1404    HA   ASP   9           HA       ASP   9 288.884  -5.176  -0.192
 1405    HB2  ASP   9           HB2      ASP   9 286.993  -2.929  -0.220
 1406    HB3  ASP   9           HB3      ASP   9 287.253  -3.664  -1.799
 1407    H    LEU  10           H        LEU  10 289.419  -5.464  -2.388
 1408    HA   LEU  10           HA       LEU  10 291.763  -4.370  -3.288
 1409    HB2  LEU  10           HB2      LEU  10 291.083  -6.346  -4.313
 1410    HB3  LEU  10           HB3      LEU  10 289.491  -5.723  -4.671
 1411    HG   LEU  10           HG       LEU  10 291.602  -4.293  -6.113
 1412   HD11  LEU  10          HD11      LEU  10 292.794  -5.980  -6.941
 1413   HD12  LEU  10          HD12      LEU  10 291.322  -6.719  -7.570
 1414   HD13  LEU  10          HD13      LEU  10 291.891  -7.127  -5.950
 1415   HD21  LEU  10          HD21      LEU  10 289.801  -3.871  -7.325
 1416   HD22  LEU  10          HD22      LEU  10 288.868  -5.068  -6.430
 1417   HD23  LEU  10          HD23      LEU  10 289.795  -5.555  -7.849
 1418    H    THR  11           H        THR  11 292.349  -2.867  -4.875
 1419    HA   THR  11           HA       THR  11 290.333  -0.790  -5.430
 1420    HB   THR  11           HB       THR  11 292.045  -0.036  -3.820
 1421    HG1  THR  11           HG1      THR  11 291.158   1.375  -5.513
 1422   HG21  THR  11          HG21      THR  11 294.345   0.331  -4.543
 1423   HG22  THR  11          HG22      THR  11 294.010  -0.533  -6.043
 1424   HG23  THR  11          HG23      THR  11 293.939  -1.385  -4.500
 1425    H    CYS  12           H        CYS  12 292.013   0.715  -7.181
 1426    HA   CYS  12           HA       CYS  12 293.011  -0.978  -9.258
 1427    HB2  CYS  12           HB2      CYS  12 290.288  -0.735  -9.291
 1428    HB3  CYS  12           HB3      CYS  12 290.770   0.591 -10.344
 1429    HG   CYS  12           HG       CYS  12 292.002  -2.117 -11.071
 1430    H    GLU  13           H        GLU  13 294.198   1.078  -7.876
 1431    HA   GLU  13           HA       GLU  13 294.820   2.895 -10.048
 1432    HB2  GLU  13           HB2      GLU  13 293.670   3.823  -7.422
 1433    HB3  GLU  13           HB3      GLU  13 294.647   4.875  -8.438
 1434    HG2  GLU  13           HG2      GLU  13 292.131   3.508  -9.358
 1435    HG3  GLU  13           HG3      GLU  13 292.191   5.147  -8.713
 1436    H    SER  14           H        SER  14 296.682   4.359  -9.425
 1437    HA   SER  14           HA       SER  14 298.427   3.068  -7.440
 1438    HB2  SER  14           HB2      SER  14 298.917   2.483  -9.910
 1439    HB3  SER  14           HB3      SER  14 299.506   4.140 -10.038
 1440    HG   SER  14           HG       SER  14 301.286   3.405  -9.222
 1441    H    LEU  15           H        LEU  15 300.575   4.600  -7.409
 1442    HA   LEU  15           HA       LEU  15 299.598   7.357  -7.051
 1443    HB2  LEU  15           HB2      LEU  15 301.115   7.529  -5.095
 1444    HB3  LEU  15           HB3      LEU  15 299.802   6.389  -4.869
 1445    HG   LEU  15           HG       LEU  15 302.357   5.267  -5.864
 1446   HD11  LEU  15          HD11      LEU  15 302.149   5.744  -2.934
 1447   HD12  LEU  15          HD12      LEU  15 302.765   7.035  -3.965
 1448   HD13  LEU  15          HD13      LEU  15 303.573   5.468  -3.936
 1449   HD21  LEU  15          HD21      LEU  15 300.142   4.070  -5.257
 1450   HD22  LEU  15          HD22      LEU  15 300.681   4.279  -3.591
 1451   HD23  LEU  15          HD23      LEU  15 301.671   3.367  -4.730
 1452    H    GLU  16           H        GLU  16 301.256   9.019  -7.166
 1453    HA   GLU  16           HA       GLU  16 302.817   8.946  -9.419
 1454    HB2  GLU  16           HB2      GLU  16 303.429  10.546  -6.929
 1455    HB3  GLU  16           HB3      GLU  16 303.962  10.915  -8.564
 1456    HG2  GLU  16           HG2      GLU  16 302.187  12.255  -8.640
 1457    HG3  GLU  16           HG3      GLU  16 301.258  10.775  -8.875
 1458    HA   PRO  17           HA       PRO  17 306.107   6.323  -7.758
 1459    HB2  PRO  17           HB2      PRO  17 306.646   4.986  -9.995
 1460    HB3  PRO  17           HB3      PRO  17 305.157   4.679  -9.093
 1461    HG2  PRO  17           HG2      PRO  17 305.563   6.205 -11.619
 1462    HG3  PRO  17           HG3      PRO  17 304.195   5.195 -11.122
 1463    HD2  PRO  17           HD2      PRO  17 304.356   8.006 -10.964
 1464    HD3  PRO  17           HD3      PRO  17 303.124   6.975 -10.215
 1465    H    VAL  18           H        VAL  18 308.271   5.637  -9.127
 1466    HA   VAL  18           HA       VAL  18 310.373   6.375  -9.520
 1467    HB   VAL  18           HB       VAL  18 309.388   6.339 -11.778
 1468   HG11  VAL  18          HG11      VAL  18 307.727   7.914 -11.910
 1469   HG12  VAL  18          HG12      VAL  18 309.039   8.739 -12.750
 1470   HG13  VAL  18          HG13      VAL  18 308.671   9.146 -11.076
 1471   HG21  VAL  18          HG21      VAL  18 311.608   6.672 -12.061
 1472   HG22  VAL  18          HG22      VAL  18 311.641   8.077 -10.993
 1473   HG23  VAL  18          HG23      VAL  18 311.064   8.244 -12.650
 1474    H    VAL  19           H        VAL  19 309.684   7.595  -7.314
 1475    HA   VAL  19           HA       VAL  19 310.794  10.303  -7.619
 1476    HB   VAL  19           HB       VAL  19 308.384  10.545  -7.206
 1477   HG11  VAL  19          HG11      VAL  19 307.249   9.623  -5.404
 1478   HG12  VAL  19          HG12      VAL  19 308.732   9.302  -4.505
 1479   HG13  VAL  19          HG13      VAL  19 308.317   8.313  -5.906
 1480   HG21  VAL  19          HG21      VAL  19 308.513  12.043  -5.310
 1481   HG22  VAL  19          HG22      VAL  19 309.976  12.188  -6.285
 1482   HG23  VAL  19          HG23      VAL  19 310.009  11.279  -4.774
 1483    H    VAL  20           H        VAL  20 312.277  10.897  -6.006
 1484    HA   VAL  20           HA       VAL  20 312.660   9.098  -3.743
 1485    HB   VAL  20           HB       VAL  20 314.841   8.432  -4.226
 1486   HG11  VAL  20          HG11      VAL  20 313.030   7.430  -5.702
 1487   HG12  VAL  20          HG12      VAL  20 314.692   7.213  -6.245
 1488   HG13  VAL  20          HG13      VAL  20 313.669   8.446  -6.989
 1489   HG21  VAL  20          HG21      VAL  20 314.914  10.515  -6.403
 1490   HG22  VAL  20          HG22      VAL  20 316.190   9.338  -6.092
 1491   HG23  VAL  20          HG23      VAL  20 315.795  10.551  -4.876
 1492    H    ASP  21           H        ASP  21 313.984   9.954  -2.047
 1493    HA   ASP  21           HA       ASP  21 315.502  12.238  -2.045
 1494    HB2  ASP  21           HB2      ASP  21 313.812  13.889  -1.020
 1495    HB3  ASP  21           HB3      ASP  21 313.773  13.651  -2.764
 1496    H    LEU  22           H        LEU  22 316.173  12.923   0.008
 1497    HA   LEU  22           HA       LEU  22 314.918  12.052   2.424
 1498    HB2  LEU  22           HB2      LEU  22 316.058   9.952   1.646
 1499    HB3  LEU  22           HB3      LEU  22 317.585  10.793   1.773
 1500    HG   LEU  22           HG       LEU  22 317.401  10.965   4.150
 1501   HD11  LEU  22          HD11      LEU  22 315.362  11.359   4.959
 1502   HD12  LEU  22          HD12      LEU  22 315.180   9.605   4.992
 1503   HD13  LEU  22          HD13      LEU  22 314.569  10.530   3.620
 1504   HD21  LEU  22          HD21      LEU  22 316.946   8.493   4.769
 1505   HD22  LEU  22          HD22      LEU  22 318.287   8.871   3.690
 1506   HD23  LEU  22          HD23      LEU  22 316.773   8.256   3.033
 1507    H    THR  23           H        THR  23 315.900  14.487   1.181
 1508    HA   THR  23           HA       THR  23 318.336  15.381   2.175
 1509    HB   THR  23           HB       THR  23 316.909  16.549   0.487
 1510    HG1  THR  23           HG1      THR  23 318.554  17.757   1.241
 1511   HG21  THR  23          HG21      THR  23 314.832  16.435   2.048
 1512   HG22  THR  23          HG22      THR  23 315.083  17.832   1.002
 1513   HG23  THR  23          HG23      THR  23 315.495  17.928   2.714
 1514    H    HIS  24           H        HIS  24 315.148  15.395   3.708
 1515    HA   HIS  24           HA       HIS  24 315.955  16.863   6.000
 1516    HB2  HIS  24           HB2      HIS  24 313.547  16.036   4.991
 1517    HB3  HIS  24           HB3      HIS  24 313.739  14.966   6.376
 1518    HD1  HIS  24           HD1      HIS  24 314.657  16.553   8.603
 1519    HD2  HIS  24           HD2      HIS  24 312.170  18.227   5.727
 1520    HE1  HIS  24           HE1      HIS  24 313.599  18.547   9.709
 1521    HE2  HIS  24           HE2      HIS  24 312.199  19.616   7.907
 1522    H    ASN  25           H        ASN  25 316.548  16.183   8.032
 1523    HA   ASN  25           HA       ASN  25 317.834  14.932   9.450
 1524    HB2  ASN  25           HB2      ASN  25 316.743  12.844  10.175
 1525    HB3  ASN  25           HB3      ASN  25 315.593  14.169  10.024
 1526   HD21  ASN  25          HD21      ASN  25 314.139  14.173   8.278
 1527   HD22  ASN  25          HD22      ASN  25 313.757  12.719   7.426
 1528    H    ASP  26           H        ASP  26 319.786  14.674   8.424
 1529    HA   ASP  26           HA       ASP  26 320.151  12.452   6.580
 1530    HB2  ASP  26           HB2      ASP  26 322.469  13.347   6.367
 1531    HB3  ASP  26           HB3      ASP  26 321.225  14.531   5.974
  Start of MODEL    3
    1    H1   GLY   1           HT1      GLY   1 298.601 -22.888 -10.454
    2    H2   GLY   1           HT2      GLY   1 297.423 -24.050 -10.104
    3    H3   GLY   1           HT3      GLY   1 299.014 -24.274  -9.576
    4    HA2  GLY   1           HA3      GLY   1 297.746 -23.591  -7.703
    5    HA3  GLY   1           HA2      GLY   1 298.803 -22.269  -8.173
    6    H    THR   2           H        THR   2 297.818 -20.383  -7.959
    7    HA   THR   2           HA       THR   2 294.932 -20.231  -8.503
    8    HB   THR   2           HB       THR   2 295.180 -18.003  -7.227
    9    HG1  THR   2           HG1      THR   2 297.532 -19.289  -6.313
   10   HG21  THR   2          HG21      THR   2 294.276 -20.246  -6.323
   11   HG22  THR   2          HG22      THR   2 294.718 -18.969  -5.189
   12   HG23  THR   2          HG23      THR   2 295.814 -20.324  -5.464
   13    H    GLU   3           H        GLU   3 294.279 -17.912  -9.219
   14    HA   GLU   3           HA       GLU   3 296.151 -16.957 -11.266
   15    HB2  GLU   3           HB2      GLU   3 294.364 -16.729 -12.864
   16    HB3  GLU   3           HB3      GLU   3 294.385 -18.381 -12.258
   17    HG2  GLU   3           HG2      GLU   3 292.711 -17.156 -10.516
   18    HG3  GLU   3           HG3      GLU   3 292.343 -16.323 -12.024
   19    H    ASN   4           H        ASN   4 294.274 -14.953 -12.237
   20    HA   ASN   4           HA       ASN   4 294.879 -12.909 -10.328
   21    HB2  ASN   4           HB2      ASN   4 294.023 -13.039 -13.098
   22    HB3  ASN   4           HB3      ASN   4 293.148 -11.803 -12.203
   23   HD21  ASN   4          HD21      ASN   4 294.169  -9.970 -11.574
   24   HD22  ASN   4          HD22      ASN   4 295.801  -9.592 -11.997
   25    H    ASP   5           H        ASP   5 292.666 -15.121  -9.882
   26    HA   ASP   5           HA       ASP   5 290.353 -13.432  -9.396
   27    HB2  ASP   5           HB2      ASP   5 290.807 -16.240  -9.762
   28    HB3  ASP   5           HB3      ASP   5 290.035 -15.998  -8.198
   29    H    HIS   6           H        HIS   6 289.398 -14.498  -6.980
   30    HA   HIS   6           HA       HIS   6 291.125 -13.089  -5.158
   31    HB2  HIS   6           HB2      HIS   6 288.474 -14.457  -4.724
   32    HB3  HIS   6           HB3      HIS   6 289.442 -13.789  -3.478
   33    HD1  HIS   6           HD1      HIS   6 287.989 -12.443  -6.716
   34    HD2  HIS   6           HD2      HIS   6 288.652 -11.388  -2.751
   35    HE1  HIS   6           HE1      HIS   6 286.970 -10.155  -6.454
   36    HE2  HIS   6           HE2      HIS   6 287.472  -9.492  -4.073
   37    H    ILE   7           H        ILE   7 291.459 -13.999  -3.003
   38    HA   ILE   7           HA       ILE   7 291.596 -16.793  -2.592
   39    HB   ILE   7           HB       ILE   7 293.841 -17.277  -2.679
   40   HG12  ILE   7          HG12      ILE   7 294.439 -14.345  -2.332
   41   HG13  ILE   7          HG13      ILE   7 294.550 -15.580  -1.087
   42   HG21  ILE   7          HG21      ILE   7 293.316 -16.831  -4.940
   43   HG22  ILE   7          HG22      ILE   7 294.940 -16.214  -4.635
   44   HG23  ILE   7          HG23      ILE   7 293.576 -15.101  -4.722
   45   HD11  ILE   7          HD11      ILE   7 296.197 -16.610  -2.942
   46   HD12  ILE   7          HD12      ILE   7 296.714 -15.554  -1.624
   47   HD13  ILE   7          HD13      ILE   7 296.418 -14.886  -3.232
   48    H    ASN   8           H        ASN   8 291.748 -17.184  -0.447
   49    HA   ASN   8           HA       ASN   8 291.254 -14.870   1.195
   50    HB2  ASN   8           HB2      ASN   8 290.551 -17.600   1.295
   51    HB3  ASN   8           HB3      ASN   8 291.474 -17.281   2.758
   52   HD21  ASN   8          HD21      ASN   8 290.818 -14.814   3.477
   53   HD22  ASN   8          HD22      ASN   8 289.123 -14.676   3.780
   54    H    LEU   9           H        LEU   9 292.538 -14.034   2.856
   55    HA   LEU   9           HA       LEU   9 295.165 -15.258   3.274
   56    HB2  LEU   9           HB2      LEU   9 294.444 -12.497   2.583
   57    HB3  LEU   9           HB3      LEU   9 295.599 -12.638   3.834
   58    HG   LEU   9           HG       LEU   9 297.240 -13.001   2.344
   59   HD11  LEU   9          HD11      LEU   9 297.220 -14.835   0.732
   60   HD12  LEU   9          HD12      LEU   9 295.500 -15.086   1.026
   61   HD13  LEU   9          HD13      LEU   9 296.667 -15.385   2.313
   62   HD21  LEU   9          HD21      LEU   9 296.423 -12.851  -0.152
   63   HD22  LEU   9          HD22      LEU   9 296.431 -11.441   0.910
   64   HD23  LEU   9          HD23      LEU   9 294.930 -12.321   0.626
   65    H    LYS  10           H        LYS  10 295.578 -15.677   5.323
   66    HA   LYS  10           HA       LYS  10 293.718 -14.709   7.348
   67    HB2  LYS  10           HB2      LYS  10 295.827 -16.771   7.189
   68    HB3  LYS  10           HB3      LYS  10 295.428 -16.180   8.753
   69    HG2  LYS  10           HG2      LYS  10 293.326 -17.120   8.709
   70    HG3  LYS  10           HG3      LYS  10 293.257 -17.100   6.942
   71    HD2  LYS  10           HD2      LYS  10 293.537 -19.365   7.564
   72    HD3  LYS  10           HD3      LYS  10 295.101 -18.807   6.966
   73    HE2  LYS  10           HE2      LYS  10 295.847 -19.787   8.862
   74    HE3  LYS  10           HE3      LYS  10 295.398 -18.233   9.566
   75    HZ1  LYS  10           HZ1      LYS  10 294.323 -19.633  10.974
   76    HZ2  LYS  10           HZ2      LYS  10 294.085 -20.836   9.809
   77    HZ3  LYS  10           HZ3      LYS  10 293.101 -19.461   9.816
   78    H    VAL  11           H        VAL  11 294.234 -12.635   8.085
   79    HA   VAL  11           HA       VAL  11 297.060 -12.027   8.348
   80    HB   VAL  11           HB       VAL  11 295.925 -10.208   7.375
   81   HG11  VAL  11          HG11      VAL  11 293.819  -9.637   7.705
   82   HG12  VAL  11          HG12      VAL  11 294.037  -9.499   9.451
   83   HG13  VAL  11          HG13      VAL  11 293.679 -11.067   8.729
   84   HG21  VAL  11          HG21      VAL  11 297.158  -8.876   8.565
   85   HG22  VAL  11          HG22      VAL  11 297.079  -9.951   9.959
   86   HG23  VAL  11          HG23      VAL  11 295.840  -8.713   9.729
   87    H    ALA  12           H        ALA  12 298.067 -12.383  10.171
   88    HA   ALA  12           HA       ALA  12 296.477 -12.898  12.593
   89    HB1  ALA  12           HB1      ALA  12 297.689 -14.715  12.959
   90    HB2  ALA  12           HB2      ALA  12 299.197 -13.799  12.831
   91    HB3  ALA  12           HB3      ALA  12 298.437 -14.455  11.380
   92    H    GLY  13           H        GLY  13 296.820 -11.879  14.469
   93    HA2  GLY  13           HA2      GLY  13 298.545  -9.532  14.328
   94    HA3  GLY  13           HA3      GLY  13 297.270  -9.818  15.500
   95    H    GLN  14           H        GLN  14 299.850  -8.931  16.095
   96    HA   GLN  14           HA       GLN  14 301.575 -10.970  16.959
   97    HB2  GLN  14           HB2      GLN  14 301.215  -8.113  17.854
   98    HB3  GLN  14           HB3      GLN  14 302.549  -9.141  18.377
   99    HG2  GLN  14           HG2      GLN  14 303.330  -9.339  16.104
  100    HG3  GLN  14           HG3      GLN  14 301.930  -8.441  15.513
  101   HE21  GLN  14          HE21      GLN  14 305.117  -8.238  16.481
  102   HE22  GLN  14          HE22      GLN  14 305.231  -6.524  16.668
  103    H    ASP  15           H        ASP  15 298.563  -9.965  18.159
  104    HA   ASP  15           HA       ASP  15 299.096 -10.905  20.866
  105    HB2  ASP  15           HB2      ASP  15 296.466 -10.267  20.907
  106    HB3  ASP  15           HB3      ASP  15 297.757  -9.121  21.236
  107    H    GLY  16           H        GLY  16 298.222 -12.315  17.991
  108    HA2  GLY  16           HA2      GLY  16 297.830 -14.686  17.949
  109    HA3  GLY  16           HA3      GLY  16 296.926 -14.524  19.443
  110    H    SER  17           H        SER  17 295.936 -12.012  17.583
  111    HA   SER  17           HA       SER  17 293.557 -13.447  16.741
  112    HB2  SER  17           HB2      SER  17 294.068 -10.462  16.781
  113    HB3  SER  17           HB3      SER  17 292.514 -11.261  16.547
  114    HG   SER  17           HG       SER  17 293.342 -10.444  18.782
  115    H    VAL  18           H        VAL  18 293.366 -14.074  14.716
  116    HA   VAL  18           HA       VAL  18 294.798 -12.592  12.611
  117    HB   VAL  18           HB       VAL  18 295.893 -14.609  12.461
  118   HG11  VAL  18          HG11      VAL  18 294.410 -16.816  12.711
  119   HG12  VAL  18          HG12      VAL  18 293.520 -15.724  13.773
  120   HG13  VAL  18          HG13      VAL  18 295.239 -16.021  14.050
  121   HG21  VAL  18          HG21      VAL  18 294.817 -14.246  10.315
  122   HG22  VAL  18          HG22      VAL  18 293.432 -15.205  10.831
  123   HG23  VAL  18          HG23      VAL  18 295.011 -15.968  10.635
  124    H    VAL  19           H        VAL  19 293.661 -12.831  10.417
  125    HA   VAL  19           HA       VAL  19 290.781 -13.267  10.629
  126    HB   VAL  19           HB       VAL  19 291.769 -10.760   9.355
  127   HG11  VAL  19          HG11      VAL  19 289.300 -12.052   9.430
  128   HG12  VAL  19          HG12      VAL  19 289.623 -10.414   8.868
  129   HG13  VAL  19          HG13      VAL  19 289.142 -10.692  10.541
  130   HG21  VAL  19          HG21      VAL  19 292.458 -10.773  11.730
  131   HG22  VAL  19          HG22      VAL  19 290.766 -10.991  12.172
  132   HG23  VAL  19          HG23      VAL  19 291.281  -9.515  11.349
  133    H    GLN  20           H        GLN  20 289.823 -13.742   8.557
  134    HA   GLN  20           HA       GLN  20 291.875 -14.284   6.529
  135    HB2  GLN  20           HB2      GLN  20 289.153 -15.558   6.724
  136    HB3  GLN  20           HB3      GLN  20 290.510 -16.074   5.725
  137    HG2  GLN  20           HG2      GLN  20 291.650 -16.093   8.154
  138    HG3  GLN  20           HG3      GLN  20 289.989 -16.509   8.580
  139   HE21  GLN  20          HE21      GLN  20 291.566 -18.399   9.197
  140   HE22  GLN  20          HE22      GLN  20 291.610 -19.689   8.051
  141    H    PHE  21           H        PHE  21 291.999 -12.749   5.083
  142    HA   PHE  21           HA       PHE  21 289.517 -11.636   3.966
  143    HB2  PHE  21           HB2      PHE  21 292.308 -10.488   4.048
  144    HB3  PHE  21           HB3      PHE  21 290.939  -9.742   3.238
  145    HD1  PHE  21           HD2      PHE  21 289.080  -8.812   4.572
  146    HD2  PHE  21           HD1      PHE  21 292.606 -10.364   6.378
  147    HE1  PHE  21           HE2      PHE  21 288.512  -7.656   6.670
  148    HE2  PHE  21           HE1      PHE  21 292.044  -9.192   8.471
  149    HZ   PHE  21           HZ       PHE  21 290.004  -7.851   8.615
  150    H    LYS  22           H        LYS  22 289.081 -12.471   2.031
  151    HA   LYS  22           HA       LYS  22 291.312 -13.328   0.387
  152    HB2  LYS  22           HB2      LYS  22 290.096 -14.971  -0.428
  153    HB3  LYS  22           HB3      LYS  22 288.963 -14.633   0.863
  154    HG2  LYS  22           HG2      LYS  22 287.874 -13.121  -0.634
  155    HG3  LYS  22           HG3      LYS  22 288.981 -13.596  -1.861
  156    HD2  LYS  22           HD2      LYS  22 287.844 -15.916  -0.633
  157    HD3  LYS  22           HD3      LYS  22 286.562 -14.861  -1.239
  158    HE2  LYS  22           HE2      LYS  22 287.331 -15.017  -3.430
  159    HE3  LYS  22           HE3      LYS  22 288.923 -15.582  -2.918
  160    HZ1  LYS  22           HZ1      LYS  22 287.025 -17.415  -2.006
  161    HZ2  LYS  22           HZ2      LYS  22 288.218 -17.649  -3.181
  162    HZ3  LYS  22           HZ3      LYS  22 286.681 -17.107  -3.634
  163    H    ILE  23           H        ILE  23 292.017 -12.198  -1.293
  164    HA   ILE  23           HA       ILE  23 290.232 -10.297  -2.541
  165    HB   ILE  23           HB       ILE  23 290.969  -8.594  -1.309
  166   HG12  ILE  23          HG12      ILE  23 292.927  -9.014  -3.353
  167   HG13  ILE  23          HG13      ILE  23 292.345  -7.513  -2.674
  168   HG21  ILE  23          HG21      ILE  23 291.774 -10.180   0.387
  169   HG22  ILE  23          HG22      ILE  23 292.728  -8.701   0.312
  170   HG23  ILE  23          HG23      ILE  23 293.352 -10.187  -0.402
  171   HD11  ILE  23          HD11      ILE  23 294.705  -7.544  -2.456
  172   HD12  ILE  23          HD12      ILE  23 294.672  -9.152  -1.731
  173   HD13  ILE  23          HD13      ILE  23 294.019  -7.772  -0.846
  174    H    LYS  24           H        LYS  24 290.541 -10.226  -4.595
  175    HA   LYS  24           HA       LYS  24 291.786 -11.807  -6.261
  176    HB2  LYS  24           HB2      LYS  24 291.685  -8.836  -6.523
  177    HB3  LYS  24           HB3      LYS  24 292.233  -9.890  -7.829
  178    HG2  LYS  24           HG2      LYS  24 289.658 -10.518  -6.528
  179    HG3  LYS  24           HG3      LYS  24 289.723  -9.148  -7.617
  180    HD2  LYS  24           HD2      LYS  24 290.859 -11.765  -8.461
  181    HD3  LYS  24           HD3      LYS  24 289.115 -11.518  -8.518
  182    HE2  LYS  24           HE2      LYS  24 289.628  -9.401  -9.838
  183    HE3  LYS  24           HE3      LYS  24 291.266 -10.033  -9.995
  184    HZ1  LYS  24           HZ1      LYS  24 290.411 -11.969 -11.107
  185    HZ2  LYS  24           HZ2      LYS  24 289.837 -10.588 -11.897
  186    HZ3  LYS  24           HZ3      LYS  24 288.814 -11.461 -10.872
  187    H    ARG  25           H        ARG  25 293.805 -12.431  -6.943
  188    HA   ARG  25           HA       ARG  25 295.973 -12.117  -5.306
  189    HB2  ARG  25           HB2      ARG  25 295.852 -12.840  -8.207
  190    HB3  ARG  25           HB3      ARG  25 297.308 -12.955  -7.252
  191    HG2  ARG  25           HG2      ARG  25 295.796 -14.380  -5.666
  192    HG3  ARG  25           HG3      ARG  25 294.849 -14.591  -7.137
  193    HD2  ARG  25           HD2      ARG  25 296.318 -16.401  -7.156
  194    HD3  ARG  25           HD3      ARG  25 297.061 -15.236  -8.249
  195    HE   ARG  25           HE       ARG  25 298.091 -14.835  -5.674
  196   HH11  ARG  25          HH11      ARG  25 298.171 -17.195  -8.244
  197   HH12  ARG  25          HH12      ARG  25 299.739 -17.792  -7.818
  198   HH21  ARG  25          HH21      ARG  25 300.158 -15.623  -5.112
  199   HH22  ARG  25          HH22      ARG  25 300.864 -16.903  -6.041
  200    H    HIS  26           H        HIS  26 295.831 -10.665  -8.572
  201    HA   HIS  26           HA       HIS  26 298.078  -9.033  -8.116
  202    HB2  HIS  26           HB2      HIS  26 295.916  -9.069 -10.176
  203    HB3  HIS  26           HB3      HIS  26 297.035  -7.712 -10.115
  204    HD1  HIS  26           HD1      HIS  26 299.192  -8.014 -11.311
  205    HD2  HIS  26           HD2      HIS  26 297.310 -11.637 -10.543
  206    HE1  HIS  26           HE1      HIS  26 300.582  -9.754 -12.480
  207    HE2  HIS  26           HE2      HIS  26 299.401 -11.935 -12.036
  208    H    THR  27           H        THR  27 295.718  -8.759  -6.148
  209    HA   THR  27           HA       THR  27 295.188  -5.913  -6.464
  210    HB   THR  27           HB       THR  27 294.089  -7.795  -4.383
  211    HG1  THR  27           HG1      THR  27 293.521  -8.412  -6.499
  212   HG21  THR  27          HG21      THR  27 292.340  -6.144  -4.112
  213   HG22  THR  27          HG22      THR  27 293.097  -5.121  -5.334
  214   HG23  THR  27          HG23      THR  27 293.922  -5.419  -3.803
  215    HA   PRO  28           HA       PRO  28 298.300  -4.989  -3.480
  216    HB2  PRO  28           HB2      PRO  28 296.844  -2.567  -2.782
  217    HB3  PRO  28           HB3      PRO  28 298.395  -2.727  -3.603
  218    HG2  PRO  28           HG2      PRO  28 296.097  -1.873  -4.819
  219    HG3  PRO  28           HG3      PRO  28 297.449  -2.639  -5.669
  220    HD2  PRO  28           HD2      PRO  28 294.815  -3.761  -4.875
  221    HD3  PRO  28           HD3      PRO  28 295.836  -4.141  -6.277
  222    H    LEU  29           H        LEU  29 298.277  -6.089  -1.687
  223    HA   LEU  29           HA       LEU  29 296.165  -6.904  -0.191
  224    HB2  LEU  29           HB2      LEU  29 298.984  -6.318   0.707
  225    HB3  LEU  29           HB3      LEU  29 297.812  -7.196   1.676
  226    HG   LEU  29           HG       LEU  29 298.429  -8.124  -1.096
  227   HD11  LEU  29          HD11      LEU  29 299.972  -9.238   1.188
  228   HD12  LEU  29          HD12      LEU  29 300.540  -7.760   0.409
  229   HD13  LEU  29          HD13      LEU  29 300.341  -9.238  -0.539
  230   HD21  LEU  29          HD21      LEU  29 297.185  -9.195   1.374
  231   HD22  LEU  29          HD22      LEU  29 298.068 -10.317   0.326
  232   HD23  LEU  29          HD23      LEU  29 296.723  -9.383  -0.327
  233    H    SER  30           H        SER  30 297.379  -3.674  -0.285
  234    HA   SER  30           HA       SER  30 296.848  -2.714   2.232
  235    HB2  SER  30           HB2      SER  30 296.092  -0.588   0.889
  236    HB3  SER  30           HB3      SER  30 297.769  -1.126   0.805
  237    HG   SER  30           HG       SER  30 297.480  -1.314  -1.255
  238    H    LYS  31           H        LYS  31 294.629  -3.982  -0.099
  239    HA   LYS  31           HA       LYS  31 292.288  -2.699   0.945
  240    HB2  LYS  31           HB2      LYS  31 292.765  -3.834  -1.386
  241    HB3  LYS  31           HB3      LYS  31 292.195  -5.276  -0.562
  242    HG2  LYS  31           HG2      LYS  31 290.068  -4.278  -0.151
  243    HG3  LYS  31           HG3      LYS  31 290.635  -2.708  -0.725
  244    HD2  LYS  31           HD2      LYS  31 291.095  -4.694  -2.742
  245    HD3  LYS  31           HD3      LYS  31 289.411  -4.765  -2.220
  246    HE2  LYS  31           HE2      LYS  31 289.541  -2.163  -2.466
  247    HE3  LYS  31           HE3      LYS  31 290.913  -2.531  -3.511
  248    HZ1  LYS  31           HZ1      LYS  31 288.743  -2.332  -4.679
  249    HZ2  LYS  31           HZ2      LYS  31 288.217  -3.717  -3.865
  250    HZ3  LYS  31           HZ3      LYS  31 289.523  -3.812  -4.936
  251    H    LEU  32           H        LEU  32 293.745  -5.929   1.095
  252    HA   LEU  32           HA       LEU  32 292.023  -7.224   2.817
  253    HB2  LEU  32           HB2      LEU  32 293.779  -8.377   1.668
  254    HB3  LEU  32           HB3      LEU  32 294.998  -7.366   2.388
  255    HG   LEU  32           HG       LEU  32 293.483  -9.031   4.303
  256   HD11  LEU  32          HD11      LEU  32 293.991 -10.317   2.049
  257   HD12  LEU  32          HD12      LEU  32 294.141 -11.060   3.641
  258   HD13  LEU  32          HD13      LEU  32 295.576 -10.455   2.812
  259   HD21  LEU  32          HD21      LEU  32 295.583  -7.516   4.605
  260   HD22  LEU  32          HD22      LEU  32 296.436  -8.917   3.940
  261   HD23  LEU  32          HD23      LEU  32 295.483  -9.076   5.432
  262    H    MET  33           H        MET  33 294.820  -5.153   3.598
  263    HA   MET  33           HA       MET  33 294.513  -5.432   6.369
  264    HB2  MET  33           HB2      MET  33 295.777  -2.964   5.516
  265    HB3  MET  33           HB3      MET  33 296.352  -4.196   6.579
  266    HG2  MET  33           HG2      MET  33 297.171  -5.499   4.777
  267    HG3  MET  33           HG3      MET  33 296.391  -4.436   3.620
  268    HE1  MET  33           HE1      MET  33 299.518  -5.085   3.235
  269    HE2  MET  33           HE2      MET  33 299.582  -5.443   4.962
  270    HE3  MET  33           HE3      MET  33 300.624  -4.181   4.277
  271    H    LYS  34           H        LYS  34 293.512  -2.951   4.058
  272    HA   LYS  34           HA       LYS  34 292.470  -1.089   5.812
  273    HB2  LYS  34           HB2      LYS  34 291.833  -1.878   3.010
  274    HB3  LYS  34           HB3      LYS  34 290.726  -0.790   3.838
  275    HG2  LYS  34           HG2      LYS  34 293.674  -0.263   3.709
  276    HG3  LYS  34           HG3      LYS  34 292.569   0.258   2.438
  277    HD2  LYS  34           HD2      LYS  34 291.226   1.256   4.467
  278    HD3  LYS  34           HD3      LYS  34 292.801   1.189   5.260
  279    HE2  LYS  34           HE2      LYS  34 293.754   2.474   3.365
  280    HE3  LYS  34           HE3      LYS  34 292.130   2.622   2.693
  281    HZ1  LYS  34           HZ1      LYS  34 292.891   4.568   4.016
  282    HZ2  LYS  34           HZ2      LYS  34 292.880   3.589   5.396
  283    HZ3  LYS  34           HZ3      LYS  34 291.440   3.889   4.562
  284    H    ALA  35           H        ALA  35 291.083  -4.134   4.691
  285    HA   ALA  35           HA       ALA  35 288.522  -3.750   5.905
  286    HB1  ALA  35           HB1      ALA  35 289.996  -6.202   4.912
  287    HB2  ALA  35           HB2      ALA  35 288.701  -5.317   4.101
  288    HB3  ALA  35           HB3      ALA  35 288.352  -6.242   5.559
  289    H    TYR  36           H        TYR  36 291.594  -5.163   6.791
  290    HA   TYR  36           HA       TYR  36 290.941  -6.355   9.281
  291    HB2  TYR  36           HB2      TYR  36 293.062  -6.634   7.960
  292    HB3  TYR  36           HB3      TYR  36 293.518  -5.007   8.435
  293    HD1  TYR  36           HD2      TYR  36 292.171  -8.008  10.186
  294    HD2  TYR  36           HD1      TYR  36 295.115  -4.942  10.036
  295    HE1  TYR  36           HE2      TYR  36 293.218  -8.911  12.198
  296    HE2  TYR  36           HE1      TYR  36 296.194  -5.823  12.030
  297    HH   TYR  36           HH       TYR  36 296.241  -8.265  13.178
  298    H    CYS  37           H        CYS  37 291.783  -3.037   8.306
  299    HA   CYS  37           HA       CYS  37 291.908  -2.028  10.974
  300    HB2  CYS  37           HB2      CYS  37 292.220  -1.032   8.250
  301    HB3  CYS  37           HB3      CYS  37 291.307   0.091   9.251
  302    HG   CYS  37           HG       CYS  37 293.507   0.846   9.994
  303    H    GLU  38           H        GLU  38 289.543  -2.369   8.425
  304    HA   GLU  38           HA       GLU  38 287.431  -0.862   9.517
  305    HB2  GLU  38           HB2      GLU  38 287.664  -1.917   7.174
  306    HB3  GLU  38           HB3      GLU  38 287.101  -3.403   7.927
  307    HG2  GLU  38           HG2      GLU  38 285.306  -1.410   8.717
  308    HG3  GLU  38           HG3      GLU  38 285.621  -1.154   7.005
  309    H    ARG  39           H        ARG  39 288.100  -4.353   9.549
  310    HA   ARG  39           HA       ARG  39 286.303  -5.516  11.018
  311    HB2  ARG  39           HB2      ARG  39 289.251  -5.647  10.858
  312    HB3  ARG  39           HB3      ARG  39 288.407  -6.704  11.887
  313    HG2  ARG  39           HG2      ARG  39 287.085  -6.872   9.472
  314    HG3  ARG  39           HG3      ARG  39 288.814  -6.825   9.093
  315    HD2  ARG  39           HD2      ARG  39 287.296  -8.737  10.723
  316    HD3  ARG  39           HD3      ARG  39 288.468  -9.064   9.452
  317    HE   ARG  39           HE       ARG  39 290.155  -8.244  11.103
  318   HH11  ARG  39          HH11      ARG  39 287.138  -9.644  12.187
  319   HH12  ARG  39          HH12      ARG  39 287.754 -10.059  13.749
  320   HH21  ARG  39          HH21      ARG  39 290.951  -8.785  13.166
  321   HH22  ARG  39          HH22      ARG  39 289.911  -9.573  14.305
  322    H    GLN  40           H        GLN  40 289.057  -3.701  12.336
  323    HA   GLN  40           HA       GLN  40 287.771  -3.743  14.980
  324    HB2  GLN  40           HB2      GLN  40 290.723  -3.453  14.393
  325    HB3  GLN  40           HB3      GLN  40 289.975  -3.677  15.969
  326    HG2  GLN  40           HG2      GLN  40 289.098  -5.893  14.927
  327    HG3  GLN  40           HG3      GLN  40 290.401  -5.646  13.763
  328   HE21  GLN  40          HE21      GLN  40 290.487  -7.851  15.252
  329   HE22  GLN  40          HE22      GLN  40 291.722  -7.746  16.455
  330    H    GLY  41           H        GLY  41 290.519  -1.720  14.689
  331    HA2  GLY  41           HA2      GLY  41 289.234   0.599  13.742
  332    HA3  GLY  41           HA3      GLY  41 289.356   0.603  15.493
  333    H    LEU  42           H        LEU  42 291.689  -0.916  13.410
  334    HA   LEU  42           HA       LEU  42 293.866   0.498  14.566
  335    HB2  LEU  42           HB2      LEU  42 293.612  -1.428  12.273
  336    HB3  LEU  42           HB3      LEU  42 295.152  -0.700  12.702
  337    HG   LEU  42           HG       LEU  42 293.641  -2.033  14.877
  338   HD11  LEU  42          HD11      LEU  42 293.866  -4.164  14.172
  339   HD12  LEU  42          HD12      LEU  42 295.330  -3.821  13.249
  340   HD13  LEU  42          HD13      LEU  42 293.748  -3.416  12.579
  341   HD21  LEU  42          HD21      LEU  42 295.999  -0.825  14.785
  342   HD22  LEU  42          HD22      LEU  42 296.519  -2.438  14.288
  343   HD23  LEU  42          HD23      LEU  42 295.697  -2.214  15.833
  344    H    SER  43           H        SER  43 295.615   1.090  12.686
  345    HA   SER  43           HA       SER  43 294.354   3.225  11.096
  346    HB2  SER  43           HB2      SER  43 295.865   3.833  13.100
  347    HB3  SER  43           HB3      SER  43 297.194   3.262  12.097
  348    HG   SER  43           HG       SER  43 295.419   5.409  11.589
  349    H    MET  44           H        MET  44 296.156   0.361  10.968
  350    HA   MET  44           HA       MET  44 297.186  -0.814   9.322
  351    HB2  MET  44           HB2      MET  44 295.168   0.037   8.021
  352    HB3  MET  44           HB3      MET  44 296.206   1.301   7.384
  353    HG2  MET  44           HG2      MET  44 297.424  -1.292   7.081
  354    HG3  MET  44           HG3      MET  44 295.811  -1.257   6.366
  355    HE1  MET  44           HE1      MET  44 297.510  -1.361   3.460
  356    HE2  MET  44           HE2      MET  44 296.219  -0.198   3.162
  357    HE3  MET  44           HE3      MET  44 295.970  -1.520   4.301
  358    H    ARG  45           H        ARG  45 298.033   2.237  10.259
  359    HA   ARG  45           HA       ARG  45 300.509   2.291   8.679
  360    HB2  ARG  45           HB2      ARG  45 298.731   4.324   9.023
  361    HB3  ARG  45           HB3      ARG  45 299.842   4.632  10.347
  362    HG2  ARG  45           HG2      ARG  45 301.094   4.083   7.745
  363    HG3  ARG  45           HG3      ARG  45 300.155   5.574   7.843
  364    HD2  ARG  45           HD2      ARG  45 301.436   6.292   9.765
  365    HD3  ARG  45           HD3      ARG  45 302.326   4.770   9.771
  366    HE   ARG  45           HE       ARG  45 303.687   5.625   8.155
  367   HH11  ARG  45          HH11      ARG  45 300.718   7.459   8.169
  368   HH12  ARG  45          HH12      ARG  45 301.275   8.606   6.997
  369   HH21  ARG  45          HH21      ARG  45 304.421   7.132   6.614
  370   HH22  ARG  45          HH22      ARG  45 303.376   8.420   6.113
  371    H    GLN  46           H        GLN  46 299.058   2.646  11.854
  372    HA   GLN  46           HA       GLN  46 301.526   2.543  13.338
  373    HB2  GLN  46           HB2      GLN  46 299.519   3.658  14.219
  374    HB3  GLN  46           HB3      GLN  46 298.638   2.137  14.181
  375    HG2  GLN  46           HG2      GLN  46 301.170   2.175  15.700
  376    HG3  GLN  46           HG3      GLN  46 299.825   3.092  16.376
  377   HE21  GLN  46          HE21      GLN  46 301.257   0.507  17.065
  378   HE22  GLN  46          HE22      GLN  46 299.973  -0.616  17.319
  379    H    ILE  47           H        ILE  47 299.774   0.473  11.584
  380    HA   ILE  47           HA       ILE  47 300.742  -1.942  12.913
  381    HB   ILE  47           HB       ILE  47 298.458  -2.129  13.206
  382   HG12  ILE  47          HG12      ILE  47 299.424  -4.053  11.892
  383   HG13  ILE  47          HG13      ILE  47 297.668  -3.845  11.748
  384   HG21  ILE  47          HG21      ILE  47 297.302  -0.478  12.322
  385   HG22  ILE  47          HG22      ILE  47 297.004  -1.617  11.008
  386   HG23  ILE  47          HG23      ILE  47 298.298  -0.427  10.872
  387   HD11  ILE  47          HD11      ILE  47 299.467  -4.058   9.692
  388   HD12  ILE  47          HD12      ILE  47 298.921  -2.380   9.701
  389   HD13  ILE  47          HD13      ILE  47 297.743  -3.689   9.630
  390    H    ARG  48           H        ARG  48 301.382  -3.632  11.487
  391    HA   ARG  48           HA       ARG  48 301.639  -3.004   8.653
  392    HB2  ARG  48           HB2      ARG  48 303.991  -3.483  10.488
  393    HB3  ARG  48           HB3      ARG  48 304.068  -3.602   8.735
  394    HG2  ARG  48           HG2      ARG  48 303.170  -1.121  10.161
  395    HG3  ARG  48           HG3      ARG  48 304.850  -1.433   9.719
  396    HD2  ARG  48           HD2      ARG  48 304.448  -1.234   7.483
  397    HD3  ARG  48           HD3      ARG  48 302.775  -1.750   7.621
  398    HE   ARG  48           HE       ARG  48 302.699   0.613   8.860
  399   HH11  ARG  48          HH11      ARG  48 304.129  -0.314   5.810
  400   HH12  ARG  48          HH12      ARG  48 303.933   1.254   5.103
  401   HH21  ARG  48          HH21      ARG  48 302.446   2.670   7.931
  402   HH22  ARG  48          HH22      ARG  48 302.977   2.949   6.306
  403    H    PHE  49           H        PHE  49 301.281  -4.811   7.497
  404    HA   PHE  49           HA       PHE  49 301.105  -7.340   8.942
  405    HB2  PHE  49           HB2      PHE  49 300.430  -6.652   6.088
  406    HB3  PHE  49           HB3      PHE  49 300.191  -8.219   6.812
  407    HD1  PHE  49           HD1      PHE  49 299.414  -5.996   9.384
  408    HD2  PHE  49           HD2      PHE  49 297.992  -7.422   5.620
  409    HE1  PHE  49           HE1      PHE  49 297.148  -5.308   9.966
  410    HE2  PHE  49           HE2      PHE  49 295.743  -6.687   6.213
  411    HZ   PHE  49           HZ       PHE  49 295.332  -5.626   8.393
  412    H    ARG  50           H        ARG  50 302.249  -9.160   8.414
  413    HA   ARG  50           HA       ARG  50 304.377  -8.961   6.429
  414    HB2  ARG  50           HB2      ARG  50 305.357  -8.880   8.674
  415    HB3  ARG  50           HB3      ARG  50 304.536 -10.352   9.109
  416    HG2  ARG  50           HG2      ARG  50 306.012 -10.546   6.703
  417    HG3  ARG  50           HG3      ARG  50 307.027  -9.987   7.986
  418    HD2  ARG  50           HD2      ARG  50 305.944 -12.602   7.452
  419    HD3  ARG  50           HD3      ARG  50 307.296 -12.142   8.457
  420    HE   ARG  50           HE       ARG  50 304.704 -11.734   9.644
  421   HH11  ARG  50          HH11      ARG  50 307.350 -13.957   9.180
  422   HH12  ARG  50          HH12      ARG  50 306.951 -14.911  10.569
  423   HH21  ARG  50          HH21      ARG  50 304.177 -12.987  11.466
  424   HH22  ARG  50          HH22      ARG  50 305.151 -14.362  11.866
  425    H    PHE  51           H        PHE  51 304.480 -10.669   5.160
  426    HA   PHE  51           HA       PHE  51 302.276 -12.540   5.396
  427    HB2  PHE  51           HB2      PHE  51 302.164 -11.846   3.254
  428    HB3  PHE  51           HB3      PHE  51 303.869 -11.515   3.144
  429    HD1  PHE  51           HD1      PHE  51 301.518 -14.364   3.404
  430    HD2  PHE  51           HD2      PHE  51 305.156 -12.900   1.771
  431    HE1  PHE  51           HE1      PHE  51 301.766 -16.442   2.105
  432    HE2  PHE  51           HE2      PHE  51 305.421 -14.973   0.477
  433    HZ   PHE  51           HZ       PHE  51 303.722 -16.749   0.641
  434    H    ASP  52           H        ASP  52 302.641 -14.697   4.927
  435    HA   ASP  52           HA       ASP  52 304.168 -16.055   6.759
  436    HB2  ASP  52           HB2      ASP  52 302.513 -17.123   5.104
  437    HB3  ASP  52           HB3      ASP  52 303.863 -17.192   3.978
  438    H    GLY  53           H        GLY  53 306.019 -15.061   7.071
  439    HA2  GLY  53           HA2      GLY  53 308.240 -14.572   6.905
  440    HA3  GLY  53           HA3      GLY  53 308.333 -15.812   5.665
  441    H    GLN  54           H        GLN  54 307.016 -12.346   5.959
  442    HA   GLN  54           HA       GLN  54 308.734 -11.368   4.018
  443    HB2  GLN  54           HB2      GLN  54 307.017 -12.981   2.727
  444    HB3  GLN  54           HB3      GLN  54 306.035 -11.523   2.779
  445    HG2  GLN  54           HG2      GLN  54 307.329 -11.717   0.708
  446    HG3  GLN  54           HG3      GLN  54 307.743 -10.274   1.633
  447   HE21  GLN  54          HE21      GLN  54 309.791  -9.974   2.278
  448   HE22  GLN  54          HE22      GLN  54 311.082 -11.088   2.000
  449    HA   PRO  55           HA       PRO  55 307.150  -8.209   6.943
  450    HB2  PRO  55           HB2      PRO  55 308.630  -6.440   5.200
  451    HB3  PRO  55           HB3      PRO  55 308.909  -6.824   6.897
  452    HG2  PRO  55           HG2      PRO  55 310.218  -7.897   4.536
  453    HG3  PRO  55           HG3      PRO  55 310.656  -8.100   6.237
  454    HD2  PRO  55           HD2      PRO  55 309.724 -10.100   4.649
  455    HD3  PRO  55           HD3      PRO  55 309.502 -10.067   6.407
  456    H    ILE  56           H        ILE  56 305.851  -8.771   4.107
  457    HA   ILE  56           HA       ILE  56 304.587  -7.605   2.531
  458    HB   ILE  56           HB       ILE  56 303.286  -7.486   5.189
  459   HG12  ILE  56          HG12      ILE  56 303.648  -9.445   3.202
  460   HG13  ILE  56          HG13      ILE  56 302.857  -9.579   4.757
  461   HG21  ILE  56          HG21      ILE  56 302.047  -6.611   2.602
  462   HG22  ILE  56          HG22      ILE  56 302.275  -5.642   4.059
  463   HG23  ILE  56          HG23      ILE  56 301.137  -6.990   4.070
  464   HD11  ILE  56          HD11      ILE  56 300.789  -9.142   3.909
  465   HD12  ILE  56          HD12      ILE  56 301.532 -10.191   2.697
  466   HD13  ILE  56          HD13      ILE  56 301.426  -8.456   2.419
  467    H    ASN  57           H        ASN  57 303.525  -5.880   1.757
  468    HA   ASN  57           HA       ASN  57 304.134  -3.254   2.909
  469    HB2  ASN  57           HB2      ASN  57 304.810  -4.370   0.309
  470    HB3  ASN  57           HB3      ASN  57 304.007  -2.808   0.208
  471   HD21  ASN  57          HD21      ASN  57 306.380  -4.248   2.414
  472   HD22  ASN  57          HD22      ASN  57 307.527  -2.962   2.292
  473    H    GLU  58           H        GLU  58 302.785  -1.599   1.368
  474    HA   GLU  58           HA       GLU  58 300.037  -2.357   1.887
  475    HB2  GLU  58           HB2      GLU  58 301.527   0.143   1.515
  476    HB3  GLU  58           HB3      GLU  58 299.946   0.149   0.745
  477    HG2  GLU  58           HG2      GLU  58 298.869  -0.341   2.822
  478    HG3  GLU  58           HG3      GLU  58 300.420  -0.562   3.628
  479    H    THR  59           H        THR  59 302.187  -1.915  -0.804
  480    HA   THR  59           HA       THR  59 299.991  -2.124  -2.722
  481    HB   THR  59           HB       THR  59 301.794  -1.709  -4.411
  482    HG1  THR  59           HG1      THR  59 303.425  -1.166  -2.164
  483   HG21  THR  59          HG21      THR  59 302.415   0.594  -2.944
  484   HG22  THR  59          HG22      THR  59 300.769   0.145  -2.498
  485   HG23  THR  59          HG23      THR  59 301.186   0.401  -4.193
  486    H    ASP  60           H        ASP  60 302.063  -4.188  -1.068
  487    HA   ASP  60           HA       ASP  60 302.766  -6.043  -3.069
  488    HB2  ASP  60           HB2      ASP  60 302.568  -6.107  -0.093
  489    HB3  ASP  60           HB3      ASP  60 302.667  -7.642  -0.948
  490    H    THR  61           H        THR  61 301.759  -7.869  -3.836
  491    HA   THR  61           HA       THR  61 298.992  -8.314  -2.952
  492    HB   THR  61           HB       THR  61 298.136  -8.358  -5.050
  493    HG1  THR  61           HG1      THR  61 299.295  -9.822  -6.118
  494   HG21  THR  61          HG21      THR  61 298.700  -6.453  -6.213
  495   HG22  THR  61          HG22      THR  61 300.419  -6.618  -5.852
  496   HG23  THR  61          HG23      THR  61 299.300  -6.100  -4.592
  497    HA   PRO  62           HA       PRO  62 299.648 -12.571  -2.210
  498    HB2  PRO  62           HB2      PRO  62 297.598 -13.006  -4.330
  499    HB3  PRO  62           HB3      PRO  62 297.651 -13.645  -2.688
  500    HG2  PRO  62           HG2      PRO  62 296.051 -11.592  -3.528
  501    HG3  PRO  62           HG3      PRO  62 296.568 -11.832  -1.847
  502    HD2  PRO  62           HD2      PRO  62 297.309  -9.735  -3.700
  503    HD3  PRO  62           HD3      PRO  62 297.685  -9.877  -1.978
  504    H    ALA  63           H        ALA  63 299.032 -11.749  -5.668
  505    HA   ALA  63           HA       ALA  63 300.426 -13.912  -6.825
  506    HB1  ALA  63           HB1      ALA  63 298.848 -12.243  -7.918
  507    HB2  ALA  63           HB2      ALA  63 300.307 -12.654  -8.822
  508    HB3  ALA  63           HB3      ALA  63 300.223 -11.128  -7.920
  509    H    GLN  64           H        GLN  64 301.229 -10.702  -5.891
  510    HA   GLN  64           HA       GLN  64 303.893 -10.574  -6.823
  511    HB2  GLN  64           HB2      GLN  64 301.896  -8.973  -5.588
  512    HB3  GLN  64           HB3      GLN  64 303.318  -8.869  -4.607
  513    HG2  GLN  64           HG2      GLN  64 303.309  -8.415  -7.559
  514    HG3  GLN  64           HG3      GLN  64 303.064  -7.127  -6.382
  515   HE21  GLN  64          HE21      GLN  64 304.787  -6.471  -5.084
  516   HE22  GLN  64          HE22      GLN  64 306.426  -6.861  -5.469
  517    H    LEU  65           H        LEU  65 302.260 -11.837  -4.130
  518    HA   LEU  65           HA       LEU  65 304.718 -12.293  -2.604
  519    HB2  LEU  65           HB2      LEU  65 301.817 -12.066  -1.889
  520    HB3  LEU  65           HB3      LEU  65 302.993 -12.643  -0.752
  521    HG   LEU  65           HG       LEU  65 302.731  -9.913  -1.977
  522   HD11  LEU  65          HD11      LEU  65 302.378  -9.133   0.153
  523   HD12  LEU  65          HD12      LEU  65 303.164 -10.521   0.911
  524   HD13  LEU  65          HD13      LEU  65 301.566 -10.696   0.189
  525   HD21  LEU  65          HD21      LEU  65 305.033 -10.381  -2.194
  526   HD22  LEU  65          HD22      LEU  65 305.113 -11.093  -0.582
  527   HD23  LEU  65          HD23      LEU  65 304.851  -9.358  -0.769
  528    H    GLU  66           H        GLU  66 302.961 -13.822  -4.796
  529    HA   GLU  66           HA       GLU  66 302.398 -15.954  -5.335
  530    HB2  GLU  66           HB2      GLU  66 304.901 -16.341  -3.690
  531    HB3  GLU  66           HB3      GLU  66 304.101 -17.681  -4.501
  532    HG2  GLU  66           HG2      GLU  66 304.384 -16.523  -6.651
  533    HG3  GLU  66           HG3      GLU  66 305.241 -15.226  -5.818
  534    H    MET  67           H        MET  67 300.855 -14.978  -3.329
  535    HA   MET  67           HA       MET  67 300.699 -16.896  -1.163
  536    HB2  MET  67           HB2      MET  67 299.185 -14.405  -1.882
  537    HB3  MET  67           HB3      MET  67 298.639 -15.453  -0.598
  538    HG2  MET  67           HG2      MET  67 301.212 -15.136   0.110
  539    HG3  MET  67           HG3      MET  67 300.908 -13.595  -0.691
  540    HE1  MET  67           HE1      MET  67 299.866 -11.823   0.036
  541    HE2  MET  67           HE2      MET  67 300.722 -11.740   1.574
  542    HE3  MET  67           HE3      MET  67 298.968 -11.552   1.527
  543    H    GLU  68           H        GLU  68 298.549 -17.875  -0.634
  544    HA   GLU  68           HA       GLU  68 297.159 -18.727  -3.096
  545    HB2  GLU  68           HB2      GLU  68 298.358 -20.299  -0.989
  546    HB3  GLU  68           HB3      GLU  68 296.642 -20.648  -1.146
  547    HG2  GLU  68           HG2      GLU  68 296.885 -21.569  -3.214
  548    HG3  GLU  68           HG3      GLU  68 298.273 -20.563  -3.628
  549    H    ASP  69           H        ASP  69 295.111 -20.030  -2.253
  550    HA   ASP  69           HA       ASP  69 293.491 -18.014  -0.962
  551    HB2  ASP  69           HB2      ASP  69 291.670 -18.956  -1.991
  552    HB3  ASP  69           HB3      ASP  69 292.948 -19.374  -3.122
  553    H    GLU  70           H        GLU  70 293.530 -17.984   1.001
  554    HA   GLU  70           HA       GLU  70 292.678 -18.643   3.130
  555    HB2  GLU  70           HB2      GLU  70 293.538 -21.422   2.300
  556    HB3  GLU  70           HB3      GLU  70 292.932 -21.003   3.893
  557    HG2  GLU  70           HG2      GLU  70 290.829 -20.209   2.796
  558    HG3  GLU  70           HG3      GLU  70 291.438 -20.890   1.288
  559    H    ASP  71           H        ASP  71 295.506 -18.357   1.667
  560    HA   ASP  71           HA       ASP  71 297.465 -19.308   3.350
  561    HB2  ASP  71           HB2      ASP  71 297.443 -17.741   1.112
  562    HB3  ASP  71           HB3      ASP  71 297.943 -16.578   2.332
  563    H    THR  72           H        THR  72 298.897 -17.225   4.393
  564    HA   THR  72           HA       THR  72 297.060 -15.941   6.287
  565    HB   THR  72           HB       THR  72 299.515 -17.475   7.078
  566    HG1  THR  72           HG1      THR  72 297.003 -17.898   8.188
  567   HG21  THR  72          HG21      THR  72 298.569 -15.195   8.316
  568   HG22  THR  72          HG22      THR  72 299.617 -16.421   9.027
  569   HG23  THR  72          HG23      THR  72 297.870 -16.521   9.244
  570    H    ILE  73           H        ILE  73 297.407 -13.978   6.592
  571    HA   ILE  73           HA       ILE  73 299.895 -12.681   5.726
  572    HB   ILE  73           HB       ILE  73 297.026 -11.764   5.949
  573   HG12  ILE  73          HG12      ILE  73 297.734 -11.969   3.770
  574   HG13  ILE  73          HG13      ILE  73 297.972 -10.270   4.118
  575   HG21  ILE  73          HG21      ILE  73 297.782  -9.391   6.149
  576   HG22  ILE  73          HG22      ILE  73 299.406  -9.971   6.529
  577   HG23  ILE  73          HG23      ILE  73 298.063 -10.328   7.615
  578   HD11  ILE  73          HD11      ILE  73 299.967 -12.388   3.759
  579   HD12  ILE  73          HD12      ILE  73 300.330 -10.985   4.768
  580   HD13  ILE  73          HD13      ILE  73 299.889 -10.766   3.077
  581    H    ASP  74           H        ASP  74 301.140 -11.849   7.355
  582    HA   ASP  74           HA       ASP  74 300.161 -12.354  10.072
  583    HB2  ASP  74           HB2      ASP  74 303.013 -11.662   9.410
  584    HB3  ASP  74           HB3      ASP  74 302.382 -12.527  10.806
  585    H    VAL  75           H        VAL  75 300.175 -10.779  11.633
  586    HA   VAL  75           HA       VAL  75 300.432  -8.064  10.554
  587    HB   VAL  75           HB       VAL  75 298.528  -9.193  12.512
  588   HG11  VAL  75          HG11      VAL  75 299.630  -7.711  14.028
  589   HG12  VAL  75          HG12      VAL  75 298.174  -6.880  13.472
  590   HG13  VAL  75          HG13      VAL  75 299.746  -6.450  12.791
  591   HG21  VAL  75          HG21      VAL  75 297.999  -6.714  11.045
  592   HG22  VAL  75          HG22      VAL  75 296.999  -8.153  11.242
  593   HG23  VAL  75          HG23      VAL  75 298.305  -8.140  10.054
  594    H    PHE  76           H        PHE  76 301.743  -6.679  11.362
  595    HA   PHE  76           HA       PHE  76 302.978  -7.046  13.958
  596    HB2  PHE  76           HB2      PHE  76 304.412  -6.467  11.408
  597    HB3  PHE  76           HB3      PHE  76 305.135  -6.297  12.977
  598    HD1  PHE  76           HD1      PHE  76 304.472  -8.587  14.430
  599    HD2  PHE  76           HD2      PHE  76 305.389  -8.334  10.261
  600    HE1  PHE  76           HE1      PHE  76 305.251 -10.917  14.459
  601    HE2  PHE  76           HE2      PHE  76 306.165 -10.648  10.312
  602    HZ   PHE  76           HZ       PHE  76 306.102 -11.950  12.396
  603    H    GLN  77           H        GLN  77 302.678  -5.221  14.888
  604    HA   GLN  77           HA       GLN  77 301.868  -2.930  13.320
  605    HB2  GLN  77           HB2      GLN  77 301.260  -3.959  15.938
  606    HB3  GLN  77           HB3      GLN  77 301.634  -2.242  16.009
  607    HG2  GLN  77           HG2      GLN  77 299.826  -1.688  14.674
  608    HG3  GLN  77           HG3      GLN  77 299.748  -3.297  13.943
  609   HE21  GLN  77          HE21      GLN  77 298.722  -4.956  15.047
  610   HE22  GLN  77          HE22      GLN  77 297.661  -4.664  16.379
  611    H    GLN  78           H        GLN  78 303.232  -1.379  12.781
  612    HA   GLN  78           HA       GLN  78 305.100  -0.169  12.610
  613    HB2  GLN  78           HB2      GLN  78 304.033   0.198  15.212
  614    HB3  GLN  78           HB3      GLN  78 305.788   0.205  15.358
  615    HG2  GLN  78           HG2      GLN  78 305.998   2.160  14.281
  616    HG3  GLN  78           HG3      GLN  78 304.724   1.774  13.122
  617   HE21  GLN  78          HE21      GLN  78 303.640   3.682  13.245
  618   HE22  GLN  78          HE22      GLN  78 302.815   4.230  14.661
  619    H    GLN  79           H        GLN  79 307.461   0.114  13.749
  620    HA   GLN  79           HA       GLN  79 309.534  -0.841  13.668
  621    HB2  GLN  79           HB2      GLN  79 309.999  -2.450  15.348
  622    HB3  GLN  79           HB3      GLN  79 308.699  -1.458  15.987
  623    HG2  GLN  79           HG2      GLN  79 307.239  -3.166  16.038
  624    HG3  GLN  79           HG3      GLN  79 307.853  -3.884  14.551
  625   HE21  GLN  79          HE21      GLN  79 308.791  -5.768  14.794
  626   HE22  GLN  79          HE22      GLN  79 309.602  -6.333  16.212
  627    H    THR  80           H        THR  80 307.745  -1.432  11.568
  628    HA   THR  80           HA       THR  80 308.859  -3.965  10.588
  629    HB   THR  80           HB       THR  80 306.001  -3.167  10.875
  630    HG1  THR  80           HG1      THR  80 307.361  -5.648  11.052
  631   HG21  THR  80          HG21      THR  80 305.531  -5.107   9.272
  632   HG22  THR  80          HG22      THR  80 307.136  -4.743   8.631
  633   HG23  THR  80          HG23      THR  80 305.874  -3.505   8.610
  634    H    GLY  81           H        GLY  81 309.000  -4.125   8.291
  635    HA2  GLY  81           HA2      GLY  81 308.098  -2.451   6.350
  636    HA3  GLY  81           HA3      GLY  81 309.475  -1.585   7.010
  637    H    GLY  82           H        GLY  82 308.561  -3.574   4.577
  638    HA2  GLY  82           HA2      GLY  82 310.822  -3.920   3.241
  639    HA3  GLY  82           HA3      GLY  82 311.023  -5.146   4.481
  640    H1   GLY   1           HT1      GLY   1 307.129   6.243  13.680
  641    H2   GLY   1           HT2      GLY   1 307.572   6.615  12.091
  642    H3   GLY   1           HT3      GLY   1 307.449   7.846  13.243
  643    HA2  GLY   1           HA3      GLY   1 309.764   7.302  12.813
  644    HA3  GLY   1           HA2      GLY   1 309.307   6.960  14.475
  645    H    SER   2           H        SER   2 308.758   5.132  11.472
  646    HA   SER   2           HA       SER   2 309.353   2.647  12.693
  647    HB2  SER   2           HB2      SER   2 308.061   3.346  10.424
  648    HB3  SER   2           HB3      SER   2 309.613   2.854   9.747
  649    HG   SER   2           HG       SER   2 308.165   1.257  11.582
  650    H    GLU   3           H        GLU   3 311.406   3.252  13.668
  651    HA   GLU   3           HA       GLU   3 313.686   3.580  13.710
  652    HB2  GLU   3           HB2      GLU   3 312.971   1.047  13.461
  653    HB3  GLU   3           HB3      GLU   3 313.877   1.169  11.964
  654    HG2  GLU   3           HG2      GLU   3 315.653   2.273  13.630
  655    HG3  GLU   3           HG3      GLU   3 314.814   1.210  14.759
  656    H    GLU   4           H        GLU   4 314.051   1.991  10.601
  657    HA   GLU   4           HA       GLU   4 314.199   4.242   8.949
  658    HB2  GLU   4           HB2      GLU   4 316.768   4.289   8.780
  659    HB3  GLU   4           HB3      GLU   4 316.011   5.119  10.129
  660    HG2  GLU   4           HG2      GLU   4 316.420   2.656  11.192
  661    HG3  GLU   4           HG3      GLU   4 317.796   2.796  10.102
  662    H    LYS   5           H        LYS   5 315.919   3.755   7.066
  663    HA   LYS   5           HA       LYS   5 315.301   2.224   5.203
  664    HB2  LYS   5           HB2      LYS   5 317.495   1.701   4.558
  665    HB3  LYS   5           HB3      LYS   5 317.607   3.175   5.506
  666    HG2  LYS   5           HG2      LYS   5 318.101   0.447   6.621
  667    HG3  LYS   5           HG3      LYS   5 319.368   1.474   5.966
  668    HD2  LYS   5           HD2      LYS   5 317.571   2.094   8.305
  669    HD3  LYS   5           HD3      LYS   5 319.291   1.705   8.376
  670    HE2  LYS   5           HE2      LYS   5 319.600   3.743   6.840
  671    HE3  LYS   5           HE3      LYS   5 317.962   4.174   7.311
  672    HZ1  LYS   5           HZ1      LYS   5 318.699   4.947   9.241
  673    HZ2  LYS   5           HZ2      LYS   5 320.280   4.745   8.675
  674    HZ3  LYS   5           HZ3      LYS   5 319.545   3.521   9.580
  675    HA   PRO   6           HA       PRO   6 314.037  -1.895   6.478
  676    HB2  PRO   6           HB2      PRO   6 314.764  -2.532   3.659
  677    HB3  PRO   6           HB3      PRO   6 313.273  -2.906   4.528
  678    HG2  PRO   6           HG2      PRO   6 313.333  -0.953   2.732
  679    HG3  PRO   6           HG3      PRO   6 312.440  -0.736   4.248
  680    HD2  PRO   6           HD2      PRO   6 315.100   0.369   3.433
  681    HD3  PRO   6           HD3      PRO   6 313.807   1.130   4.385
  682    H    LYS   7           H        LYS   7 315.358  -3.277   7.577
  683    HA   LYS   7           HA       LYS   7 318.138  -3.526   6.988
  684    HB2  LYS   7           HB2      LYS   7 316.214  -4.900   8.829
  685    HB3  LYS   7           HB3      LYS   7 317.755  -5.680   8.501
  686    HG2  LYS   7           HG2      LYS   7 317.466  -2.870   9.541
  687    HG3  LYS   7           HG3      LYS   7 317.740  -4.290  10.553
  688    HD2  LYS   7           HD2      LYS   7 319.910  -3.720  10.287
  689    HD3  LYS   7           HD3      LYS   7 319.732  -4.596   8.765
  690    HE2  LYS   7           HE2      LYS   7 320.419  -2.727   7.761
  691    HE3  LYS   7           HE3      LYS   7 318.838  -2.055   8.158
  692    HZ1  LYS   7           HZ1      LYS   7 321.429  -1.602   9.447
  693    HZ2  LYS   7           HZ2      LYS   7 320.039  -1.532  10.409
  694    HZ3  LYS   7           HZ3      LYS   7 320.199  -0.499   9.080
  695    H    GLU   8           H        GLU   8 318.017  -3.970   4.738
  696    HA   GLU   8           HA       GLU   8 318.045  -5.319   2.891
  697    HB2  GLU   8           HB2      GLU   8 318.719  -7.048   5.101
  698    HB3  GLU   8           HB3      GLU   8 317.740  -7.935   3.942
  699    HG2  GLU   8           HG2      GLU   8 320.135  -6.343   3.099
  700    HG3  GLU   8           HG3      GLU   8 320.267  -8.008   3.663
  701    H    GLY   9           H        GLY   9 315.807  -4.200   2.977
  702    HA2  GLY   9           HA2      GLY   9 313.760  -6.292   2.759
  703    HA3  GLY   9           HA3      GLY   9 313.424  -4.823   3.642
  704    H    VAL  10           H        VAL  10 314.652  -5.833   0.435
  705    HA   VAL  10           HA       VAL  10 313.002  -3.706  -0.752
  706    HB   VAL  10           HB       VAL  10 315.350  -3.222  -1.035
  707   HG11  VAL  10          HG11      VAL  10 315.692  -5.887  -2.379
  708   HG12  VAL  10          HG12      VAL  10 316.065  -5.604  -0.677
  709   HG13  VAL  10          HG13      VAL  10 316.941  -4.725  -1.932
  710   HG21  VAL  10          HG21      VAL  10 313.619  -3.114  -3.012
  711   HG22  VAL  10          HG22      VAL  10 314.663  -4.355  -3.706
  712   HG23  VAL  10          HG23      VAL  10 315.327  -2.775  -3.291
  713    H    LYS  11           H        LYS  11 311.672  -4.217  -2.307
  714    HA   LYS  11           HA       LYS  11 311.671  -6.919  -3.448
  715    HB2  LYS  11           HB2      LYS  11 309.506  -5.462  -2.040
  716    HB3  LYS  11           HB3      LYS  11 309.118  -6.635  -3.295
  717    HG2  LYS  11           HG2      LYS  11 309.164  -8.016  -1.530
  718    HG3  LYS  11           HG3      LYS  11 310.837  -8.097  -1.977
  719    HD2  LYS  11           HD2      LYS  11 310.485  -7.828   0.464
  720    HD3  LYS  11           HD3      LYS  11 311.473  -6.575  -0.275
  721    HE2  LYS  11           HE2      LYS  11 309.088  -5.377  -0.434
  722    HE3  LYS  11           HE3      LYS  11 308.790  -6.404   0.960
  723    HZ1  LYS  11           HZ3      LYS  11 310.911  -5.456   1.901
  724    H    THR  12           H        THR  12 309.518  -4.204  -3.583
  725    HA   THR  12           HA       THR  12 309.859  -3.936  -6.490
  726    HB   THR  12           HB       THR  12 307.887  -2.426  -6.359
  727    HG1  THR  12           HG1      THR  12 307.010  -1.886  -4.489
  728   HG21  THR  12          HG21      THR  12 307.220  -4.916  -4.832
  729   HG22  THR  12          HG22      THR  12 307.610  -4.934  -6.552
  730   HG23  THR  12          HG23      THR  12 306.217  -4.020  -5.972
  731    H    GLU  13           H        GLU  13 309.506  -1.191  -6.942
  732    HA   GLU  13           HA       GLU  13 311.996  -0.195  -5.987
  733    HB2  GLU  13           HB2      GLU  13 309.740   1.256  -7.396
  734    HB3  GLU  13           HB3      GLU  13 311.387   1.839  -7.208
  735    HG2  GLU  13           HG2      GLU  13 311.595   1.017  -9.291
  736    HG3  GLU  13           HG3      GLU  13 311.899  -0.484  -8.417
  737    H    ASN  14           H        ASN  14 308.772   1.285  -5.739
  738    HA   ASN  14           HA       ASN  14 309.296   2.909  -3.583
  739    HB2  ASN  14           HB2      ASN  14 307.374   3.001  -5.176
  740    HB3  ASN  14           HB3      ASN  14 306.631   1.754  -4.176
  741   HD21  ASN  14          HD21      ASN  14 307.694   5.057  -4.303
  742   HD22  ASN  14          HD22      ASN  14 306.825   5.604  -2.915
  743    H    ASP  15           H        ASP  15 310.597   1.470  -2.298
  744    HA   ASP  15           HA       ASP  15 309.159   0.572   0.004
  745    HB2  ASP  15           HB2      ASP  15 310.165  -1.385  -1.965
  746    HB3  ASP  15           HB3      ASP  15 310.690  -1.689  -0.311
  747    H    HIS  16           H        HIS  16 311.085   2.550  -0.743
  748    HA   HIS  16           HA       HIS  16 313.253   3.244  -0.493
  749    HB2  HIS  16           HB2      HIS  16 312.287   2.840   2.313
  750    HB3  HIS  16           HB3      HIS  16 313.477   3.983   1.752
  751    HD1  HIS  16           HD1      HIS  16 309.780   3.309   1.422
  752    HD2  HIS  16           HD2      HIS  16 312.541   6.373   0.917
  753    HE1  HIS  16           HE1      HIS  16 308.413   5.370   0.962
  754    HE2  HIS  16           HE2      HIS  16 310.107   7.199   0.581
  755    H    ILE  17           H        ILE  17 315.309   2.898  -0.138
  756    HA   ILE  17           HA       ILE  17 316.217   0.609   1.435
  757    HB   ILE  17           HB       ILE  17 317.741  -0.206  -0.173
  758   HG12  ILE  17          HG12      ILE  17 316.995   2.172  -1.854
  759   HG13  ILE  17          HG13      ILE  17 318.556   1.826  -1.159
  760   HG21  ILE  17          HG21      ILE  17 315.747  -0.058  -2.231
  761   HG22  ILE  17          HG22      ILE  17 314.986  -0.268  -0.651
  762   HG23  ILE  17          HG23      ILE  17 316.203  -1.421  -1.205
  763   HD11  ILE  17          HD11      ILE  17 319.163   0.946  -3.066
  764   HD12  ILE  17          HD12      ILE  17 317.518   1.094  -3.708
  765   HD13  ILE  17          HD13      ILE  17 317.981  -0.346  -2.801
  766    H    ASN  18           H        ASN  18 318.374   0.873   2.205
  767    HA   ASN  18           HA       ASN  18 319.091   3.651   2.410
  768    HB2  ASN  18           HB2      ASN  18 319.310   1.523   4.138
  769    HB3  ASN  18           HB3      ASN  18 320.939   1.639   3.517
  770   HD21  ASN  18          HD21      ASN  18 318.638   4.214   4.076
  771   HD22  ASN  18          HD22      ASN  18 319.607   5.043   5.231
  772    H    LEU  19           H        LEU  19 320.447   4.575   0.962
  773    HA   LEU  19           HA       LEU  19 322.190   2.806  -0.575
  774    HB2  LEU  19           HB2      LEU  19 320.617   5.103  -1.203
  775    HB3  LEU  19           HB3      LEU  19 322.291   5.469  -1.576
  776    HG   LEU  19           HG       LEU  19 320.578   3.207  -2.650
  777   HD11  LEU  19          HD11      LEU  19 321.247   4.120  -4.834
  778   HD12  LEU  19          HD12      LEU  19 322.017   5.469  -3.993
  779   HD13  LEU  19          HD13      LEU  19 320.278   5.224  -3.865
  780   HD21  LEU  19          HD21      LEU  19 322.310   1.937  -3.152
  781   HD22  LEU  19          HD22      LEU  19 323.279   2.941  -2.059
  782   HD23  LEU  19          HD23      LEU  19 323.234   3.302  -3.785
  783    H    LYS  20           H        LYS  20 324.198   2.659   0.007
  784    HA   LYS  20           HA       LYS  20 325.396   4.599   1.775
  785    HB2  LYS  20           HB2      LYS  20 325.686   1.875   1.224
  786    HB3  LYS  20           HB3      LYS  20 327.181   2.580   0.770
  787    HG2  LYS  20           HG2      LYS  20 327.635   3.282   2.843
  788    HG3  LYS  20           HG3      LYS  20 325.972   3.296   3.333
  789    HD2  LYS  20           HD2      LYS  20 327.857   1.372   3.900
  790    HD3  LYS  20           HD3      LYS  20 326.121   1.231   4.145
  791    HE2  LYS  20           HE2      LYS  20 325.925  -0.292   2.527
  792    HE3  LYS  20           HE3      LYS  20 326.972   0.600   1.427
  793    HZ1  LYS  20           HZ1      LYS  20 327.957  -1.051   3.683
  794    HZ2  LYS  20           HZ2      LYS  20 328.890  -0.317   2.478
  795    HZ3  LYS  20           HZ3      LYS  20 327.852  -1.593   2.083
  796    H    VAL  21           H        VAL  21 326.901   6.138   1.141
  797    HA   VAL  21           HA       VAL  21 327.924   5.922  -1.607
  798    HB   VAL  21           HB       VAL  21 327.914   8.582  -0.267
  799   HG11  VAL  21          HG11      VAL  21 327.202   7.859  -3.091
  800   HG12  VAL  21          HG12      VAL  21 328.879   7.946  -2.550
  801   HG13  VAL  21          HG13      VAL  21 327.847   9.377  -2.467
  802   HG21  VAL  21          HG21      VAL  21 325.576   8.812  -1.487
  803   HG22  VAL  21          HG22      VAL  21 325.679   8.263   0.188
  804   HG23  VAL  21          HG23      VAL  21 325.473   7.091  -1.115
  805    H    ALA  22           H        ALA  22 330.084   5.727  -1.766
  806    HA   ALA  22           HA       ALA  22 331.683   6.082   0.665
  807    HB1  ALA  22           HB1      ALA  22 333.138   4.813  -1.446
  808    HB2  ALA  22           HB2      ALA  22 331.559   4.040  -1.274
  809    HB3  ALA  22           HB3      ALA  22 332.643   4.154   0.115
  810    H    GLY  23           H        GLY  23 332.622   8.023   0.789
  811    HA2  GLY  23           HA2      GLY  23 333.416   9.326  -1.714
  812    HA3  GLY  23           HA3      GLY  23 333.125  10.149  -0.203
  813    H    GLN  24           H        GLN  24 335.347   9.878  -2.272
  814    HA   GLN  24           HA       GLN  24 337.600   9.966  -2.367
  815    HB2  GLN  24           HB2      GLN  24 337.256  10.750   0.497
  816    HB3  GLN  24           HB3      GLN  24 338.692  11.017  -0.472
  817    HG2  GLN  24           HG2      GLN  24 337.120  12.251  -2.077
  818    HG3  GLN  24           HG3      GLN  24 335.999  12.282  -0.717
  819   HE21  GLN  24          HE21      GLN  24 336.231  13.808   0.789
  820   HE22  GLN  24          HE22      GLN  24 337.549  14.921   0.887
  821    H    ASP  25           H        ASP  25 336.367   7.412  -1.404
  822    HA   ASP  25           HA       ASP  25 336.978   5.384  -0.584
  823    HB2  ASP  25           HB2      ASP  25 339.088   4.563  -1.362
  824    HB3  ASP  25           HB3      ASP  25 338.467   5.671  -2.580
  825    H    GLY  26           H        GLY  26 336.926   7.387   1.404
  826    HA2  GLY  26           HA2      GLY  26 339.110   6.524   3.159
  827    HA3  GLY  26           HA3      GLY  26 338.314   8.081   3.292
  828    H    SER  27           H        SER  27 335.733   6.549   2.658
  829    HA   SER  27           HA       SER  27 335.161   4.742   4.714
  830    HB2  SER  27           HB2      SER  27 335.573   7.042   5.941
  831    HB3  SER  27           HB3      SER  27 333.945   7.404   5.368
  832    HG   SER  27           HG       SER  27 333.528   6.426   7.228
  833    H    VAL  28           H        VAL  28 332.474   5.726   5.206
  834    HA   VAL  28           HA       VAL  28 331.300   5.931   2.566
  835    HB   VAL  28           HB       VAL  28 331.562   3.561   2.703
  836   HG11  VAL  28          HG11      VAL  28 330.773   2.220   4.549
  837   HG12  VAL  28          HG12      VAL  28 330.162   3.657   5.370
  838   HG13  VAL  28          HG13      VAL  28 331.900   3.445   5.136
  839   HG21  VAL  28          HG21      VAL  28 329.351   4.487   1.890
  840   HG22  VAL  28          HG22      VAL  28 328.681   4.096   3.476
  841   HG23  VAL  28          HG23      VAL  28 329.295   2.809   2.432
  842    H    VAL  29           H        VAL  29 329.026   6.256   2.616
  843    HA   VAL  29           HA       VAL  29 327.967   7.145   5.203
  844    HB   VAL  29           HB       VAL  29 326.545   8.759   3.708
  845   HG11  VAL  29          HG11      VAL  29 328.061  10.564   4.243
  846   HG12  VAL  29          HG12      VAL  29 329.376   9.411   4.480
  847   HG13  VAL  29          HG13      VAL  29 327.980   9.394   5.563
  848   HG21  VAL  29          HG21      VAL  29 329.094   8.721   2.125
  849   HG22  VAL  29          HG22      VAL  29 327.634   9.657   1.811
  850   HG23  VAL  29          HG23      VAL  29 327.617   7.907   1.618
  851    H    GLN  30           H        GLN  30 325.712   6.895   5.393
  852    HA   GLN  30           HA       GLN  30 324.653   4.960   3.441
  853    HB2  GLN  30           HB2      GLN  30 324.879   4.893   6.308
  854    HB3  GLN  30           HB3      GLN  30 323.250   4.521   5.780
  855    HG2  GLN  30           HG2      GLN  30 324.328   2.837   4.223
  856    HG3  GLN  30           HG3      GLN  30 325.823   3.117   5.124
  857   HE21  GLN  30          HE21      GLN  30 323.680   0.877   4.807
  858   HE22  GLN  30          HE22      GLN  30 323.460   0.335   6.433
  859    H    PHE  31           H        PHE  31 323.275   5.930   2.227
  860    HA   PHE  31           HA       PHE  31 321.478   7.996   3.221
  861    HB2  PHE  31           HB2      PHE  31 322.112   6.987   0.415
  862    HB3  PHE  31           HB3      PHE  31 321.000   8.255   0.746
  863    HD1  PHE  31           HD2      PHE  31 323.563   8.495   3.128
  864    HD2  PHE  31           HD1      PHE  31 322.742   9.348  -0.949
  865    HE1  PHE  31           HE2      PHE  31 325.397  10.110   3.096
  866    HE2  PHE  31           HE1      PHE  31 324.572  10.975  -0.985
  867    HZ   PHE  31           HZ       PHE  31 325.905  11.355   1.047
  868    H    LYS  32           H        LYS  32 319.205   7.868   2.378
  869    HA   LYS  32           HA       LYS  32 318.344   5.091   2.066
  870    HB2  LYS  32           HB2      LYS  32 317.650   5.698   4.325
  871    HB3  LYS  32           HB3      LYS  32 316.891   7.142   3.709
  872    HG2  LYS  32           HG2      LYS  32 315.066   6.036   2.917
  873    HG3  LYS  32           HG3      LYS  32 316.005   4.608   2.512
  874    HD2  LYS  32           HD2      LYS  32 314.574   3.960   4.238
  875    HD3  LYS  32           HD3      LYS  32 316.171   4.150   4.964
  876    HE2  LYS  32           HE2      LYS  32 314.749   5.184   6.471
  877    HE3  LYS  32           HE3      LYS  32 315.432   6.512   5.534
  878    HZ1  LYS  32           HZ1      LYS  32 312.880   6.375   5.984
  879    HZ2  LYS  32           HZ2      LYS  32 312.898   5.326   4.658
  880    HZ3  LYS  32           HZ3      LYS  32 313.457   6.913   4.487
  881    H    ILE  33           H        ILE  33 317.180   4.778   0.407
  882    HA   ILE  33           HA       ILE  33 315.672   6.861  -0.899
  883    HB   ILE  33           HB       ILE  33 318.015   7.337  -1.607
  884   HG12  ILE  33          HG12      ILE  33 316.839   6.264  -4.111
  885   HG13  ILE  33          HG13      ILE  33 315.758   7.272  -3.172
  886   HG21  ILE  33          HG21      ILE  33 318.308   5.092  -3.394
  887   HG22  ILE  33          HG22      ILE  33 318.226   4.577  -1.708
  888   HG23  ILE  33          HG23      ILE  33 319.424   5.766  -2.209
  889   HD11  ILE  33          HD11      ILE  33 317.682   8.964  -3.146
  890   HD12  ILE  33          HD12      ILE  33 316.766   8.746  -4.638
  891   HD13  ILE  33          HD13      ILE  33 318.351   7.993  -4.459
  892    H    LYS  34           H        LYS  34 314.038   6.009  -2.037
  893    HA   LYS  34           HA       LYS  34 313.487   3.275  -1.948
  894    HB2  LYS  34           HB2      LYS  34 311.692   4.824  -2.184
  895    HB3  LYS  34           HB3      LYS  34 312.404   5.493  -3.628
  896    HG2  LYS  34           HG2      LYS  34 312.030   3.159  -4.647
  897    HG3  LYS  34           HG3      LYS  34 310.942   2.936  -3.286
  898    HD2  LYS  34           HD2      LYS  34 309.757   3.730  -5.291
  899    HD3  LYS  34           HD3      LYS  34 309.645   4.876  -3.956
  900    HE2  LYS  34           HE2      LYS  34 311.496   6.169  -4.981
  901    HE3  LYS  34           HE3      LYS  34 311.475   5.055  -6.341
  902    HZ1  LYS  34           HZ1      LYS  34 310.151   6.740  -7.102
  903    HZ2  LYS  34           HZ2      LYS  34 309.504   7.089  -5.578
  904    HZ3  LYS  34           HZ3      LYS  34 308.981   5.721  -6.424
  905    H    ARG  35           H        ARG  35 313.255   4.524  -5.158
  906    HA   ARG  35           HA       ARG  35 315.666   3.469  -6.188
  907    HB2  ARG  35           HB2      ARG  35 313.175   1.891  -6.823
  908    HB3  ARG  35           HB3      ARG  35 314.785   1.611  -7.434
  909    HG2  ARG  35           HG2      ARG  35 315.134   1.428  -4.733
  910    HG3  ARG  35           HG3      ARG  35 313.544   0.717  -4.984
  911    HD2  ARG  35           HD2      ARG  35 316.121  -0.039  -6.312
  912    HD3  ARG  35           HD3      ARG  35 315.228  -0.982  -5.123
  913    HE   ARG  35           HE       ARG  35 313.710  -0.388  -7.484
  914   HH11  ARG  35          HH11      ARG  35 316.011  -2.589  -6.055
  915   HH12  ARG  35          HH12      ARG  35 315.592  -3.904  -7.101
  916   HH21  ARG  35          HH21      ARG  35 313.158  -2.117  -8.862
  917   HH22  ARG  35          HH22      ARG  35 313.973  -3.637  -8.695
  918    H    HIS  36           H        HIS  36 312.286   3.504  -7.263
  919    HA   HIS  36           HA       HIS  36 312.652   4.435  -9.812
  920    HB2  HIS  36           HB2      HIS  36 310.522   3.592  -9.137
  921    HB3  HIS  36           HB3      HIS  36 310.329   4.831  -7.908
  922    HD1  HIS  36           HD1      HIS  36 308.884   3.989 -10.917
  923    HD2  HIS  36           HD2      HIS  36 310.570   7.526  -9.553
  924    HE1  HIS  36           HE1      HIS  36 307.895   5.799 -12.354
  925    HE2  HIS  36           HE2      HIS  36 309.007   7.922 -11.576
  926    H    THR  37           H        THR  37 312.964   6.185  -6.866
  927    HA   THR  37           HA       THR  37 312.736   8.823  -8.050
  928    HB   THR  37           HB       THR  37 313.852   7.845  -5.396
  929    HG1  THR  37           HG1      THR  37 311.504   7.946  -5.862
  930   HG21  THR  37          HG21      THR  37 313.312  10.729  -5.904
  931   HG22  THR  37          HG22      THR  37 314.861  10.054  -6.411
  932   HG23  THR  37          HG23      THR  37 314.370   9.967  -4.718
  933    HA   PRO  38           HA       PRO  38 316.606   9.106  -9.940
  934    HB2  PRO  38           HB2      PRO  38 316.389  11.967  -9.188
  935    HB3  PRO  38           HB3      PRO  38 316.499  11.226 -10.801
  936    HG2  PRO  38           HG2      PRO  38 314.156  12.186  -9.982
  937    HG3  PRO  38           HG3      PRO  38 314.216  10.621 -10.793
  938    HD2  PRO  38           HD2      PRO  38 314.151  11.247  -7.870
  939    HD3  PRO  38           HD3      PRO  38 313.071  10.195  -8.812
  940    H    LEU  39           H        LEU  39 318.783   9.388  -9.484
  941    HA   LEU  39           HA       LEU  39 319.451   9.147  -6.727
  942    HB2  LEU  39           HB2      LEU  39 320.960   9.046  -9.288
  943    HB3  LEU  39           HB3      LEU  39 321.848   9.219  -7.780
  944    HG   LEU  39           HG       LEU  39 319.848   7.014  -8.257
  945   HD11  LEU  39          HD11      LEU  39 321.463   5.638  -9.126
  946   HD12  LEU  39          HD12      LEU  39 322.791   6.545  -8.403
  947   HD13  LEU  39          HD13      LEU  39 321.962   7.179  -9.825
  948   HD21  LEU  39          HD21      LEU  39 321.882   6.272  -6.471
  949   HD22  LEU  39          HD22      LEU  39 320.196   6.630  -6.099
  950   HD23  LEU  39          HD23      LEU  39 321.408   7.909  -6.012
  951    H    SER  40           H        SER  40 319.221  11.852  -8.846
  952    HA   SER  40           HA       SER  40 321.160  13.588  -8.035
  953    HB2  SER  40           HB2      SER  40 319.887  15.186  -9.028
  954    HB3  SER  40           HB3      SER  40 318.848  13.834  -9.474
  955    HG   SER  40           HG       SER  40 318.554  15.629  -7.307
  956    H    LYS  41           H        LYS  41 318.075  12.998  -6.358
  957    HA   LYS  41           HA       LYS  41 318.342  14.698  -4.230
  958    HB2  LYS  41           HB2      LYS  41 317.048  12.052  -4.604
  959    HB3  LYS  41           HB3      LYS  41 316.904  12.936  -3.119
  960    HG2  LYS  41           HG2      LYS  41 315.018  13.634  -4.170
  961    HG3  LYS  41           HG3      LYS  41 316.139  14.870  -4.719
  962    HD2  LYS  41           HD2      LYS  41 316.377  13.889  -6.827
  963    HD3  LYS  41           HD3      LYS  41 315.710  12.348  -6.284
  964    HE2  LYS  41           HE2      LYS  41 314.148  13.642  -7.699
  965    HE3  LYS  41           HE3      LYS  41 313.521  13.308  -6.086
  966    HZ1  LYS  41           HZ1      LYS  41 313.071  15.580  -6.710
  967    HZ2  LYS  41           HZ2      LYS  41 314.712  15.870  -6.997
  968    HZ3  LYS  41           HZ3      LYS  41 314.172  15.554  -5.426
  969    H    LEU  42           H        LEU  42 319.855  11.694  -4.934
  970    HA   LEU  42           HA       LEU  42 320.817  11.096  -2.302
  971    HB2  LEU  42           HB2      LEU  42 320.295   9.600  -4.420
  972    HB3  LEU  42           HB3      LEU  42 321.978   9.928  -4.783
  973    HG   LEU  42           HG       LEU  42 321.609   9.021  -2.042
  974   HD11  LEU  42          HD11      LEU  42 321.029   6.753  -2.534
  975   HD12  LEU  42          HD12      LEU  42 320.827   7.143  -4.238
  976   HD13  LEU  42          HD13      LEU  42 319.732   7.831  -3.042
  977   HD21  LEU  42          HD21      LEU  42 323.193   7.977  -4.381
  978   HD22  LEU  42          HD22      LEU  42 323.425   7.539  -2.685
  979   HD23  LEU  42          HD23      LEU  42 323.751   9.189  -3.225
  980    H    MET  43           H        MET  43 322.432  11.932  -5.357
  981    HA   MET  43           HA       MET  43 325.002  12.134  -4.489
  982    HB2  MET  43           HB2      MET  43 323.764  13.942  -6.553
  983    HB3  MET  43           HB3      MET  43 325.461  13.498  -6.421
  984    HG2  MET  43           HG2      MET  43 324.037  11.090  -6.542
  985    HG3  MET  43           HG3      MET  43 323.322  12.142  -7.758
  986    HE1  MET  43           HE1      MET  43 324.211  10.071  -9.448
  987    HE2  MET  43           HE2      MET  43 324.918   9.346  -8.005
  988    HE3  MET  43           HE3      MET  43 325.904   9.554  -9.459
  989    H    LYS  44           H        LYS  44 322.502  14.465  -3.990
  990    HA   LYS  44           HA       LYS  44 324.299  16.614  -3.222
  991    HB2  LYS  44           HB2      LYS  44 322.056  17.056  -4.129
  992    HB3  LYS  44           HB3      LYS  44 321.354  16.452  -2.637
  993    HG2  LYS  44           HG2      LYS  44 321.919  19.047  -3.142
  994    HG3  LYS  44           HG3      LYS  44 321.766  18.370  -1.539
  995    HD2  LYS  44           HD2      LYS  44 323.790  19.234  -1.184
  996    HD3  LYS  44           HD3      LYS  44 324.408  17.948  -2.197
  997    HE2  LYS  44           HE2      LYS  44 325.256  19.596  -3.449
  998    HE3  LYS  44           HE3      LYS  44 323.609  19.763  -4.057
  999    HZ1  LYS  44           HZ1      LYS  44 323.573  21.804  -3.238
 1000    HZ2  LYS  44           HZ2      LYS  44 325.130  21.622  -2.605
 1001    HZ3  LYS  44           HZ3      LYS  44 323.785  21.201  -1.671
 1002    H    ALA  45           H        ALA  45 322.226  14.336  -1.435
 1003    HA   ALA  45           HA       ALA  45 322.447  15.153   1.130
 1004    HB1  ALA  45           HB1      ALA  45 323.040  12.512   1.513
 1005    HB2  ALA  45           HB2      ALA  45 322.357  12.495  -0.118
 1006    HB3  ALA  45           HB3      ALA  45 321.418  13.152   1.221
 1007    H    TYR  46           H        TYR  46 324.912  13.123  -0.448
 1008    HA   TYR  46           HA       TYR  46 326.759  13.161   1.593
 1009    HB2  TYR  46           HB2      TYR  46 326.686  11.944  -0.777
 1010    HB3  TYR  46           HB3      TYR  46 327.810  13.239  -1.181
 1011    HD1  TYR  46           HD2      TYR  46 327.926  12.310   2.268
 1012    HD2  TYR  46           HD1      TYR  46 329.367  11.275  -1.596
 1013    HE1  TYR  46           HE2      TYR  46 329.717  11.038   3.298
 1014    HE2  TYR  46           HE1      TYR  46 331.176   9.959  -0.569
 1015    HH   TYR  46           HH       TYR  46 331.233   8.865   2.352
 1016    H    CYS  47           H        CYS  47 326.039  15.611  -0.750
 1017    HA   CYS  47           HA       CYS  47 328.433  17.142  -0.414
 1018    HB2  CYS  47           HB2      CYS  47 325.753  18.179  -1.280
 1019    HB3  CYS  47           HB3      CYS  47 327.324  18.718  -1.804
 1020    HG   CYS  47           HG       CYS  47 326.179  15.998  -2.697
 1021    H    GLU  48           H        GLU  48 325.080  17.426   0.651
 1022    HA   GLU  48           HA       GLU  48 325.546  19.580   2.399
 1023    HB2  GLU  48           HB2      GLU  48 323.329  17.610   2.856
 1024    HB3  GLU  48           HB3      GLU  48 323.314  19.354   3.063
 1025    HG2  GLU  48           HG2      GLU  48 323.164  19.706   0.686
 1026    HG3  GLU  48           HG3      GLU  48 323.446  18.003   0.369
 1027    H    ARG  49           H        ARG  49 326.282  16.283   2.509
 1028    HA   ARG  49           HA       ARG  49 326.372  15.936   5.362
 1029    HB2  ARG  49           HB2      ARG  49 326.514  14.371   2.942
 1030    HB3  ARG  49           HB3      ARG  49 327.778  13.918   4.048
 1031    HG2  ARG  49           HG2      ARG  49 326.315  13.047   5.568
 1032    HG3  ARG  49           HG3      ARG  49 325.019  14.140   5.080
 1033    HD2  ARG  49           HD2      ARG  49 325.809  12.411   2.909
 1034    HD3  ARG  49           HD3      ARG  49 325.327  11.492   4.315
 1035    HE   ARG  49           HE       ARG  49 323.618  13.509   3.039
 1036   HH11  ARG  49          HH11      ARG  49 324.006  10.528   4.832
 1037   HH12  ARG  49          HH12      ARG  49 322.309  10.199   4.880
 1038   HH21  ARG  49          HH21      ARG  49 321.388  13.069   3.123
 1039   HH22  ARG  49          HH22      ARG  49 320.828  11.633   3.911
 1040    H    GLN  50           H        GLN  50 328.664  15.800   2.684
 1041    HA   GLN  50           HA       GLN  50 330.954  16.054   4.424
 1042    HB2  GLN  50           HB2      GLN  50 330.786  15.746   1.471
 1043    HB3  GLN  50           HB3      GLN  50 332.244  15.612   2.404
 1044    HG2  GLN  50           HG2      GLN  50 331.128  13.679   3.598
 1045    HG3  GLN  50           HG3      GLN  50 329.893  13.763   2.346
 1046   HE21  GLN  50          HE21      GLN  50 330.527  13.433   0.165
 1047   HE22  GLN  50          HE22      GLN  50 331.900  12.462  -0.210
 1048    H    GLY  51           H        GLY  51 329.303  17.791   1.907
 1049    HA2  GLY  51           HA2      GLY  51 329.286  20.218   1.861
 1050    HA3  GLY  51           HA3      GLY  51 330.932  20.184   2.501
 1051    H    LEU  52           H        LEU  52 328.993  19.079  -0.262
 1052    HA   LEU  52           HA       LEU  52 331.310  19.534  -2.012
 1053    HB2  LEU  52           HB2      LEU  52 329.221  17.384  -2.400
 1054    HB3  LEU  52           HB3      LEU  52 330.757  17.567  -3.230
 1055    HG   LEU  52           HG       LEU  52 330.976  17.276  -0.314
 1056   HD11  LEU  52          HD11      LEU  52 330.113  15.265   0.022
 1057   HD12  LEU  52          HD12      LEU  52 330.610  14.676  -1.568
 1058   HD13  LEU  52          HD13      LEU  52 329.127  15.618  -1.403
 1059   HD21  LEU  52          HD21      LEU  52 332.815  17.385  -1.995
 1060   HD22  LEU  52          HD22      LEU  52 332.325  15.765  -2.515
 1061   HD23  LEU  52          HD23      LEU  52 332.882  16.028  -0.859
 1062    H    SER  53           H        SER  53 329.922  19.180  -4.474
 1063    HA   SER  53           HA       SER  53 327.881  21.265  -4.289
 1064    HB2  SER  53           HB2      SER  53 329.104  20.896  -6.910
 1065    HB3  SER  53           HB3      SER  53 328.890  22.350  -5.956
 1066    HG   SER  53           HG       SER  53 330.862  22.199  -5.256
 1067    H    MET  54           H        MET  54 328.160  18.063  -4.607
 1068    HA   MET  54           HA       MET  54 326.720  16.428  -5.305
 1069    HB2  MET  54           HB2      MET  54 324.828  17.829  -4.804
 1070    HB3  MET  54           HB3      MET  54 325.053  18.776  -6.249
 1071    HG2  MET  54           HG2      MET  54 324.619  16.703  -7.573
 1072    HG3  MET  54           HG3      MET  54 324.195  15.913  -6.059
 1073    HE1  MET  54           HE1      MET  54 323.115  17.923  -8.994
 1074    HE2  MET  54           HE2      MET  54 323.318  19.358  -7.989
 1075    HE3  MET  54           HE3      MET  54 321.704  18.853  -8.490
 1076    H    ARG  55           H        ARG  55 326.394  18.840  -7.833
 1077    HA   ARG  55           HA       ARG  55 326.774  17.045  -9.954
 1078    HB2  ARG  55           HB2      ARG  55 327.455  19.412 -11.054
 1079    HB3  ARG  55           HB3      ARG  55 325.788  18.952 -10.734
 1080    HG2  ARG  55           HG2      ARG  55 325.647  20.290  -8.829
 1081    HG3  ARG  55           HG3      ARG  55 327.402  20.399  -8.668
 1082    HD2  ARG  55           HD2      ARG  55 325.618  21.786 -10.654
 1083    HD3  ARG  55           HD3      ARG  55 326.693  22.506  -9.454
 1084    HE   ARG  55           HE       ARG  55 328.374  21.110 -11.062
 1085   HH11  ARG  55          HH11      ARG  55 325.923  23.525 -11.648
 1086   HH12  ARG  55          HH12      ARG  55 326.713  24.167 -13.049
 1087   HH21  ARG  55          HH21      ARG  55 329.415  21.954 -12.905
 1088   HH22  ARG  55          HH22      ARG  55 328.695  23.275 -13.763
 1089    H    GLN  56           H        GLN  56 328.976  18.924  -7.978
 1090    HA   GLN  56           HA       GLN  56 331.231  18.766  -9.655
 1091    HB2  GLN  56           HB2      GLN  56 330.614  19.624  -6.908
 1092    HB3  GLN  56           HB3      GLN  56 332.291  19.187  -7.215
 1093    HG2  GLN  56           HG2      GLN  56 331.887  20.747  -9.334
 1094    HG3  GLN  56           HG3      GLN  56 330.706  21.461  -8.238
 1095   HE21  GLN  56          HE21      GLN  56 331.428  23.024  -6.985
 1096   HE22  GLN  56          HE22      GLN  56 333.071  23.278  -6.516
 1097    H    ILE  57           H        ILE  57 329.939  16.473  -7.338
 1098    HA   ILE  57           HA       ILE  57 332.485  15.117  -7.145
 1099    HB   ILE  57           HB       ILE  57 331.029  13.329  -5.941
 1100   HG12  ILE  57          HG12      ILE  57 329.170  15.606  -6.225
 1101   HG13  ILE  57          HG13      ILE  57 328.831  13.893  -6.029
 1102   HG21  ILE  57          HG21      ILE  57 331.510  14.316  -3.866
 1103   HG22  ILE  57          HG22      ILE  57 331.487  15.942  -4.566
 1104   HG23  ILE  57          HG23      ILE  57 332.783  14.818  -4.985
 1105   HD11  ILE  57          HD11      ILE  57 329.659  15.832  -3.901
 1106   HD12  ILE  57          HD12      ILE  57 329.440  14.092  -3.658
 1107   HD13  ILE  57          HD13      ILE  57 328.064  15.099  -4.113
 1108    H    ARG  58           H        ARG  58 332.481  12.713  -7.458
 1109    HA   ARG  58           HA       ARG  58 331.017  12.044  -9.916
 1110    HB2  ARG  58           HB2      ARG  58 333.585  10.685  -9.428
 1111    HB3  ARG  58           HB3      ARG  58 332.902  11.310 -10.924
 1112    HG2  ARG  58           HG2      ARG  58 334.151  13.015  -8.779
 1113    HG3  ARG  58           HG3      ARG  58 334.985  12.439 -10.217
 1114    HD2  ARG  58           HD2      ARG  58 333.697  13.758 -11.629
 1115    HD3  ARG  58           HD3      ARG  58 332.442  14.003 -10.428
 1116    HE   ARG  58           HE       ARG  58 333.605  15.821  -9.699
 1117   HH11  ARG  58          HH11      ARG  58 335.801  13.745 -11.448
 1118   HH12  ARG  58          HH12      ARG  58 337.124  14.859 -11.358
 1119   HH21  ARG  58          HH21      ARG  58 335.346  17.289  -9.583
 1120   HH22  ARG  58          HH22      ARG  58 336.866  16.869 -10.300
 1121    H    PHE  59           H        PHE  59 329.595  10.409  -9.476
 1122    HA   PHE  59           HA       PHE  59 330.224   8.651  -7.221
 1123    HB2  PHE  59           HB2      PHE  59 327.620   9.363  -8.543
 1124    HB3  PHE  59           HB3      PHE  59 327.782   8.001  -7.470
 1125    HD1  PHE  59           HD1      PHE  59 329.641  11.093  -6.792
 1126    HD2  PHE  59           HD2      PHE  59 326.114   8.846  -6.008
 1127    HE1  PHE  59           HE1      PHE  59 329.158  12.513  -4.853
 1128    HE2  PHE  59           HE2      PHE  59 325.628  10.272  -4.075
 1129    HZ   PHE  59           HZ       PHE  59 327.151  12.121  -3.499
 1130    H    ARG  60           H        ARG  60 329.475   6.446  -7.375
 1131    HA   ARG  60           HA       ARG  60 329.163   5.299 -10.001
 1132    HB2  ARG  60           HB2      ARG  60 331.735   5.432  -9.215
 1133    HB3  ARG  60           HB3      ARG  60 331.264   3.957  -8.389
 1134    HG2  ARG  60           HG2      ARG  60 330.241   3.692 -10.954
 1135    HG3  ARG  60           HG3      ARG  60 331.832   4.401 -11.169
 1136    HD2  ARG  60           HD2      ARG  60 331.387   1.762 -10.965
 1137    HD3  ARG  60           HD3      ARG  60 332.895   2.535 -10.489
 1138    HE   ARG  60           HE       ARG  60 330.777   1.590  -8.688
 1139   HH11  ARG  60          HH11      ARG  60 334.013   2.838  -9.144
 1140   HH12  ARG  60          HH12      ARG  60 334.519   2.444  -7.538
 1141   HH21  ARG  60          HH21      ARG  60 331.450   1.080  -6.579
 1142   HH22  ARG  60          HH22      ARG  60 333.068   1.449  -6.083
 1143    H    PHE  61           H        PHE  61 328.187   3.310  -9.927
 1144    HA   PHE  61           HA       PHE  61 327.455   2.303  -7.277
 1145    HB2  PHE  61           HB2      PHE  61 325.442   3.301  -7.989
 1146    HB3  PHE  61           HB3      PHE  61 325.672   2.806  -9.657
 1147    HD1  PHE  61           HD1      PHE  61 325.450   1.232  -6.300
 1148    HD2  PHE  61           HD2      PHE  61 324.310   1.096 -10.395
 1149    HE1  PHE  61           HE1      PHE  61 324.119  -0.797  -5.859
 1150    HE2  PHE  61           HE2      PHE  61 322.974  -0.928  -9.966
 1151    HZ   PHE  61           HZ       PHE  61 322.879  -1.878  -7.695
 1152    H    ASP  62           H        ASP  62 327.095  -0.067  -7.285
 1153    HA   ASP  62           HA       ASP  62 329.057  -1.536  -8.386
 1154    HB2  ASP  62           HB2      ASP  62 326.225  -2.529  -8.012
 1155    HB3  ASP  62           HB3      ASP  62 327.673  -3.529  -8.079
 1156    H    GLY  63           H        GLY  63 329.526  -0.819 -10.482
 1157    HA2  GLY  63           HA2      GLY  63 329.685  -1.494 -12.701
 1158    HA3  GLY  63           HA3      GLY  63 328.134  -2.307 -12.557
 1159    H    GLN  64           H        GLN  64 328.416   0.993 -11.520
 1160    HA   GLN  64           HA       GLN  64 327.531   2.033 -14.072
 1161    HB2  GLN  64           HB2      GLN  64 325.535   1.154 -12.615
 1162    HB3  GLN  64           HB3      GLN  64 325.751   2.698 -11.805
 1163    HG2  GLN  64           HG2      GLN  64 324.747   3.789 -13.442
 1164    HG3  GLN  64           HG3      GLN  64 325.771   3.046 -14.649
 1165   HE21  GLN  64          HE21      GLN  64 323.574   1.402 -12.456
 1166   HE22  GLN  64          HE22      GLN  64 322.514   0.799 -13.678
 1167    HA   PRO  65           HA       PRO  65 329.715   5.576 -12.423
 1168    HB2  PRO  65           HB2      PRO  65 329.118   6.869 -14.930
 1169    HB3  PRO  65           HB3      PRO  65 330.625   6.147 -14.415
 1170    HG2  PRO  65           HG2      PRO  65 329.161   5.167 -16.453
 1171    HG3  PRO  65           HG3      PRO  65 330.114   4.113 -15.384
 1172    HD2  PRO  65           HD2      PRO  65 327.199   4.841 -15.174
 1173    HD3  PRO  65           HD3      PRO  65 327.935   3.238 -15.199
 1174    H    ILE  66           H        ILE  66 326.551   5.432 -13.355
 1175    HA   ILE  66           HA       ILE  66 324.731   6.759 -13.424
 1176    HB   ILE  66           HB       ILE  66 324.165   7.551 -11.181
 1177   HG12  ILE  66          HG12      ILE  66 326.976   6.692 -10.527
 1178   HG13  ILE  66          HG13      ILE  66 326.386   8.311 -10.515
 1179   HG21  ILE  66          HG21      ILE  66 325.496   4.941 -10.736
 1180   HG22  ILE  66          HG22      ILE  66 324.373   5.045 -12.095
 1181   HG23  ILE  66          HG23      ILE  66 323.822   5.425 -10.459
 1182   HD11  ILE  66          HD11      ILE  66 326.156   7.854  -8.304
 1183   HD12  ILE  66          HD12      ILE  66 325.973   6.123  -8.591
 1184   HD13  ILE  66          HD13      ILE  66 324.613   7.214  -8.861
 1185    H    ASN  67           H        ASN  67 323.787   8.983 -12.881
 1186    HA   ASN  67           HA       ASN  67 325.678  11.178 -13.188
 1187    HB2  ASN  67           HB2      ASN  67 323.508  10.653 -15.210
 1188    HB3  ASN  67           HB3      ASN  67 324.582  12.046 -15.204
 1189   HD21  ASN  67          HD21      ASN  67 324.264   8.672 -15.902
 1190   HD22  ASN  67          HD22      ASN  67 325.774   8.484 -16.721
 1191    H    GLU  68           H        GLU  68 324.491  10.907 -11.078
 1192    HA   GLU  68           HA       GLU  68 322.860  11.484  -9.560
 1193    HB2  GLU  68           HB2      GLU  68 322.520  14.187 -10.397
 1194    HB3  GLU  68           HB3      GLU  68 323.425  13.536  -9.036
 1195    HG2  GLU  68           HG2      GLU  68 325.389  13.387 -10.251
 1196    HG3  GLU  68           HG3      GLU  68 324.545  13.524 -11.787
 1197    H    THR  69           H        THR  69 321.752  10.771 -12.403
 1198    HA   THR  69           HA       THR  69 319.046  11.732 -11.841
 1199    HB   THR  69           HB       THR  69 318.630  12.010 -14.227
 1200    HG1  THR  69           HG1      THR  69 319.941  10.810 -15.383
 1201   HG21  THR  69          HG21      THR  69 319.797  13.843 -12.779
 1202   HG22  THR  69          HG22      THR  69 319.604  14.052 -14.520
 1203   HG23  THR  69          HG23      THR  69 321.156  13.534 -13.860
 1204    H    ASP  70           H        ASP  70 321.096   9.221 -12.149
 1205    HA   ASP  70           HA       ASP  70 319.350   7.286 -13.393
 1206    HB2  ASP  70           HB2      ASP  70 321.939   7.042 -11.860
 1207    HB3  ASP  70           HB3      ASP  70 321.032   5.656 -12.402
 1208    H    THR  71           H        THR  71 317.911   6.000 -12.285
 1209    HA   THR  71           HA       THR  71 317.603   6.696  -9.461
 1210    HB   THR  71           HB       THR  71 315.381   6.160  -9.619
 1211    HG1  THR  71           HG1      THR  71 314.721   4.375 -10.489
 1212   HG21  THR  71          HG21      THR  71 315.903   7.899 -11.363
 1213   HG22  THR  71          HG22      THR  71 314.404   6.993 -11.604
 1214   HG23  THR  71          HG23      THR  71 315.838   6.593 -12.556
 1215    HA   PRO  72           HA       PRO  72 319.544   3.010  -8.204
 1216    HB2  PRO  72           HB2      PRO  72 317.446   2.652  -6.161
 1217    HB3  PRO  72           HB3      PRO  72 319.208   2.790  -5.977
 1218    HG2  PRO  72           HG2      PRO  72 317.433   4.792  -5.365
 1219    HG3  PRO  72           HG3      PRO  72 319.137   5.044  -5.770
 1220    HD2  PRO  72           HD2      PRO  72 316.731   5.643  -7.333
 1221    HD3  PRO  72           HD3      PRO  72 318.376   6.270  -7.516
 1222    H    ALA  73           H        ALA  73 316.082   3.131  -8.702
 1223    HA   ALA  73           HA       ALA  73 315.609   0.348  -8.860
 1224    HB1  ALA  73           HB1      ALA  73 313.545   1.202  -8.910
 1225    HB2  ALA  73           HB2      ALA  73 313.813   1.571 -10.620
 1226    HB3  ALA  73           HB3      ALA  73 314.153   2.786  -9.387
 1227    H    GLN  74           H        GLN  74 315.881   2.712 -11.600
 1228    HA   GLN  74           HA       GLN  74 316.019   0.913 -13.601
 1229    HB2  GLN  74           HB2      GLN  74 316.976   3.622 -13.127
 1230    HB3  GLN  74           HB3      GLN  74 317.460   2.846 -14.602
 1231    HG2  GLN  74           HG2      GLN  74 315.566   3.773 -15.383
 1232    HG3  GLN  74           HG3      GLN  74 314.828   2.347 -14.653
 1233   HE21  GLN  74          HE21      GLN  74 313.951   2.570 -12.506
 1234   HE22  GLN  74          HE22      GLN  74 313.323   4.097 -11.998
 1235    H    LEU  75           H        LEU  75 318.439   1.766 -11.294
 1236    HA   LEU  75           HA       LEU  75 320.566   0.473 -12.802
 1237    HB2  LEU  75           HB2      LEU  75 320.720   1.701 -10.052
 1238    HB3  LEU  75           HB3      LEU  75 322.052   1.325 -11.123
 1239    HG   LEU  75           HG       LEU  75 320.208   3.670 -11.151
 1240   HD11  LEU  75          HD11      LEU  75 322.547   4.512 -12.096
 1241   HD12  LEU  75          HD12      LEU  75 323.096   3.077 -11.230
 1242   HD13  LEU  75          HD13      LEU  75 322.211   4.339 -10.374
 1243   HD21  LEU  75          HD21      LEU  75 321.189   4.044 -13.545
 1244   HD22  LEU  75          HD22      LEU  75 319.689   3.143 -13.319
 1245   HD23  LEU  75          HD23      LEU  75 321.202   2.280 -13.592
 1246    H    GLU  76           H        GLU  76 318.211  -0.236 -10.540
 1247    HA   GLU  76           HA       GLU  76 317.572  -2.103  -9.515
 1248    HB2  GLU  76           HB2      GLU  76 319.955  -3.313 -10.898
 1249    HB3  GLU  76           HB3      GLU  76 318.761  -4.237  -9.993
 1250    HG2  GLU  76           HG2      GLU  76 317.141  -2.833 -11.614
 1251    HG3  GLU  76           HG3      GLU  76 318.570  -2.973 -12.641
 1252    H    MET  77           H        MET  77 319.392  -0.228  -8.261
 1253    HA   MET  77           HA       MET  77 321.327  -1.327  -6.627
 1254    HB2  MET  77           HB2      MET  77 319.353   0.889  -6.080
 1255    HB3  MET  77           HB3      MET  77 320.728   0.563  -5.033
 1256    HG2  MET  77           HG2      MET  77 321.757   0.658  -7.625
 1257    HG3  MET  77           HG3      MET  77 320.623   1.981  -7.513
 1258    HE1  MET  77           HE1      MET  77 322.564   3.286  -8.224
 1259    HE2  MET  77           HE2      MET  77 323.609   4.122  -7.072
 1260    HE3  MET  77           HE3      MET  77 321.855   4.373  -7.028
 1261    H    GLU  78           H        GLU  78 320.436  -0.987  -3.849
 1262    HA   GLU  78           HA       GLU  78 318.151  -2.564  -3.387
 1263    HB2  GLU  78           HB2      GLU  78 320.661  -3.947  -3.856
 1264    HB3  GLU  78           HB3      GLU  78 320.030  -4.288  -2.252
 1265    HG2  GLU  78           HG2      GLU  78 318.376  -5.554  -3.044
 1266    HG3  GLU  78           HG3      GLU  78 318.008  -4.425  -4.347
 1267    H    ASP  79           H        ASP  79 318.788  -3.654  -0.946
 1268    HA   ASP  79           HA       ASP  79 318.899  -1.270   0.653
 1269    HB2  ASP  79           HB2      ASP  79 317.871  -3.888   0.950
 1270    HB3  ASP  79           HB3      ASP  79 318.958  -3.583   2.304
 1271    H    GLU  80           H        GLU  80 320.706  -0.298   1.129
 1272    HA   GLU  80           HA       GLU  80 322.633   0.007   2.397
 1273    HB2  GLU  80           HB2      GLU  80 323.184  -2.941   2.062
 1274    HB3  GLU  80           HB3      GLU  80 324.086  -1.811   3.060
 1275    HG2  GLU  80           HG2      GLU  80 321.870  -1.379   4.261
 1276    HG3  GLU  80           HG3      GLU  80 321.310  -2.846   3.463
 1277    H    ASP  81           H        ASP  81 322.217  -1.129  -0.716
 1278    HA   ASP  81           HA       ASP  81 324.512  -1.521  -1.987
 1279    HB2  ASP  81           HB2      ASP  81 323.511   0.286  -3.677
 1280    HB3  ASP  81           HB3      ASP  81 322.749  -1.275  -3.447
 1281    H    THR  82           H        THR  82 326.423  -0.516  -2.267
 1282    HA   THR  82           HA       THR  82 326.666   2.196  -1.169
 1283    HB   THR  82           HB       THR  82 328.972   0.447  -1.997
 1284    HG1  THR  82           HG1      THR  82 329.099  -0.089   0.228
 1285   HG21  THR  82          HG21      THR  82 329.292   2.931  -1.646
 1286   HG22  THR  82          HG22      THR  82 330.289   1.866  -0.641
 1287   HG23  THR  82          HG23      THR  82 328.858   2.641   0.049
 1288    H    ILE  83           H        ILE  83 327.333   3.876  -2.330
 1289    HA   ILE  83           HA       ILE  83 327.861   3.524  -5.198
 1290    HB   ILE  83           HB       ILE  83 326.604   5.841  -3.707
 1291   HG12  ILE  83          HG12      ILE  83 325.538   3.930  -5.797
 1292   HG13  ILE  83          HG13      ILE  83 325.091   3.978  -4.093
 1293   HG21  ILE  83          HG21      ILE  83 328.151   6.541  -5.593
 1294   HG22  ILE  83          HG22      ILE  83 326.472   7.030  -5.812
 1295   HG23  ILE  83          HG23      ILE  83 327.107   5.646  -6.697
 1296   HD11  ILE  83          HD11      ILE  83 324.481   5.970  -6.232
 1297   HD12  ILE  83          HD12      ILE  83 324.296   6.324  -4.510
 1298   HD13  ILE  83          HD13      ILE  83 323.359   5.025  -5.254
 1299    H    ASP  84           H        ASP  84 329.831   4.630  -5.900
 1300    HA   ASP  84           HA       ASP  84 331.420   5.520  -3.601
 1301    HB2  ASP  84           HB2      ASP  84 331.969   3.753  -5.732
 1302    HB3  ASP  84           HB3      ASP  84 333.060   5.126  -5.865
 1303    H    VAL  85           H        VAL  85 331.877   7.557  -3.347
 1304    HA   VAL  85           HA       VAL  85 331.646   9.473  -5.550
 1305    HB   VAL  85           HB       VAL  85 331.921   9.875  -2.563
 1306   HG11  VAL  85          HG11      VAL  85 331.624  11.951  -4.728
 1307   HG12  VAL  85          HG12      VAL  85 333.022  11.718  -3.681
 1308   HG13  VAL  85          HG13      VAL  85 331.490  12.272  -2.996
 1309   HG21  VAL  85          HG21      VAL  85 329.605  11.066  -3.516
 1310   HG22  VAL  85          HG22      VAL  85 329.748   9.623  -2.509
 1311   HG23  VAL  85          HG23      VAL  85 329.668   9.470  -4.267
 1312    H    PHE  86           H        PHE  86 333.483  10.024  -6.586
 1313    HA   PHE  86           HA       PHE  86 335.944  10.219  -4.991
 1314    HB2  PHE  86           HB2      PHE  86 335.689   8.948  -7.730
 1315    HB3  PHE  86           HB3      PHE  86 337.219   9.391  -6.982
 1316    HD1  PHE  86           HD2      PHE  86 336.587   8.545  -4.160
 1317    HD2  PHE  86           HD1      PHE  86 335.937   6.628  -7.904
 1318    HE1  PHE  86           HE2      PHE  86 336.671   6.352  -3.048
 1319    HE2  PHE  86           HE1      PHE  86 336.020   4.432  -6.798
 1320    HZ   PHE  86           HZ       PHE  86 336.388   4.292  -4.367
 1321    H    GLN  87           H        GLN  87 336.181  12.326  -4.948
 1322    HA   GLN  87           HA       GLN  87 336.442  13.747  -7.470
 1323    HB2  GLN  87           HB2      GLN  87 334.050  13.856  -6.420
 1324    HB3  GLN  87           HB3      GLN  87 334.769  15.018  -5.325
 1325    HG2  GLN  87           HG2      GLN  87 335.485  15.652  -8.029
 1326    HG3  GLN  87           HG3      GLN  87 333.753  15.438  -7.892
 1327   HE21  GLN  87          HE21      GLN  87 332.739  16.569  -5.903
 1328   HE22  GLN  87          HE22      GLN  87 333.312  18.174  -5.604
 1329    H    GLN  88           H        GLN  88 338.388  14.647  -7.387
 1330    HA   GLN  88           HA       GLN  88 339.818  15.032  -4.976
 1331    HB2  GLN  88           HB2      GLN  88 340.317  15.921  -7.804
 1332    HB3  GLN  88           HB3      GLN  88 341.428  16.289  -6.493
 1333    HG2  GLN  88           HG2      GLN  88 340.578  13.503  -7.238
 1334    HG3  GLN  88           HG3      GLN  88 342.029  14.291  -7.856
 1335   HE21  GLN  88          HE21      GLN  88 343.655  14.927  -6.312
 1336   HE22  GLN  88          HE22      GLN  88 343.839  14.032  -4.846
 1337    H    GLN  89           H        GLN  89 340.766  17.095  -4.266
 1338    HA   GLN  89           HA       GLN  89 338.758  19.002  -3.724
 1339    HB2  GLN  89           HB2      GLN  89 341.679  18.772  -3.197
 1340    HB3  GLN  89           HB3      GLN  89 340.949  20.365  -3.046
 1341    HG2  GLN  89           HG2      GLN  89 339.231  19.234  -1.532
 1342    HG3  GLN  89           HG3      GLN  89 340.357  17.879  -1.484
 1343   HE21  GLN  89          HE21      GLN  89 341.219  17.939   0.478
 1344   HE22  GLN  89          HE22      GLN  89 341.968  19.315   1.206
 1345    H    THR  90           H        THR  90 337.931  20.360  -5.164
 1346    HA   THR  90           HA       THR  90 339.440  22.331  -6.463
 1347    HB   THR  90           HB       THR  90 340.275  20.757  -7.998
 1348    HG1  THR  90           HG1      THR  90 339.198  22.607  -8.968
 1349   HG21  THR  90          HG21      THR  90 337.612  19.491  -7.781
 1350   HG22  THR  90          HG22      THR  90 339.216  18.764  -7.867
 1351   HG23  THR  90          HG23      THR  90 338.448  19.381  -9.330
 1352    H1   THR   2           HT1      THR   2 287.804  -5.246  16.641
 1353    H2   THR   2           HT2      THR   2 286.491  -5.693  17.652
 1354    H3   THR   2           HT3      THR   2 286.213  -5.302  16.004
 1355    HA   THR   2           HA       THR   2 287.518  -7.183  15.330
 1356    HB   THR   2           HB       THR   2 287.521  -7.907  18.264
 1357    HG1  THR   2           HG1      THR   2 288.987  -6.366  18.291
 1358   HG21  THR   2          HG21      THR   2 287.989  -9.477  16.035
 1359   HG22  THR   2          HG22      THR   2 288.442  -9.838  17.702
 1360   HG23  THR   2          HG23      THR   2 289.597  -9.053  16.624
 1361    H    VAL   3           H        VAL   3 285.698  -7.827  14.301
 1362    HA   VAL   3           HA       VAL   3 283.816  -9.459  15.830
 1363    HB   VAL   3           HB       VAL   3 282.775  -7.234  15.709
 1364   HG11  VAL   3          HG11      VAL   3 283.894  -6.542  13.594
 1365   HG12  VAL   3          HG12      VAL   3 282.161  -6.216  13.630
 1366   HG13  VAL   3          HG13      VAL   3 282.780  -7.591  12.717
 1367   HG21  VAL   3          HG21      VAL   3 281.441  -9.361  15.607
 1368   HG22  VAL   3          HG22      VAL   3 281.349  -9.137  13.860
 1369   HG23  VAL   3          HG23      VAL   3 280.636  -7.940  14.942
 1370    H    GLY   4           H        GLY   4 284.788  -8.296  12.613
 1371    HA2  GLY   4           HA2      GLY   4 285.548  -9.964  10.999
 1372    HA3  GLY   4           HA3      GLY   4 284.281 -11.024  11.599
 1373    H    ASP   5           H        ASP   5 285.109  -9.280   9.019
 1374    HA   ASP   5           HA       ASP   5 282.399  -9.173   8.039
 1375    HB2  ASP   5           HB2      ASP   5 282.677  -6.748   7.307
 1376    HB3  ASP   5           HB3      ASP   5 282.367  -7.017   9.019
 1377    H    GLU   6           H        GLU   6 285.787  -8.278   7.450
 1378    HA   GLU   6           HA       GLU   6 287.152  -8.669   5.671
 1379    HB2  GLU   6           HB2      GLU   6 285.472 -10.839   5.657
 1380    HB3  GLU   6           HB3      GLU   6 285.252 -10.202   4.036
 1381    HG2  GLU   6           HG2      GLU   6 287.843 -10.163   3.979
 1382    HG3  GLU   6           HG3      GLU   6 287.706 -11.306   5.315
 1383    H    ILE   7           H        ILE   7 284.141  -8.865   3.809
 1384    HA   ILE   7           HA       ILE   7 283.473  -7.696   1.963
 1385    HB   ILE   7           HB       ILE   7 282.955  -5.361   2.398
 1386   HG12  ILE   7          HG12      ILE   7 284.412  -5.582   5.026
 1387   HG13  ILE   7          HG13      ILE   7 285.203  -4.955   3.583
 1388   HG21  ILE   7          HG21      ILE   7 282.425  -6.471   5.066
 1389   HG22  ILE   7          HG22      ILE   7 281.951  -7.499   3.714
 1390   HG23  ILE   7          HG23      ILE   7 281.309  -5.861   3.844
 1391   HD11  ILE   7          HD11      ILE   7 282.838  -3.538   3.707
 1392   HD12  ILE   7          HD12      ILE   7 284.436  -2.968   4.188
 1393   HD13  ILE   7          HD13      ILE   7 283.352  -3.670   5.389
 1394    H    VAL   8           H        VAL   8 283.990  -5.372   0.776
 1395    HA   VAL   8           HA       VAL   8 285.353  -4.405  -0.756
 1396    HB   VAL   8           HB       VAL   8 287.567  -4.769   1.264
 1397   HG11  VAL   8          HG11      VAL   8 288.092  -3.889  -1.036
 1398   HG12  VAL   8          HG12      VAL   8 288.519  -2.815   0.296
 1399   HG13  VAL   8          HG13      VAL   8 287.069  -2.503  -0.658
 1400   HG21  VAL   8          HG21      VAL   8 285.073  -3.398   1.585
 1401   HG22  VAL   8          HG22      VAL   8 286.392  -2.228   1.560
 1402   HG23  VAL   8          HG23      VAL   8 286.412  -3.555   2.721
 1403    H    ASP   9           H        ASP   9 288.418  -5.602  -0.055
 1404    HA   ASP   9           HA       ASP   9 289.834  -6.896  -1.269
 1405    HB2  ASP   9           HB2      ASP   9 289.202  -9.279  -1.337
 1406    HB3  ASP   9           HB3      ASP   9 288.927  -8.554   0.240
 1407    H    LEU  10           H        LEU  10 290.277  -6.390  -3.318
 1408    HA   LEU  10           HA       LEU  10 289.285  -7.759  -5.502
 1409    HB2  LEU  10           HB2      LEU  10 287.166  -6.578  -4.986
 1410    HB3  LEU  10           HB3      LEU  10 287.977  -5.051  -5.246
 1411    HG   LEU  10           HG       LEU  10 286.519  -5.923  -7.130
 1412   HD11  LEU  10          HD11      LEU  10 287.648  -4.460  -8.341
 1413   HD12  LEU  10          HD12      LEU  10 289.004  -5.574  -8.507
 1414   HD13  LEU  10          HD13      LEU  10 288.922  -4.484  -7.120
 1415   HD21  LEU  10          HD21      LEU  10 287.002  -7.804  -8.248
 1416   HD22  LEU  10          HD22      LEU  10 287.898  -8.246  -6.795
 1417   HD23  LEU  10          HD23      LEU  10 288.742  -7.526  -8.167
 1418    H    THR  11           H        THR  11 290.516  -7.387  -7.308
 1419    HA   THR  11           HA       THR  11 292.900  -5.957  -7.114
 1420    HB   THR  11           HB       THR  11 292.562  -6.160  -9.822
 1421    HG1  THR  11           HG1      THR  11 291.238  -8.424  -8.832
 1422   HG21  THR  11          HG21      THR  11 294.028  -7.898  -9.776
 1423   HG22  THR  11          HG22      THR  11 293.225  -8.694  -8.425
 1424   HG23  THR  11          HG23      THR  11 294.246  -7.292  -8.135
 1425    H    CYS  12           H        CYS  12 293.556  -3.967  -7.549
 1426    HA   CYS  12           HA       CYS  12 292.311  -2.201  -9.364
 1427    HB2  CYS  12           HB2      CYS  12 291.357  -0.569  -7.849
 1428    HB3  CYS  12           HB3      CYS  12 290.596  -2.132  -7.570
 1429    HG   CYS  12           HG       CYS  12 292.791  -1.824  -5.590
 1430    H    GLU  13           H        GLU  13 293.160   0.157  -8.909
 1431    HA   GLU  13           HA       GLU  13 295.978   0.013  -8.920
 1432    HB2  GLU  13           HB2      GLU  13 294.272   1.809  -9.879
 1433    HB3  GLU  13           HB3      GLU  13 294.616   2.604  -8.349
 1434    HG2  GLU  13           HG2      GLU  13 296.111   3.521  -9.909
 1435    HG3  GLU  13           HG3      GLU  13 297.059   2.404  -8.929
 1436    H    SER  14           H        SER  14 297.506   0.836  -7.441
 1437    HA   SER  14           HA       SER  14 296.706   0.514  -4.671
 1438    HB2  SER  14           HB2      SER  14 299.215   0.804  -4.277
 1439    HB3  SER  14           HB3      SER  14 298.726  -0.607  -5.214
 1440    HG   SER  14           HG       SER  14 300.206   0.187  -6.517
 1441    H    LEU  15           H        LEU  15 299.101   2.821  -5.899
 1442    HA   LEU  15           HA       LEU  15 297.580   5.145  -5.381
 1443    HB2  LEU  15           HB2      LEU  15 298.973   5.919  -3.405
 1444    HB3  LEU  15           HB3      LEU  15 297.731   4.725  -3.082
 1445    HG   LEU  15           HG       LEU  15 300.324   3.512  -3.654
 1446   HD11  LEU  15          HD11      LEU  15 300.085   5.232  -1.191
 1447   HD12  LEU  15          HD12      LEU  15 301.098   5.597  -2.588
 1448   HD13  LEU  15          HD13      LEU  15 301.427   4.166  -1.611
 1449   HD21  LEU  15          HD21      LEU  15 298.383   3.344  -1.354
 1450   HD22  LEU  15          HD22      LEU  15 299.787   2.301  -1.577
 1451   HD23  LEU  15          HD23      LEU  15 298.466   2.261  -2.744
 1452    H    GLU  16           H        GLU  16 300.825   3.734  -5.460
 1453    HA   GLU  16           HA       GLU  16 302.815   4.518  -6.273
 1454    HB2  GLU  16           HB2      GLU  16 301.300   3.981  -8.295
 1455    HB3  GLU  16           HB3      GLU  16 301.186   5.724  -8.492
 1456    HG2  GLU  16           HG2      GLU  16 302.908   5.096  -9.920
 1457    HG3  GLU  16           HG3      GLU  16 303.737   5.716  -8.493
 1458    HA   PRO  17           HA       PRO  17 302.402   8.860  -4.805
 1459    HB2  PRO  17           HB2      PRO  17 304.464   8.797  -3.078
 1460    HB3  PRO  17           HB3      PRO  17 302.874   8.148  -2.658
 1461    HG2  PRO  17           HG2      PRO  17 305.332   6.698  -3.561
 1462    HG3  PRO  17           HG3      PRO  17 304.197   6.275  -2.266
 1463    HD2  PRO  17           HD2      PRO  17 304.130   5.146  -4.751
 1464    HD3  PRO  17           HD3      PRO  17 302.696   5.331  -3.723
 1465    H    VAL  18           H        VAL  18 305.436   7.125  -5.495
 1466    HA   VAL  18           HA       VAL  18 307.217   7.646  -6.814
 1467    HB   VAL  18           HB       VAL  18 305.630   9.984  -7.870
 1468   HG11  VAL  18          HG11      VAL  18 306.977   9.420  -9.940
 1469   HG12  VAL  18          HG12      VAL  18 307.952   8.378  -8.904
 1470   HG13  VAL  18          HG13      VAL  18 307.874  10.111  -8.588
 1471   HG21  VAL  18          HG21      VAL  18 305.627   7.184  -8.981
 1472   HG22  VAL  18          HG22      VAL  18 304.668   8.561  -9.524
 1473   HG23  VAL  18          HG23      VAL  18 304.349   7.829  -7.952
 1474    H    VAL  19           H        VAL  19 307.644   8.356  -4.362
 1475    HA   VAL  19           HA       VAL  19 309.167  10.812  -4.587
 1476    HB   VAL  19           HB       VAL  19 306.981  11.606  -3.764
 1477   HG11  VAL  19          HG11      VAL  19 306.206   9.627  -2.619
 1478   HG12  VAL  19          HG12      VAL  19 306.253  10.979  -1.488
 1479   HG13  VAL  19          HG13      VAL  19 307.519   9.751  -1.448
 1480   HG21  VAL  19          HG21      VAL  19 309.304  12.493  -3.010
 1481   HG22  VAL  19          HG22      VAL  19 308.864  11.798  -1.450
 1482   HG23  VAL  19          HG23      VAL  19 307.851  13.045  -2.177
 1483    H    VAL  20           H        VAL  20 310.713  11.078  -2.835
 1484    HA   VAL  20           HA       VAL  20 311.066   8.818  -1.040
 1485    HB   VAL  20           HB       VAL  20 313.051   9.500  -3.207
 1486   HG11  VAL  20          HG11      VAL  20 314.327   9.365  -1.173
 1487   HG12  VAL  20          HG12      VAL  20 314.573   7.886  -2.097
 1488   HG13  VAL  20          HG13      VAL  20 313.498   7.880  -0.703
 1489   HG21  VAL  20          HG21      VAL  20 311.863   6.864  -2.369
 1490   HG22  VAL  20          HG22      VAL  20 312.892   7.161  -3.774
 1491   HG23  VAL  20          HG23      VAL  20 311.266   7.849  -3.700
 1492    H    ASP  21           H        ASP  21 312.677   9.168   0.584
 1493    HA   ASP  21           HA       ASP  21 313.570  11.948   0.894
 1494    HB2  ASP  21           HB2      ASP  21 312.133  10.267   2.955
 1495    HB3  ASP  21           HB3      ASP  21 313.027  11.731   3.355
 1496    H    LEU  22           H        LEU  22 315.563  12.194   1.870
 1497    HA   LEU  22           HA       LEU  22 317.157   9.771   2.035
 1498    HB2  LEU  22           HB2      LEU  22 317.770  12.697   1.922
 1499    HB3  LEU  22           HB3      LEU  22 318.996  11.571   2.473
 1500    HG   LEU  22           HG       LEU  22 318.106  10.414   0.127
 1501   HD11  LEU  22          HD11      LEU  22 318.002  12.087  -1.550
 1502   HD12  LEU  22          HD12      LEU  22 318.413  13.360  -0.399
 1503   HD13  LEU  22          HD13      LEU  22 316.851  12.547  -0.295
 1504   HD21  LEU  22          HD21      LEU  22 320.292  10.451  -0.306
 1505   HD22  LEU  22          HD22      LEU  22 320.479  11.306   1.225
 1506   HD23  LEU  22          HD23      LEU  22 320.348  12.213  -0.282
 1507    H    THR  23           H        THR  23 319.046  10.133   3.816
 1508    HA   THR  23           HA       THR  23 317.606  10.074   6.357
 1509    HB   THR  23           HB       THR  23 319.629   8.984   7.238
 1510    HG1  THR  23           HG1      THR  23 321.272   8.431   5.682
 1511   HG21  THR  23          HG21      THR  23 318.178   7.373   6.421
 1512   HG22  THR  23          HG22      THR  23 319.704   7.001   5.618
 1513   HG23  THR  23          HG23      THR  23 318.432   7.854   4.743
 1514    H    HIS  24           H        HIS  24 318.279  12.603   5.003
 1515    HA   HIS  24           HA       HIS  24 319.237  14.637   5.389
 1516    HB2  HIS  24           HB2      HIS  24 318.959  15.450   7.669
 1517    HB3  HIS  24           HB3      HIS  24 317.569  14.482   7.196
 1518    HD1  HIS  24           HD1      HIS  24 320.542  14.455   9.478
 1519    HD2  HIS  24           HD2      HIS  24 317.177  12.155   8.673
 1520    HE1  HIS  24           HE1      HIS  24 320.404  12.787  11.354
 1521    HE2  HIS  24           HE2      HIS  24 318.303  11.472  10.899
 1522    H    ASN  25           H        ASN  25 320.849  15.733   7.260
 1523    HA   ASN  25           HA       ASN  25 323.402  14.863   6.497
 1524    HB2  ASN  25           HB2      ASN  25 322.444  16.698   8.687
 1525    HB3  ASN  25           HB3      ASN  25 324.156  16.363   8.441
 1526   HD21  ASN  25          HD21      ASN  25 324.757  18.371   7.799
 1527   HD22  ASN  25          HD22      ASN  25 324.223  19.111   6.332
 1528    H    ASP  26           H        ASP  26 325.089  13.908   7.721
 1529    HA   ASP  26           HA       ASP  26 324.181  11.754   9.402
 1530    HB2  ASP  26           HB2      ASP  26 326.729  12.525   8.083
 1531    HB3  ASP  26           HB3      ASP  26 326.854  11.521   9.524
  Start of MODEL    4
    1    H1   GLY   1           HT1      GLY   1 293.964 -21.448 -14.451
    2    H2   GLY   1           HT2      GLY   1 293.054 -21.252 -15.862
    3    H3   GLY   1           HT3      GLY   1 292.329 -21.028 -14.351
    4    HA2  GLY   1           HA3      GLY   1 294.573 -19.339 -14.539
    5    HA3  GLY   1           HA2      GLY   1 293.565 -19.118 -15.962
    6    H    THR   2           H        THR   2 292.761 -17.121 -15.481
    7    HA   THR   2           HA       THR   2 291.463 -15.529 -14.505
    8    HB   THR   2           HB       THR   2 289.342 -16.206 -13.701
    9    HG1  THR   2           HG1      THR   2 289.102 -17.845 -12.430
   10   HG21  THR   2          HG21      THR   2 289.291 -18.622 -15.130
   11   HG22  THR   2          HG22      THR   2 290.420 -17.555 -15.965
   12   HG23  THR   2          HG23      THR   2 288.765 -17.025 -15.664
   13    H    GLU   3           H        GLU   3 293.831 -16.245 -13.096
   14    HA   GLU   3           HA       GLU   3 293.186 -16.382 -10.290
   15    HB2  GLU   3           HB2      GLU   3 295.345 -17.150 -11.702
   16    HB3  GLU   3           HB3      GLU   3 295.911 -15.600 -11.093
   17    HG2  GLU   3           HG2      GLU   3 294.918 -16.617  -8.831
   18    HG3  GLU   3           HG3      GLU   3 295.339 -18.116  -9.660
   19    H    ASN   4           H        ASN   4 291.836 -14.256 -11.085
   20    HA   ASN   4           HA       ASN   4 293.296 -12.068  -9.831
   21    HB2  ASN   4           HB2      ASN   4 293.062 -12.120 -12.562
   22    HB3  ASN   4           HB3      ASN   4 291.668 -11.161 -12.082
   23   HD21  ASN   4          HD21      ASN   4 292.002  -9.075 -11.919
   24   HD22  ASN   4          HD22      ASN   4 293.515  -8.309 -11.591
   25    H    ASP   5           H        ASP   5 290.890 -13.958  -9.378
   26    HA   ASP   5           HA       ASP   5 288.714 -12.057  -9.065
   27    HB2  ASP   5           HB2      ASP   5 288.759 -14.778  -9.469
   28    HB3  ASP   5           HB3      ASP   5 288.492 -14.681  -7.731
   29    H    HIS   6           H        HIS   6 287.780 -13.074  -6.474
   30    HA   HIS   6           HA       HIS   6 289.705 -11.627  -4.856
   31    HB2  HIS   6           HB2      HIS   6 286.949 -12.643  -4.166
   32    HB3  HIS   6           HB3      HIS   6 288.064 -11.992  -3.048
   33    HD1  HIS   6           HD1      HIS   6 286.442 -10.789  -6.246
   34    HD2  HIS   6           HD2      HIS   6 287.709  -9.444  -2.523
   35    HE1  HIS   6           HE1      HIS   6 285.706  -8.389  -6.122
   36    HE2  HIS   6           HE2      HIS   6 286.414  -7.610  -3.830
   37    H    ILE   7           H        ILE   7 290.046 -12.433  -2.662
   38    HA   ILE   7           HA       ILE   7 289.842 -15.196  -2.076
   39    HB   ILE   7           HB       ILE   7 291.983 -15.987  -2.260
   40   HG12  ILE   7          HG12      ILE   7 293.014 -13.163  -2.035
   41   HG13  ILE   7          HG13      ILE   7 293.011 -14.368  -0.754
   42   HG21  ILE   7          HG21      ILE   7 291.439 -15.526  -4.510
   43   HG22  ILE   7          HG22      ILE   7 293.140 -15.113  -4.283
   44   HG23  ILE   7          HG23      ILE   7 291.926 -13.838  -4.347
   45   HD11  ILE   7          HD11      ILE   7 295.122 -14.707  -1.417
   46   HD12  ILE   7          HD12      ILE   7 294.837 -14.015  -3.019
   47   HD13  ILE   7          HD13      ILE   7 294.362 -15.681  -2.680
   48    H    ASN   8           H        ASN   8 289.979 -15.504   0.065
   49    HA   ASN   8           HA       ASN   8 289.963 -13.073   1.611
   50    HB2  ASN   8           HB2      ASN   8 288.657 -15.525   1.794
   51    HB3  ASN   8           HB3      ASN   8 289.753 -15.527   3.173
   52   HD21  ASN   8          HD21      ASN   8 289.818 -13.104   4.113
   53   HD22  ASN   8          HD22      ASN   8 288.251 -12.515   4.541
   54    H    LEU   9           H        LEU   9 291.493 -12.430   3.113
   55    HA   LEU   9           HA       LEU   9 293.836 -14.140   3.477
   56    HB2  LEU   9           HB2      LEU   9 293.571 -11.219   3.035
   57    HB3  LEU   9           HB3      LEU   9 294.832 -11.750   4.038
   58    HG   LEU   9           HG       LEU   9 296.109 -12.108   2.251
   59   HD11  LEU   9          HD11      LEU   9 295.326 -14.422   2.321
   60   HD12  LEU   9          HD12      LEU   9 295.603 -13.904   0.657
   61   HD13  LEU   9          HD13      LEU   9 293.960 -13.997   1.288
   62   HD21  LEU   9          HD21      LEU   9 294.870 -11.854  -0.078
   63   HD22  LEU   9          HD22      LEU   9 295.289 -10.468   0.935
   64   HD23  LEU   9          HD23      LEU   9 293.648 -11.116   0.959
   65    H    LYS  10           H        LYS  10 294.514 -14.464   5.504
   66    HA   LYS  10           HA       LYS  10 292.815 -13.389   7.628
   67    HB2  LYS  10           HB2      LYS  10 294.676 -15.694   7.426
   68    HB3  LYS  10           HB3      LYS  10 293.972 -15.237   8.916
   69    HG2  LYS  10           HG2      LYS  10 291.776 -15.652   8.071
   70    HG3  LYS  10           HG3      LYS  10 292.412 -15.885   6.443
   71    HD2  LYS  10           HD2      LYS  10 293.440 -17.549   8.649
   72    HD3  LYS  10           HD3      LYS  10 291.857 -17.922   7.960
   73    HE2  LYS  10           HE2      LYS  10 293.065 -17.866   5.714
   74    HE3  LYS  10           HE3      LYS  10 294.550 -17.970   6.660
   75    HZ1  LYS  10           HZ1      LYS  10 292.385 -19.955   6.389
   76    HZ2  LYS  10           HZ2      LYS  10 293.406 -19.980   7.738
   77    HZ3  LYS  10           HZ3      LYS  10 294.052 -20.165   6.186
   78    H    VAL  11           H        VAL  11 293.680 -11.503   8.380
   79    HA   VAL  11           HA       VAL  11 296.576 -11.308   8.458
   80    HB   VAL  11           HB       VAL  11 295.626  -9.375   7.537
   81   HG11  VAL  11          HG11      VAL  11 293.738  -8.326   8.097
   82   HG12  VAL  11          HG12      VAL  11 293.981  -8.556   9.830
   83   HG13  VAL  11          HG13      VAL  11 293.354  -9.874   8.847
   84   HG21  VAL  11          HG21      VAL  11 297.084  -9.254   9.929
   85   HG22  VAL  11          HG22      VAL  11 295.907  -7.939   9.970
   86   HG23  VAL  11          HG23      VAL  11 297.028  -8.085   8.613
   87    H    ALA  12           H        ALA  12 297.702 -11.621  10.227
   88    HA   ALA  12           HA       ALA  12 296.264 -12.002  12.766
   89    HB1  ALA  12           HB1      ALA  12 298.866 -12.962  13.093
   90    HB2  ALA  12           HB2      ALA  12 298.359 -13.480  11.484
   91    HB3  ALA  12           HB3      ALA  12 297.385 -13.904  12.896
   92    H    GLY  13           H        GLY  13 296.584 -10.698  14.451
   93    HA2  GLY  13           HA2      GLY  13 298.433  -8.486  14.073
   94    HA3  GLY  13           HA3      GLY  13 297.187  -8.609  15.303
   95    H    GLN  14           H        GLN  14 299.725  -7.739  15.861
   96    HA   GLN  14           HA       GLN  14 301.489  -9.713  16.787
   97    HB2  GLN  14           HB2      GLN  14 301.075  -6.852  17.653
   98    HB3  GLN  14           HB3      GLN  14 302.451  -7.842  18.133
   99    HG2  GLN  14           HG2      GLN  14 302.010  -7.775  15.250
  100    HG3  GLN  14           HG3      GLN  14 302.328  -6.189  15.953
  101   HE21  GLN  14          HE21      GLN  14 303.552  -9.324  17.000
  102   HE22  GLN  14          HE22      GLN  14 305.219  -8.971  16.718
  103    H    ASP  15           H        ASP  15 298.477  -8.664  17.999
  104    HA   ASP  15           HA       ASP  15 299.019  -9.476  20.736
  105    HB2  ASP  15           HB2      ASP  15 296.730  -8.169  19.328
  106    HB3  ASP  15           HB3      ASP  15 296.434  -8.981  20.863
  107    H    GLY  16           H        GLY  16 298.411 -11.160  17.987
  108    HA2  GLY  16           HA2      GLY  16 298.097 -13.502  17.966
  109    HA3  GLY  16           HA3      GLY  16 297.298 -13.386  19.524
  110    H    SER  17           H        SER  17 295.974 -10.991  17.724
  111    HA   SER  17           HA       SER  17 293.695 -12.654  17.005
  112    HB2  SER  17           HB2      SER  17 294.027  -9.752  17.693
  113    HB3  SER  17           HB3      SER  17 292.635 -10.270  16.743
  114    HG   SER  17           HG       SER  17 292.241 -10.265  19.021
  115    H    VAL  18           H        VAL  18 293.325 -13.106  14.969
  116    HA   VAL  18           HA       VAL  18 294.640 -11.531  12.860
  117    HB   VAL  18           HB       VAL  18 295.448 -13.585  12.350
  118   HG11  VAL  18          HG11      VAL  18 293.167 -14.695  13.916
  119   HG12  VAL  18          HG12      VAL  18 294.906 -14.844  14.188
  120   HG13  VAL  18          HG13      VAL  18 294.138 -15.737  12.874
  121   HG21  VAL  18          HG21      VAL  18 294.100 -14.829  10.742
  122   HG22  VAL  18          HG22      VAL  18 294.008 -13.088  10.481
  123   HG23  VAL  18          HG23      VAL  18 292.666 -13.935  11.249
  124    H    VAL  19           H        VAL  19 293.307 -11.478  10.754
  125    HA   VAL  19           HA       VAL  19 290.419 -11.491  11.243
  126    HB   VAL  19           HB       VAL  19 291.760  -9.136   9.981
  127   HG11  VAL  19          HG11      VAL  19 289.013  -9.988  10.339
  128   HG12  VAL  19          HG12      VAL  19 289.674  -8.725   9.303
  129   HG13  VAL  19          HG13      VAL  19 289.302  -8.376  10.987
  130   HG21  VAL  19          HG21      VAL  19 291.463  -7.911  12.014
  131   HG22  VAL  19          HG22      VAL  19 292.408  -9.365  12.351
  132   HG23  VAL  19          HG23      VAL  19 290.698  -9.306  12.780
  133    H    GLN  20           H        GLN  20 289.168 -11.663   9.335
  134    HA   GLN  20           HA       GLN  20 290.724 -12.660   7.083
  135    HB2  GLN  20           HB2      GLN  20 287.738 -12.804   7.496
  136    HB3  GLN  20           HB3      GLN  20 288.691 -13.699   6.315
  137    HG2  GLN  20           HG2      GLN  20 289.789 -14.162   8.881
  138    HG3  GLN  20           HG3      GLN  20 288.045 -14.422   8.973
  139   HE21  GLN  20          HE21      GLN  20 290.076 -16.384   9.263
  140   HE22  GLN  20          HE22      GLN  20 289.887 -17.532   7.988
  141    H    PHE  21           H        PHE  21 290.770 -11.778   5.134
  142    HA   PHE  21           HA       PHE  21 288.992  -9.583   4.437
  143    HB2  PHE  21           HB2      PHE  21 291.995  -9.312   4.599
  144    HB3  PHE  21           HB3      PHE  21 290.965  -8.216   3.687
  145    HD1  PHE  21           HD1      PHE  21 289.195  -6.920   4.960
  146    HD2  PHE  21           HD2      PHE  21 292.357  -9.034   6.860
  147    HE1  PHE  21           HE1      PHE  21 288.852  -5.595   7.000
  148    HE2  PHE  21           HE2      PHE  21 292.025  -7.694   8.898
  149    HZ   PHE  21           HZ       PHE  21 290.273  -5.984   8.966
  150    H    LYS  22           H        LYS  22 288.288 -10.207   2.509
  151    HA   LYS  22           HA       LYS  22 290.217 -11.454   0.728
  152    HB2  LYS  22           HB2      LYS  22 288.767 -12.962   0.096
  153    HB3  LYS  22           HB3      LYS  22 287.721 -12.415   1.389
  154    HG2  LYS  22           HG2      LYS  22 286.837 -10.832  -0.212
  155    HG3  LYS  22           HG3      LYS  22 287.800 -11.604  -1.412
  156    HD2  LYS  22           HD2      LYS  22 286.392 -13.595   0.056
  157    HD3  LYS  22           HD3      LYS  22 285.239 -12.397  -0.544
  158    HE2  LYS  22           HE2      LYS  22 285.822 -12.813  -2.764
  159    HE3  LYS  22           HE3      LYS  22 287.320 -13.622  -2.299
  160    HZ1  LYS  22           HZ1      LYS  22 285.540 -15.148  -3.047
  161    HZ2  LYS  22           HZ2      LYS  22 284.612 -14.681  -1.713
  162    HZ3  LYS  22           HZ3      LYS  22 286.088 -15.474  -1.479
  163    H    ILE  23           H        ILE  23 290.897 -10.520  -0.978
  164    HA   ILE  23           HA       ILE  23 289.362  -8.424  -2.210
  165    HB   ILE  23           HB       ILE  23 290.359  -6.774  -1.085
  166   HG12  ILE  23          HG12      ILE  23 292.224  -7.583  -3.110
  167   HG13  ILE  23          HG13      ILE  23 291.838  -5.974  -2.546
  168   HG21  ILE  23          HG21      ILE  23 290.960  -8.295   0.708
  169   HG22  ILE  23          HG22      ILE  23 292.217  -7.081   0.474
  170   HG23  ILE  23          HG23      ILE  23 292.451  -8.720  -0.132
  171   HD11  ILE  23          HD11      ILE  23 293.507  -6.142  -0.809
  172   HD12  ILE  23          HD12      ILE  23 294.227  -6.487  -2.384
  173   HD13  ILE  23          HD13      ILE  23 293.852  -7.807  -1.278
  174    H    LYS  24           H        LYS  24 289.631  -8.450  -4.259
  175    HA   LYS  24           HA       LYS  24 290.544 -10.305  -5.850
  176    HB2  LYS  24           HB2      LYS  24 290.680  -7.396  -6.291
  177    HB3  LYS  24           HB3      LYS  24 291.263  -8.509  -7.530
  178    HG2  LYS  24           HG2      LYS  24 289.193  -9.503  -7.817
  179    HG3  LYS  24           HG3      LYS  24 288.600  -8.937  -6.257
  180    HD2  LYS  24           HD2      LYS  24 289.363  -6.917  -8.246
  181    HD3  LYS  24           HD3      LYS  24 287.874  -7.812  -8.526
  182    HE2  LYS  24           HE2      LYS  24 286.904  -7.038  -6.558
  183    HE3  LYS  24           HE3      LYS  24 288.461  -6.589  -5.863
  184    HZ1  LYS  24           HZ1      LYS  24 288.443  -4.948  -7.897
  185    HZ2  LYS  24           HZ2      LYS  24 287.649  -4.554  -6.458
  186    HZ3  LYS  24           HZ3      LYS  24 286.768  -5.144  -7.773
  187    H    ARG  25           H        ARG  25 292.387 -11.273  -6.595
  188    HA   ARG  25           HA       ARG  25 294.654 -11.237  -5.106
  189    HB2  ARG  25           HB2      ARG  25 294.445 -11.960  -8.026
  190    HB3  ARG  25           HB3      ARG  25 295.700 -12.467  -6.914
  191    HG2  ARG  25           HG2      ARG  25 293.852 -13.500  -5.520
  192    HG3  ARG  25           HG3      ARG  25 292.830 -13.264  -6.933
  193    HD2  ARG  25           HD2      ARG  25 294.181 -14.687  -8.263
  194    HD3  ARG  25           HD3      ARG  25 295.455 -14.722  -7.045
  195    HE   ARG  25           HE       ARG  25 294.346 -16.431  -6.026
  196   HH11  ARG  25          HH11      ARG  25 292.081 -14.708  -8.046
  197   HH12  ARG  25          HH12      ARG  25 290.782 -15.813  -7.749
  198   HH21  ARG  25          HH21      ARG  25 292.638 -17.887  -5.633
  199   HH22  ARG  25          HH22      ARG  25 291.097 -17.618  -6.378
  200    H    HIS  26           H        HIS  26 294.377  -9.639  -8.304
  201    HA   HIS  26           HA       HIS  26 296.973  -8.501  -8.021
  202    HB2  HIS  26           HB2      HIS  26 294.898  -8.548 -10.072
  203    HB3  HIS  26           HB3      HIS  26 295.755  -7.010  -9.983
  204    HD1  HIS  26           HD1      HIS  26 297.951  -6.904 -11.139
  205    HD2  HIS  26           HD2      HIS  26 296.742 -10.818 -10.439
  206    HE1  HIS  26           HE1      HIS  26 299.658  -8.351 -12.288
  207    HE2  HIS  26           HE2      HIS  26 298.957 -10.715 -11.770
  208    H    THR  27           H        THR  27 295.025  -7.796  -5.865
  209    HA   THR  27           HA       THR  27 294.980  -4.890  -6.265
  210    HB   THR  27           HB       THR  27 293.375  -6.674  -4.435
  211    HG1  THR  27           HG1      THR  27 292.489  -4.627  -6.132
  212   HG21  THR  27          HG21      THR  27 292.355  -4.699  -3.469
  213   HG22  THR  27          HG22      THR  27 293.451  -3.662  -4.372
  214   HG23  THR  27          HG23      THR  27 294.082  -4.716  -3.109
  215    HA   PRO  28           HA       PRO  28 298.332  -4.571  -3.441
  216    HB2  PRO  28           HB2      PRO  28 297.327  -1.975  -2.569
  217    HB3  PRO  28           HB3      PRO  28 298.788  -2.357  -3.474
  218    HG2  PRO  28           HG2      PRO  28 296.640  -1.090  -4.564
  219    HG3  PRO  28           HG3      PRO  28 297.765  -2.092  -5.497
  220    HD2  PRO  28           HD2      PRO  28 295.026  -2.714  -4.510
  221    HD3  PRO  28           HD3      PRO  28 295.837  -3.227  -6.005
  222    H    LEU  29           H        LEU  29 298.488  -5.491  -1.547
  223    HA   LEU  29           HA       LEU  29 296.341  -6.042   0.121
  224    HB2  LEU  29           HB2      LEU  29 299.297  -6.027   0.699
  225    HB3  LEU  29           HB3      LEU  29 298.088  -6.672   1.798
  226    HG   LEU  29           HG       LEU  29 298.160  -7.672  -1.009
  227   HD11  LEU  29          HD11      LEU  29 299.734  -9.262   0.854
  228   HD12  LEU  29          HD12      LEU  29 300.464  -7.708   0.450
  229   HD13  LEU  29          HD13      LEU  29 300.041  -8.844  -0.832
  230   HD21  LEU  29          HD21      LEU  29 297.025  -8.461   1.582
  231   HD22  LEU  29          HD22      LEU  29 297.711  -9.778   0.620
  232   HD23  LEU  29          HD23      LEU  29 296.451  -8.754  -0.068
  233    H    SER  30           H        SER  30 298.100  -3.111  -0.186
  234    HA   SER  30           HA       SER  30 298.039  -2.058   2.365
  235    HB2  SER  30           HB2      SER  30 299.108  -0.683   0.822
  236    HB3  SER  30           HB3      SER  30 297.825  -0.858  -0.375
  237    HG   SER  30           HG       SER  30 296.711   0.701   0.563
  238    H    LYS  31           H        LYS  31 295.440  -2.826   0.228
  239    HA   LYS  31           HA       LYS  31 293.473  -1.160   1.500
  240    HB2  LYS  31           HB2      LYS  31 293.295  -1.923  -0.863
  241    HB3  LYS  31           HB3      LYS  31 293.126  -3.576  -0.293
  242    HG2  LYS  31           HG2      LYS  31 291.011  -3.201   0.567
  243    HG3  LYS  31           HG3      LYS  31 291.235  -1.451   0.621
  244    HD2  LYS  31           HD2      LYS  31 291.383  -2.790  -2.027
  245    HD3  LYS  31           HD3      LYS  31 289.796  -2.624  -1.272
  246    HE2  LYS  31           HE2      LYS  31 291.144  -0.153  -0.995
  247    HE3  LYS  31           HE3      LYS  31 291.324  -0.677  -2.668
  248    HZ1  LYS  31           HZ1      LYS  31 288.666  -0.913  -1.496
  249    HZ2  LYS  31           HZ2      LYS  31 289.121  -0.470  -3.063
  250    HZ3  LYS  31           HZ3      LYS  31 289.216   0.656  -1.806
  251    H    LEU  32           H        LEU  32 294.402  -4.572   1.513
  252    HA   LEU  32           HA       LEU  32 292.521  -5.554   3.320
  253    HB2  LEU  32           HB2      LEU  32 293.894  -6.964   1.909
  254    HB3  LEU  32           HB3      LEU  32 295.351  -6.372   2.659
  255    HG   LEU  32           HG       LEU  32 293.431  -7.841   4.402
  256   HD11  LEU  32          HD11      LEU  32 294.951  -9.843   3.442
  257   HD12  LEU  32          HD12      LEU  32 294.658  -8.908   1.976
  258   HD13  LEU  32          HD13      LEU  32 293.299  -9.501   2.930
  259   HD21  LEU  32          HD21      LEU  32 295.301  -8.333   5.623
  260   HD22  LEU  32          HD22      LEU  32 295.800  -6.792   4.910
  261   HD23  LEU  32          HD23      LEU  32 296.353  -8.313   4.194
  262    H    MET  33           H        MET  33 295.764  -4.179   3.851
  263    HA   MET  33           HA       MET  33 295.679  -4.495   6.654
  264    HB2  MET  33           HB2      MET  33 297.458  -2.381   6.117
  265    HB3  MET  33           HB3      MET  33 297.824  -4.041   6.500
  266    HG2  MET  33           HG2      MET  33 298.040  -4.664   4.298
  267    HG3  MET  33           HG3      MET  33 297.198  -3.229   3.750
  268    HE1  MET  33           HE1      MET  33 300.270  -4.984   4.000
  269    HE2  MET  33           HE2      MET  33 300.717  -4.307   5.567
  270    HE3  MET  33           HE3      MET  33 301.601  -3.827   4.110
  271    H    LYS  34           H        LYS  34 294.989  -1.795   4.509
  272    HA   LYS  34           HA       LYS  34 294.608   0.210   6.407
  273    HB2  LYS  34           HB2      LYS  34 293.525  -0.301   3.669
  274    HB3  LYS  34           HB3      LYS  34 292.776   0.962   4.636
  275    HG2  LYS  34           HG2      LYS  34 295.736   0.932   4.352
  276    HG3  LYS  34           HG3      LYS  34 294.744   1.510   3.012
  277    HD2  LYS  34           HD2      LYS  34 293.632   2.756   5.204
  278    HD3  LYS  34           HD3      LYS  34 295.357   2.770   5.565
  279    HE2  LYS  34           HE2      LYS  34 295.606   3.608   3.125
  280    HE3  LYS  34           HE3      LYS  34 293.895   4.006   3.268
  281    HZ1  LYS  34           HZ1      LYS  34 294.741   5.932   4.038
  282    HZ2  LYS  34           HZ2      LYS  34 296.199   5.240   4.542
  283    HZ3  LYS  34           HZ3      LYS  34 294.815   5.088   5.503
  284    H    ALA  35           H        ALA  35 292.450  -2.348   5.322
  285    HA   ALA  35           HA       ALA  35 290.171  -1.452   6.802
  286    HB1  ALA  35           HB1      ALA  35 289.594  -2.868   5.055
  287    HB2  ALA  35           HB2      ALA  35 289.532  -3.961   6.434
  288    HB3  ALA  35           HB3      ALA  35 290.934  -3.976   5.362
  289    H    TYR  36           H        TYR  36 292.865  -3.639   7.347
  290    HA   TYR  36           HA       TYR  36 292.034  -4.756   9.827
  291    HB2  TYR  36           HB2      TYR  36 293.932  -5.611   8.403
  292    HB3  TYR  36           HB3      TYR  36 294.844  -4.198   8.899
  293    HD1  TYR  36           HD1      TYR  36 292.686  -6.665  10.655
  294    HD2  TYR  36           HD2      TYR  36 296.464  -4.689  10.513
  295    HE1  TYR  36           HE1      TYR  36 293.388  -7.822  12.695
  296    HE2  TYR  36           HE2      TYR  36 297.166  -5.844  12.533
  297    HH   TYR  36           HH       TYR  36 295.296  -7.145  14.655
  298    H    CYS  37           H        CYS  37 293.924  -1.905   8.902
  299    HA   CYS  37           HA       CYS  37 294.616  -1.088  11.518
  300    HB2  CYS  37           HB2      CYS  37 294.618   0.100   8.782
  301    HB3  CYS  37           HB3      CYS  37 294.714   1.211  10.139
  302    HG   CYS  37           HG       CYS  37 297.029   0.451  10.631
  303    H    GLU  38           H        GLU  38 291.973  -0.541   9.339
  304    HA   GLU  38           HA       GLU  38 290.585   1.446  10.796
  305    HB2  GLU  38           HB2      GLU  38 290.371   0.362   8.347
  306    HB3  GLU  38           HB3      GLU  38 289.044  -0.435   9.180
  307    HG2  GLU  38           HG2      GLU  38 289.277   2.276   8.241
  308    HG3  GLU  38           HG3      GLU  38 287.888   1.331   8.706
  309    H    ARG  39           H        ARG  39 290.579  -2.069  10.737
  310    HA   ARG  39           HA       ARG  39 288.360  -2.660  12.236
  311    HB2  ARG  39           HB2      ARG  39 290.919  -3.924  11.497
  312    HB3  ARG  39           HB3      ARG  39 289.887  -4.688  12.614
  313    HG2  ARG  39           HG2      ARG  39 288.295  -3.988  10.452
  314    HG3  ARG  39           HG3      ARG  39 289.810  -4.630   9.802
  315    HD2  ARG  39           HD2      ARG  39 287.744  -5.909  11.353
  316    HD3  ARG  39           HD3      ARG  39 288.798  -6.598  10.125
  317    HE   ARG  39           HE       ARG  39 290.531  -6.464  11.983
  318   HH11  ARG  39          HH11      ARG  39 287.135  -7.063  12.563
  319   HH12  ARG  39          HH12      ARG  39 287.411  -7.837  14.086
  320   HH21  ARG  39          HH21      ARG  39 290.883  -7.473  13.984
  321   HH22  ARG  39          HH22      ARG  39 289.535  -8.069  14.891
  322    H    GLN  40           H        GLN  40 291.784  -2.349  13.175
  323    HA   GLN  40           HA       GLN  40 290.997  -2.675  15.983
  324    HB2  GLN  40           HB2      GLN  40 293.752  -2.958  14.808
  325    HB3  GLN  40           HB3      GLN  40 293.213  -3.453  16.404
  326    HG2  GLN  40           HG2      GLN  40 291.506  -4.862  14.873
  327    HG3  GLN  40           HG3      GLN  40 292.902  -4.782  13.797
  328   HE21  GLN  40          HE21      GLN  40 291.496  -6.784  15.787
  329   HE22  GLN  40          HE22      GLN  40 292.850  -7.568  16.519
  330    H    GLY  41           H        GLY  41 292.056  -0.167  13.894
  331    HA2  GLY  41           HA2      GLY  41 292.258   2.041  14.641
  332    HA3  GLY  41           HA3      GLY  41 292.590   1.445  16.259
  333    H    LEU  42           H        LEU  42 294.412  -0.262  13.993
  334    HA   LEU  42           HA       LEU  42 296.868   0.637  14.962
  335    HB2  LEU  42           HB2      LEU  42 296.198  -0.726  12.360
  336    HB3  LEU  42           HB3      LEU  42 297.840  -0.496  12.923
  337    HG   LEU  42           HG       LEU  42 295.919  -1.889  14.724
  338   HD11  LEU  42          HD11      LEU  42 296.116  -3.959  13.641
  339   HD12  LEU  42          HD12      LEU  42 297.358  -3.360  12.540
  340   HD13  LEU  42          HD13      LEU  42 295.686  -2.817  12.365
  341   HD21  LEU  42          HD21      LEU  42 298.520  -1.226  14.941
  342   HD22  LEU  42          HD22      LEU  42 298.667  -2.833  14.227
  343   HD23  LEU  42          HD23      LEU  42 297.794  -2.620  15.745
  344    H    SER  43           H        SER  43 298.600   1.520  13.423
  345    HA   SER  43           HA       SER  43 297.594   4.062  12.368
  346    HB2  SER  43           HB2      SER  43 299.342   4.449  13.889
  347    HB3  SER  43           HB3      SER  43 300.277   3.088  13.300
  348    HG   SER  43           HG       SER  43 301.272   4.556  12.174
  349    H    MET  44           H        MET  44 298.987   1.088  11.377
  350    HA   MET  44           HA       MET  44 299.307   0.204   9.327
  351    HB2  MET  44           HB2      MET  44 297.529   2.117   8.687
  352    HB3  MET  44           HB3      MET  44 298.926   2.707   7.791
  353    HG2  MET  44           HG2      MET  44 299.000   0.113   7.108
  354    HG3  MET  44           HG3      MET  44 297.268   0.308   7.365
  355    HE1  MET  44           HE1      MET  44 297.883  -0.523   4.407
  356    HE2  MET  44           HE2      MET  44 299.542  -0.159   4.882
  357    HE3  MET  44           HE3      MET  44 298.834   0.633   3.473
  358    H    ARG  45           H        ARG  45 300.486   3.597   9.508
  359    HA   ARG  45           HA       ARG  45 302.893   3.041   8.083
  360    HB2  ARG  45           HB2      ARG  45 301.642   5.323   8.952
  361    HB3  ARG  45           HB3      ARG  45 303.036   5.233  10.011
  362    HG2  ARG  45           HG2      ARG  45 303.575   4.785   7.156
  363    HG3  ARG  45           HG3      ARG  45 303.047   6.411   7.595
  364    HD2  ARG  45           HD2      ARG  45 304.814   6.402   9.369
  365    HD3  ARG  45           HD3      ARG  45 305.405   4.890   8.683
  366    HE   ARG  45           HE       ARG  45 305.185   7.078   6.808
  367   HH11  ARG  45          HH11      ARG  45 307.251   5.389   9.062
  368   HH12  ARG  45          HH12      ARG  45 308.716   5.949   8.328
  369   HH21  ARG  45          HH21      ARG  45 307.112   7.813   5.846
  370   HH22  ARG  45          HH22      ARG  45 308.638   7.325   6.505
  371    H    GLN  46           H        GLN  46 301.792   2.814  11.311
  372    HA   GLN  46           HA       GLN  46 304.375   2.258  12.527
  373    HB2  GLN  46           HB2      GLN  46 302.366   3.531  13.503
  374    HB3  GLN  46           HB3      GLN  46 301.678   1.931  13.765
  375    HG2  GLN  46           HG2      GLN  46 304.435   2.314  14.729
  376    HG3  GLN  46           HG3      GLN  46 303.204   3.262  15.564
  377   HE21  GLN  46          HE21      GLN  46 301.075   1.645  15.606
  378   HE22  GLN  46          HE22      GLN  46 301.416   0.201  16.484
  379    H    ILE  47           H        ILE  47 302.232   0.636  10.713
  380    HA   ILE  47           HA       ILE  47 302.609  -1.982  12.023
  381    HB   ILE  47           HB       ILE  47 300.285  -0.819  11.492
  382   HG12  ILE  47          HG12      ILE  47 300.566  -3.090  12.527
  383   HG13  ILE  47          HG13      ILE  47 299.177  -2.876  11.452
  384   HG21  ILE  47          HG21      ILE  47 300.769  -2.404   8.996
  385   HG22  ILE  47          HG22      ILE  47 300.873  -0.656   9.095
  386   HG23  ILE  47          HG23      ILE  47 299.341  -1.464   9.415
  387   HD11  ILE  47          HD11      ILE  47 301.257  -4.776  11.335
  388   HD12  ILE  47          HD12      ILE  47 301.099  -3.865   9.835
  389   HD13  ILE  47          HD13      ILE  47 299.683  -4.690  10.526
  390    H    ARG  48           H        ARG  48 303.285  -3.653  10.788
  391    HA   ARG  48           HA       ARG  48 303.744  -3.212   7.941
  392    HB2  ARG  48           HB2      ARG  48 305.728  -4.202   9.985
  393    HB3  ARG  48           HB3      ARG  48 305.806  -4.692   8.299
  394    HG2  ARG  48           HG2      ARG  48 305.851  -1.839   9.223
  395    HG3  ARG  48           HG3      ARG  48 307.283  -2.793   8.822
  396    HD2  ARG  48           HD2      ARG  48 306.965  -2.513   6.641
  397    HD3  ARG  48           HD3      ARG  48 305.272  -2.960   6.755
  398    HE   ARG  48           HE       ARG  48 304.717  -0.733   6.785
  399   HH11  ARG  48          HH11      ARG  48 308.147  -1.066   7.338
  400   HH12  ARG  48          HH12      ARG  48 308.459   0.632   7.210
  401   HH21  ARG  48          HH21      ARG  48 305.126   1.500   6.616
  402   HH22  ARG  48          HH22      ARG  48 306.744   2.090   6.800
  403    H    PHE  49           H        PHE  49 302.513  -4.733   7.005
  404    HA   PHE  49           HA       PHE  49 301.749  -7.008   8.631
  405    HB2  PHE  49           HB2      PHE  49 300.916  -6.281   5.793
  406    HB3  PHE  49           HB3      PHE  49 300.432  -7.729   6.613
  407    HD1  PHE  49           HD1      PHE  49 300.711  -4.481   8.351
  408    HD2  PHE  49           HD2      PHE  49 298.168  -7.347   6.497
  409    HE1  PHE  49           HE1      PHE  49 298.799  -3.372   9.293
  410    HE2  PHE  49           HE2      PHE  49 296.225  -6.209   7.484
  411    HZ   PHE  49           HZ       PHE  49 296.585  -4.228   8.912
  412    H    ARG  50           H        ARG  50 302.391  -9.146   8.106
  413    HA   ARG  50           HA       ARG  50 304.244  -9.400   5.874
  414    HB2  ARG  50           HB2      ARG  50 305.719  -9.574   7.688
  415    HB3  ARG  50           HB3      ARG  50 304.529 -10.384   8.697
  416    HG2  ARG  50           HG2      ARG  50 304.702 -12.362   7.461
  417    HG3  ARG  50           HG3      ARG  50 305.677 -11.584   6.210
  418    HD2  ARG  50           HD2      ARG  50 307.334 -12.611   7.313
  419    HD3  ARG  50           HD3      ARG  50 307.220 -11.150   8.314
  420    HE   ARG  50           HE       ARG  50 305.492 -12.962   9.447
  421   HH11  ARG  50          HH11      ARG  50 308.900 -12.907   8.701
  422   HH12  ARG  50          HH12      ARG  50 309.331 -13.960  10.006
  423   HH21  ARG  50          HH21      ARG  50 306.056 -14.349  11.164
  424   HH22  ARG  50          HH22      ARG  50 307.717 -14.780  11.403
  425    H    PHE  51           H        PHE  51 303.924 -11.185   4.690
  426    HA   PHE  51           HA       PHE  51 301.445 -12.608   5.222
  427    HB2  PHE  51           HB2      PHE  51 301.286 -12.015   3.032
  428    HB3  PHE  51           HB3      PHE  51 303.010 -11.973   2.801
  429    HD1  PHE  51           HD2      PHE  51 300.413 -14.540   3.525
  430    HD2  PHE  51           HD1      PHE  51 303.798 -13.444   1.209
  431    HE1  PHE  51           HE2      PHE  51 300.261 -16.671   2.304
  432    HE2  PHE  51           HE1      PHE  51 303.656 -15.565  -0.022
  433    HZ   PHE  51           HZ       PHE  51 301.884 -17.185   0.525
  434    H    ASP  52           H        ASP  52 301.461 -14.922   4.928
  435    HA   ASP  52           HA       ASP  52 302.967 -16.261   6.771
  436    HB2  ASP  52           HB2      ASP  52 301.099 -17.243   5.256
  437    HB3  ASP  52           HB3      ASP  52 302.413 -17.663   4.163
  438    H    GLY  53           H        GLY  53 304.978 -15.668   6.960
  439    HA2  GLY  53           HA2      GLY  53 307.201 -15.362   6.602
  440    HA3  GLY  53           HA3      GLY  53 307.104 -16.794   5.614
  441    H    GLN  54           H        GLN  54 306.129 -13.326   5.345
  442    HA   GLN  54           HA       GLN  54 307.867 -12.806   3.212
  443    HB2  GLN  54           HB2      GLN  54 305.670 -14.205   2.333
  444    HB3  GLN  54           HB3      GLN  54 305.134 -12.541   2.148
  445    HG2  GLN  54           HG2      GLN  54 306.167 -13.479   0.114
  446    HG3  GLN  54           HG3      GLN  54 306.984 -12.037   0.716
  447   HE21  GLN  54          HE21      GLN  54 309.058 -12.183   1.464
  448   HE22  GLN  54          HE22      GLN  54 310.026 -13.605   1.308
  449    HA   PRO  55           HA       PRO  55 306.954  -9.445   6.272
  450    HB2  PRO  55           HB2      PRO  55 308.912  -8.476   4.290
  451    HB3  PRO  55           HB3      PRO  55 308.924  -8.295   6.044
  452    HG2  PRO  55           HG2      PRO  55 310.350 -10.206   4.630
  453    HG3  PRO  55           HG3      PRO  55 309.933 -10.317   6.348
  454    HD2  PRO  55           HD2      PRO  55 309.045 -11.952   4.211
  455    HD3  PRO  55           HD3      PRO  55 308.511 -12.011   5.894
  456    H    ILE  56           H        ILE  56 305.027  -9.632   4.084
  457    HA   ILE  56           HA       ILE  56 304.378  -8.215   2.239
  458    HB   ILE  56           HB       ILE  56 303.026  -7.790   4.841
  459   HG12  ILE  56          HG12      ILE  56 303.022  -9.802   2.800
  460   HG13  ILE  56          HG13      ILE  56 302.398  -9.850   4.432
  461   HG21  ILE  56          HG21      ILE  56 302.437  -5.850   3.623
  462   HG22  ILE  56          HG22      ILE  56 301.070  -6.960   3.562
  463   HG23  ILE  56          HG23      ILE  56 302.140  -6.794   2.161
  464   HD11  ILE  56          HD11      ILE  56 300.925  -8.504   2.239
  465   HD12  ILE  56          HD12      ILE  56 300.344  -9.020   3.821
  466   HD13  ILE  56          HD13      ILE  56 300.757 -10.220   2.588
  467    H    ASN  57           H        ASN  57 303.930  -6.469   1.355
  468    HA   ASN  57           HA       ASN  57 304.997  -3.924   2.385
  469    HB2  ASN  57           HB2      ASN  57 305.117  -5.233  -0.233
  470    HB3  ASN  57           HB3      ASN  57 304.738  -3.518  -0.287
  471   HD21  ASN  57          HD21      ASN  57 306.873  -5.456   1.784
  472   HD22  ASN  57          HD22      ASN  57 308.299  -4.536   1.462
  473    H    GLU  58           H        GLU  58 303.813  -2.051   1.010
  474    HA   GLU  58           HA       GLU  58 301.045  -2.290   1.785
  475    HB2  GLU  58           HB2      GLU  58 302.892  -0.123   1.091
  476    HB3  GLU  58           HB3      GLU  58 301.258   0.126   0.490
  477    HG2  GLU  58           HG2      GLU  58 300.435  -0.307   2.812
  478    HG3  GLU  58           HG3      GLU  58 302.117  -0.299   3.339
  479    H    THR  59           H        THR  59 302.902  -2.123  -1.186
  480    HA   THR  59           HA       THR  59 300.497  -2.083  -2.807
  481    HB   THR  59           HB       THR  59 302.215  -2.181  -4.698
  482    HG1  THR  59           HG1      THR  59 304.332  -1.647  -4.050
  483   HG21  THR  59          HG21      THR  59 301.741  -0.017  -4.656
  484   HG22  THR  59          HG22      THR  59 303.172   0.186  -3.644
  485   HG23  THR  59          HG23      THR  59 301.584  -0.013  -2.898
  486    H    ASP  60           H        ASP  60 302.719  -4.423  -1.592
  487    HA   ASP  60           HA       ASP  60 302.635  -6.441  -3.469
  488    HB2  ASP  60           HB2      ASP  60 302.858  -6.416  -0.496
  489    HB3  ASP  60           HB3      ASP  60 302.572  -7.959  -1.291
  490    H    THR  61           H        THR  61 301.186  -7.927  -4.157
  491    HA   THR  61           HA       THR  61 298.532  -7.917  -2.881
  492    HB   THR  61           HB       THR  61 297.446  -7.975  -4.881
  493    HG1  THR  61           HG1      THR  61 299.317  -8.504  -6.726
  494   HG21  THR  61          HG21      THR  61 299.968  -6.563  -5.713
  495   HG22  THR  61          HG22      THR  61 298.631  -5.837  -4.819
  496   HG23  THR  61          HG23      THR  61 298.380  -6.409  -6.472
  497    HA   PRO  62           HA       PRO  62 298.509 -12.219  -1.978
  498    HB2  PRO  62           HB2      PRO  62 296.129 -12.216  -3.828
  499    HB3  PRO  62           HB3      PRO  62 296.297 -12.975  -2.242
  500    HG2  PRO  62           HG2      PRO  62 294.966 -10.711  -2.484
  501    HG3  PRO  62           HG3      PRO  62 296.088 -10.933  -1.125
  502    HD2  PRO  62           HD2      PRO  62 296.405  -9.300  -3.591
  503    HD3  PRO  62           HD3      PRO  62 297.021  -9.006  -1.953
  504    H    ALA  63           H        ALA  63 297.746 -11.390  -5.435
  505    HA   ALA  63           HA       ALA  63 298.630 -13.835  -6.553
  506    HB1  ALA  63           HB1      ALA  63 297.278 -11.863  -7.569
  507    HB2  ALA  63           HB2      ALA  63 298.423 -12.732  -8.592
  508    HB3  ALA  63           HB3      ALA  63 298.873 -11.169  -7.882
  509    H    GLN  64           H        GLN  64 299.998 -10.717  -6.005
  510    HA   GLN  64           HA       GLN  64 302.556 -11.079  -7.116
  511    HB2  GLN  64           HB2      GLN  64 300.974  -9.110  -5.819
  512    HB3  GLN  64           HB3      GLN  64 302.478  -9.202  -4.965
  513    HG2  GLN  64           HG2      GLN  64 302.233  -8.853  -7.926
  514    HG3  GLN  64           HG3      GLN  64 302.405  -7.520  -6.787
  515   HE21  GLN  64          HE21      GLN  64 304.362  -7.386  -5.553
  516   HE22  GLN  64          HE22      GLN  64 305.829  -8.052  -6.176
  517    H    LEU  65           H        LEU  65 301.023 -12.141  -4.319
  518    HA   LEU  65           HA       LEU  65 303.536 -12.815  -2.972
  519    HB2  LEU  65           HB2      LEU  65 300.778 -12.150  -2.022
  520    HB3  LEU  65           HB3      LEU  65 301.944 -12.885  -0.964
  521    HG   LEU  65           HG       LEU  65 302.005 -10.172  -2.248
  522   HD11  LEU  65          HD11      LEU  65 302.511 -10.879   0.618
  523   HD12  LEU  65          HD12      LEU  65 300.883 -10.640  -0.015
  524   HD13  LEU  65          HD13      LEU  65 302.058  -9.324  -0.081
  525   HD21  LEU  65          HD21      LEU  65 304.184 -10.955  -2.632
  526   HD22  LEU  65          HD22      LEU  65 304.276 -11.716  -1.045
  527   HD23  LEU  65          HD23      LEU  65 304.281  -9.957  -1.180
  528    H    GLU  66           H        GLU  66 301.386 -14.150  -4.933
  529    HA   GLU  66           HA       GLU  66 300.506 -16.206  -5.328
  530    HB2  GLU  66           HB2      GLU  66 303.003 -16.955  -3.785
  531    HB3  GLU  66           HB3      GLU  66 301.998 -18.120  -4.635
  532    HG2  GLU  66           HG2      GLU  66 302.834 -17.570  -6.632
  533    HG3  GLU  66           HG3      GLU  66 302.830 -15.844  -6.270
  534    H    MET  67           H        MET  67 299.241 -14.961  -3.343
  535    HA   MET  67           HA       MET  67 298.974 -16.737  -1.059
  536    HB2  MET  67           HB2      MET  67 297.706 -14.080  -1.734
  537    HB3  MET  67           HB3      MET  67 297.397 -14.960  -0.253
  538    HG2  MET  67           HG2      MET  67 299.838 -14.859   0.230
  539    HG3  MET  67           HG3      MET  67 300.022 -13.794  -1.158
  540    HE1  MET  67           HE1      MET  67 297.331 -14.195   1.583
  541    HE2  MET  67           HE2      MET  67 297.654 -12.832   2.648
  542    HE3  MET  67           HE3      MET  67 298.810 -14.150   2.532
  543    H    GLU  68           H        GLU  68 296.559 -17.107  -0.369
  544    HA   GLU  68           HA       GLU  68 295.026 -17.868  -2.775
  545    HB2  GLU  68           HB2      GLU  68 296.102 -19.584  -0.758
  546    HB3  GLU  68           HB3      GLU  68 294.340 -19.626  -0.683
  547    HG2  GLU  68           HG2      GLU  68 294.168 -20.411  -2.885
  548    HG3  GLU  68           HG3      GLU  68 295.834 -19.980  -3.269
  549    H    ASP  69           H        ASP  69 292.879 -18.895  -1.834
  550    HA   ASP  69           HA       ASP  69 291.522 -16.689  -0.549
  551    HB2  ASP  69           HB2      ASP  69 289.581 -17.495  -1.458
  552    HB3  ASP  69           HB3      ASP  69 290.755 -18.077  -2.630
  553    H    GLU  70           H        GLU  70 291.423 -16.624   1.402
  554    HA   GLU  70           HA       GLU  70 291.059 -17.137   3.686
  555    HB2  GLU  70           HB2      GLU  70 290.993 -20.058   2.899
  556    HB3  GLU  70           HB3      GLU  70 290.365 -19.316   4.363
  557    HG2  GLU  70           HG2      GLU  70 288.600 -18.251   3.129
  558    HG3  GLU  70           HG3      GLU  70 289.271 -18.822   1.607
  559    H    ASP  71           H        ASP  71 293.350 -16.481   2.743
  560    HA   ASP  71           HA       ASP  71 295.337 -18.429   3.633
  561    HB2  ASP  71           HB2      ASP  71 295.360 -16.695   1.461
  562    HB3  ASP  71           HB3      ASP  71 296.383 -15.888   2.639
  563    H    THR  72           H        THR  72 297.285 -16.708   4.577
  564    HA   THR  72           HA       THR  72 295.846 -15.139   6.584
  565    HB   THR  72           HB       THR  72 297.916 -17.196   7.218
  566    HG1  THR  72           HG1      THR  72 295.605 -16.824   8.687
  567   HG21  THR  72          HG21      THR  72 297.495 -14.668   8.529
  568   HG22  THR  72          HG22      THR  72 298.737 -15.888   8.813
  569   HG23  THR  72          HG23      THR  72 297.163 -16.031   9.596
  570    H    ILE  73           H        ILE  73 296.538 -13.254   6.763
  571    HA   ILE  73           HA       ILE  73 299.159 -12.465   5.715
  572    HB   ILE  73           HB       ILE  73 296.559 -10.958   6.131
  573   HG12  ILE  73          HG12      ILE  73 297.000 -11.651   3.927
  574   HG13  ILE  73          HG13      ILE  73 297.395  -9.948   4.029
  575   HG21  ILE  73          HG21      ILE  73 299.326  -9.943   6.645
  576   HG22  ILE  73          HG22      ILE  73 297.784  -9.370   7.287
  577   HG23  ILE  73          HG23      ILE  73 298.285  -8.917   5.657
  578   HD11  ILE  73          HD11      ILE  73 299.219 -12.237   3.832
  579   HD12  ILE  73          HD12      ILE  73 299.734 -10.692   4.522
  580   HD13  ILE  73          HD13      ILE  73 299.138 -10.769   2.858
  581    H    ASP  74           H        ASP  74 300.621 -11.744   7.162
  582    HA   ASP  74           HA       ASP  74 299.857 -12.023   9.979
  583    HB2  ASP  74           HB2      ASP  74 302.722 -11.753   9.077
  584    HB3  ASP  74           HB3      ASP  74 302.069 -12.552  10.506
  585    H    VAL  75           H        VAL  75 300.158 -10.406  11.440
  586    HA   VAL  75           HA       VAL  75 300.877  -7.825  10.236
  587    HB   VAL  75           HB       VAL  75 298.673  -8.473  12.112
  588   HG11  VAL  75          HG11      VAL  75 300.432  -6.033  12.380
  589   HG12  VAL  75          HG12      VAL  75 299.895  -7.139  13.649
  590   HG13  VAL  75          HG13      VAL  75 298.747  -6.036  12.896
  591   HG21  VAL  75          HG21      VAL  75 297.476  -7.159  10.708
  592   HG22  VAL  75          HG22      VAL  75 298.763  -7.610   9.600
  593   HG23  VAL  75          HG23      VAL  75 298.805  -6.051  10.416
  594    H    PHE  76           H        PHE  76 302.265  -6.593  11.121
  595    HA   PHE  76           HA       PHE  76 303.306  -7.085  13.768
  596    HB2  PHE  76           HB2      PHE  76 305.054  -7.008  11.324
  597    HB3  PHE  76           HB3      PHE  76 305.622  -7.090  12.970
  598    HD1  PHE  76           HD1      PHE  76 304.819  -9.062  14.380
  599    HD2  PHE  76           HD2      PHE  76 304.773  -9.110  10.095
  600    HE1  PHE  76           HE1      PHE  76 304.750 -11.516  14.401
  601    HE2  PHE  76           HE2      PHE  76 304.698 -11.554  10.146
  602    HZ   PHE  76           HZ       PHE  76 304.689 -12.764  12.284
  603    H    GLN  77           H        GLN  77 304.041  -5.217  14.639
  604    HA   GLN  77           HA       GLN  77 303.431  -2.794  13.102
  605    HB2  GLN  77           HB2      GLN  77 303.079  -3.616  15.848
  606    HB3  GLN  77           HB3      GLN  77 303.933  -2.082  15.768
  607    HG2  GLN  77           HG2      GLN  77 302.148  -0.987  14.851
  608    HG3  GLN  77           HG3      GLN  77 301.504  -2.442  14.094
  609   HE21  GLN  77          HE21      GLN  77 300.389  -3.960  15.412
  610   HE22  GLN  77          HE22      GLN  77 299.619  -3.455  16.873
  611    H    GLN  78           H        GLN  78 305.170  -1.972  12.089
  612    HA   GLN  78           HA       GLN  78 307.301  -1.335  11.620
  613    HB2  GLN  78           HB2      GLN  78 306.519  -0.210  14.130
  614    HB3  GLN  78           HB3      GLN  78 308.240  -0.563  14.180
  615    HG2  GLN  78           HG2      GLN  78 308.672   0.812  12.304
  616    HG3  GLN  78           HG3      GLN  78 306.954   0.969  11.941
  617   HE21  GLN  78          HE21      GLN  78 309.432   2.679  12.973
  618   HE22  GLN  78          HE22      GLN  78 308.665   3.754  14.086
  619    H    GLN  79           H        GLN  79 307.976  -3.506  11.198
  620    HA   GLN  79           HA       GLN  79 310.402  -4.226  12.262
  621    HB2  GLN  79           HB2      GLN  79 309.756  -6.299  13.538
  622    HB3  GLN  79           HB3      GLN  79 309.416  -4.783  14.356
  623    HG2  GLN  79           HG2      GLN  79 307.151  -5.023  14.154
  624    HG3  GLN  79           HG3      GLN  79 307.279  -6.033  12.714
  625   HE21  GLN  79          HE21      GLN  79 307.661  -5.976  16.203
  626   HE22  GLN  79          HE22      GLN  79 307.459  -7.675  16.441
  627    H    THR  80           H        THR  80 310.216  -4.292   9.838
  628    HA   THR  80           HA       THR  80 309.862  -7.064   9.016
  629    HB   THR  80           HB       THR  80 308.634  -6.270   6.936
  630    HG1  THR  80           HG1      THR  80 307.979  -4.272   6.826
  631   HG21  THR  80          HG21      THR  80 307.524  -7.395   8.900
  632   HG22  THR  80          HG22      THR  80 306.492  -6.395   7.875
  633   HG23  THR  80          HG23      THR  80 307.051  -5.780   9.432
  634    H    GLY  81           H        GLY  81 310.374  -7.089   6.472
  635    HA2  GLY  81           HA2      GLY  81 312.147  -5.258   5.356
  636    HA3  GLY  81           HA3      GLY  81 313.111  -6.424   6.253
  637    H    GLY  82           H        GLY  82 310.950  -5.953   3.533
  638    HA2  GLY  82           HA2      GLY  82 312.198  -8.081   2.087
  639    HA3  GLY  82           HA3      GLY  82 310.572  -8.501   2.600
  640    H1   GLY   1           HT1      GLY   1 312.456  -8.000  12.904
  641    H2   GLY   1           HT2      GLY   1 314.060  -7.806  12.403
  642    H3   GLY   1           HT3      GLY   1 312.808  -7.078  11.530
  643    HA2  GLY   1           HA3      GLY   1 312.341  -5.996  13.894
  644    HA3  GLY   1           HA2      GLY   1 314.075  -6.249  14.018
  645    H    SER   2           H        SER   2 315.104  -4.416  13.611
  646    HA   SER   2           HA       SER   2 315.728  -2.448  12.656
  647    HB2  SER   2           HB2      SER   2 314.546  -3.878  10.277
  648    HB3  SER   2           HB3      SER   2 315.286  -2.284  10.138
  649    HG   SER   2           HG       SER   2 317.153  -3.224  10.165
  650    H    GLU   3           H        GLU   3 314.772  -0.587  11.127
  651    HA   GLU   3           HA       GLU   3 311.955  -0.175  11.868
  652    HB2  GLU   3           HB2      GLU   3 313.964   1.076  13.178
  653    HB3  GLU   3           HB3      GLU   3 313.695   2.216  11.867
  654    HG2  GLU   3           HG2      GLU   3 311.871   3.009  12.834
  655    HG3  GLU   3           HG3      GLU   3 311.192   1.392  13.016
  656    H    GLU   4           H        GLU   4 314.645   0.869   9.806
  657    HA   GLU   4           HA       GLU   4 312.720   1.955   7.885
  658    HB2  GLU   4           HB2      GLU   4 315.686   2.326   8.224
  659    HB3  GLU   4           HB3      GLU   4 314.816   2.922   6.824
  660    HG2  GLU   4           HG2      GLU   4 314.375   4.770   7.939
  661    HG3  GLU   4           HG3      GLU   4 313.385   3.825   9.050
  662    H    LYS   5           H        LYS   5 314.502   1.801   5.668
  663    HA   LYS   5           HA       LYS   5 313.750  -0.032   4.051
  664    HB2  LYS   5           HB2      LYS   5 315.979  -0.234   3.042
  665    HB3  LYS   5           HB3      LYS   5 315.551   1.418   3.451
  666    HG2  LYS   5           HG2      LYS   5 316.926   0.057   5.598
  667    HG3  LYS   5           HG3      LYS   5 317.874   0.128   4.113
  668    HD2  LYS   5           HD2      LYS   5 318.163   2.361   4.264
  669    HD3  LYS   5           HD3      LYS   5 316.517   2.631   4.833
  670    HE2  LYS   5           HE2      LYS   5 317.088   2.145   7.046
  671    HE3  LYS   5           HE3      LYS   5 318.622   1.415   6.590
  672    HZ1  LYS   5           HZ1      LYS   5 318.699   4.012   5.661
  673    HZ2  LYS   5           HZ2      LYS   5 319.542   3.377   6.981
  674    HZ3  LYS   5           HZ3      LYS   5 318.040   4.114   7.216
  675    HA   PRO   6           HA       PRO   6 313.820  -4.245   5.520
  676    HB2  PRO   6           HB2      PRO   6 314.789  -4.546   2.686
  677    HB3  PRO   6           HB3      PRO   6 313.650  -5.572   3.568
  678    HG2  PRO   6           HG2      PRO   6 312.714  -3.770   1.895
  679    HG3  PRO   6           HG3      PRO   6 311.960  -3.926   3.494
  680    HD2  PRO   6           HD2      PRO   6 313.794  -1.812   2.466
  681    HD3  PRO   6           HD3      PRO   6 312.462  -1.680   3.629
  682    H    LYS   7           H        LYS   7 315.551  -4.540   6.923
  683    HA   LYS   7           HA       LYS   7 318.254  -4.183   6.378
  684    HB2  LYS   7           HB2      LYS   7 317.183  -4.742   8.625
  685    HB3  LYS   7           HB3      LYS   7 317.172  -6.421   8.102
  686    HG2  LYS   7           HG2      LYS   7 319.089  -6.181   9.431
  687    HG3  LYS   7           HG3      LYS   7 319.669  -6.191   7.765
  688    HD2  LYS   7           HD2      LYS   7 320.812  -4.364   8.438
  689    HD3  LYS   7           HD3      LYS   7 319.281  -3.547   8.119
  690    HE2  LYS   7           HE2      LYS   7 319.660  -2.792  10.234
  691    HE3  LYS   7           HE3      LYS   7 318.794  -4.279  10.617
  692    HZ1  LYS   7           HZ1      LYS   7 320.547  -4.828  11.835
  693    HZ2  LYS   7           HZ2      LYS   7 321.474  -3.547  11.235
  694    HZ3  LYS   7           HZ3      LYS   7 321.429  -5.019  10.403
  695    H    GLU   8           H        GLU   8 318.841  -4.873   4.355
  696    HA   GLU   8           HA       GLU   8 319.539  -6.313   2.723
  697    HB2  GLU   8           HB2      GLU   8 319.710  -7.903   5.194
  698    HB3  GLU   8           HB3      GLU   8 319.506  -8.871   3.741
  699    HG2  GLU   8           HG2      GLU   8 321.532  -8.253   2.874
  700    HG3  GLU   8           HG3      GLU   8 321.565  -6.725   3.753
  701    H    GLY   9           H        GLY   9 317.263  -5.630   2.052
  702    HA2  GLY   9           HA2      GLY   9 315.721  -8.038   1.450
  703    HA3  GLY   9           HA3      GLY   9 314.900  -6.738   2.281
  704    H    VAL  10           H        VAL  10 316.672  -7.536  -0.711
  705    HA   VAL  10           HA       VAL  10 315.085  -5.482  -2.071
  706    HB   VAL  10           HB       VAL  10 317.410  -4.765  -1.858
  707   HG11  VAL  10          HG11      VAL  10 318.256  -7.148  -1.733
  708   HG12  VAL  10          HG12      VAL  10 319.244  -6.002  -2.642
  709   HG13  VAL  10          HG13      VAL  10 318.208  -7.146  -3.497
  710   HG21  VAL  10          HG21      VAL  10 317.424  -3.872  -3.921
  711   HG22  VAL  10          HG22      VAL  10 315.916  -4.758  -4.146
  712   HG23  VAL  10          HG23      VAL  10 317.438  -5.453  -4.703
  713    H    LYS  11           H        LYS  11 314.010  -7.842  -1.921
  714    HA   LYS  11           HA       LYS  11 314.619  -9.892  -3.593
  715    HB2  LYS  11           HB2      LYS  11 312.060  -8.706  -2.696
  716    HB3  LYS  11           HB3      LYS  11 312.069 -10.067  -3.820
  717    HG2  LYS  11           HG2      LYS  11 312.100 -11.226  -1.905
  718    HG3  LYS  11           HG3      LYS  11 313.814 -11.004  -2.084
  719    HD2  LYS  11           HD2      LYS  11 312.988 -10.532   0.212
  720    HD3  LYS  11           HD3      LYS  11 313.840  -9.192  -0.553
  721    HE2  LYS  11           HE2      LYS  11 311.076  -8.971  -1.181
  722    HE3  LYS  11           HE3      LYS  11 311.227  -9.233   0.552
  723    HZ1  LYS  11           HZ3      LYS  11 312.564  -7.117  -1.036
  724    H    THR  12           H        THR  12 312.022  -7.759  -4.523
  725    HA   THR  12           HA       THR  12 312.953  -7.848  -7.316
  726    HB   THR  12           HB       THR  12 310.573  -7.405  -7.918
  727    HG1  THR  12           HG1      THR  12 309.217  -6.913  -6.415
  728   HG21  THR  12          HG21      THR  12 311.534  -9.744  -7.663
  729   HG22  THR  12          HG22      THR  12 309.779  -9.577  -7.616
  730   HG23  THR  12          HG23      THR  12 310.684  -9.796  -6.119
  731    H    GLU  13           H        GLU  13 314.368  -5.995  -6.548
  732    HA   GLU  13           HA       GLU  13 314.888  -3.780  -6.499
  733    HB2  GLU  13           HB2      GLU  13 312.535  -3.587  -8.396
  734    HB3  GLU  13           HB3      GLU  13 313.819  -2.399  -8.218
  735    HG2  GLU  13           HG2      GLU  13 315.143  -3.497  -9.615
  736    HG3  GLU  13           HG3      GLU  13 314.886  -5.022  -8.769
  737    H    ASN  14           H        ASN  14 311.523  -2.927  -7.087
  738    HA   ASN  14           HA       ASN  14 311.289  -1.062  -5.149
  739    HB2  ASN  14           HB2      ASN  14 309.681  -1.638  -7.011
  740    HB3  ASN  14           HB3      ASN  14 309.006  -2.810  -5.890
  741   HD21  ASN  14          HD21      ASN  14 308.741   0.265  -7.019
  742   HD22  ASN  14          HD22      ASN  14 307.848   0.972  -5.720
  743    H    ASP  15           H        ASP  15 312.190  -1.550  -3.206
  744    HA   ASP  15           HA       ASP  15 310.564  -2.551  -1.179
  745    HB2  ASP  15           HB2      ASP  15 312.012  -4.579  -0.593
  746    HB3  ASP  15           HB3      ASP  15 310.870  -4.780  -1.915
  747    H    HIS  16           H        HIS  16 312.220  -0.388  -1.748
  748    HA   HIS  16           HA       HIS  16 314.130   0.745  -1.201
  749    HB2  HIS  16           HB2      HIS  16 312.838   0.429   1.482
  750    HB3  HIS  16           HB3      HIS  16 313.756   1.777   0.857
  751    HD1  HIS  16           HD1      HIS  16 310.372   0.227   0.671
  752    HD2  HIS  16           HD2      HIS  16 312.418   3.517  -0.841
  753    HE1  HIS  16           HE1      HIS  16 308.608   1.704  -0.346
  754    HE2  HIS  16           HE2      HIS  16 309.878   3.642  -1.337
  755    H    ILE  17           H        ILE  17 316.116   0.876  -0.450
  756    HA   ILE  17           HA       ILE  17 317.117  -1.112   1.439
  757    HB   ILE  17           HB       ILE  17 319.041  -1.679   0.170
  758   HG12  ILE  17          HG12      ILE  17 318.052   0.310  -1.859
  759   HG13  ILE  17          HG13      ILE  17 319.550   0.380  -0.964
  760   HG21  ILE  17          HG21      ILE  17 317.985  -3.263  -0.983
  761   HG22  ILE  17          HG22      ILE  17 317.270  -2.092  -2.098
  762   HG23  ILE  17          HG23      ILE  17 316.482  -2.444  -0.553
  763   HD11  ILE  17          HD11      ILE  17 319.049  -0.781  -3.502
  764   HD12  ILE  17          HD12      ILE  17 319.589  -2.035  -2.385
  765   HD13  ILE  17          HD13      ILE  17 320.580  -0.591  -2.636
  766    H    ASN  18           H        ASN  18 319.128  -0.444   2.433
  767    HA   ASN  18           HA       ASN  18 319.244   2.417   2.666
  768    HB2  ASN  18           HB2      ASN  18 319.622   0.471   4.495
  769    HB3  ASN  18           HB3      ASN  18 321.277   0.618   3.943
  770   HD21  ASN  18          HD21      ASN  18 320.468   3.597   3.421
  771   HD22  ASN  18          HD22      ASN  18 320.693   4.315   4.973
  772    H    LEU  19           H        LEU  19 320.520   3.589   1.372
  773    HA   LEU  19           HA       LEU  19 322.791   2.267   0.112
  774    HB2  LEU  19           HB2      LEU  19 320.896   4.247  -0.833
  775    HB3  LEU  19           HB3      LEU  19 322.540   4.830  -1.041
  776    HG   LEU  19           HG       LEU  19 321.252   2.347  -2.201
  777   HD11  LEU  19          HD11      LEU  19 320.988   4.082  -3.685
  778   HD12  LEU  19          HD12      LEU  19 322.433   3.271  -4.259
  779   HD13  LEU  19          HD13      LEU  19 322.574   4.765  -3.334
  780   HD21  LEU  19          HD21      LEU  19 323.902   2.414  -1.231
  781   HD22  LEU  19          HD22      LEU  19 323.997   2.503  -2.983
  782   HD23  LEU  19          HD23      LEU  19 323.122   1.172  -2.215
  783    H    LYS  20           H        LYS  20 324.742   3.610  -0.152
  784    HA   LYS  20           HA       LYS  20 325.154   5.412   2.147
  785    HB2  LYS  20           HB2      LYS  20 326.155   2.813   1.889
  786    HB3  LYS  20           HB3      LYS  20 327.497   3.830   1.523
  787    HG2  LYS  20           HG2      LYS  20 327.391   4.871   3.561
  788    HG3  LYS  20           HG3      LYS  20 325.808   4.258   3.904
  789    HD2  LYS  20           HD2      LYS  20 328.365   3.142   4.523
  790    HD3  LYS  20           HD3      LYS  20 326.775   2.640   5.085
  791    HE2  LYS  20           HE2      LYS  20 326.618   0.968   3.558
  792    HE3  LYS  20           HE3      LYS  20 327.594   1.815   2.355
  793    HZ1  LYS  20           HZ1      LYS  20 328.674  -0.164   3.357
  794    HZ2  LYS  20           HZ2      LYS  20 328.709   0.648   4.840
  795    HZ3  LYS  20           HZ3      LYS  20 329.569   1.263   3.520
  796    H    VAL  21           H        VAL  21 326.396   7.232   1.556
  797    HA   VAL  21           HA       VAL  21 327.666   7.125  -1.085
  798    HB   VAL  21           HB       VAL  21 326.840   9.724   0.148
  799   HG11  VAL  21          HG11      VAL  21 326.783  10.471  -2.085
  800   HG12  VAL  21          HG12      VAL  21 326.744   8.823  -2.716
  801   HG13  VAL  21          HG13      VAL  21 328.211   9.445  -1.961
  802   HG21  VAL  21          HG21      VAL  21 324.700   9.340  -1.348
  803   HG22  VAL  21          HG22      VAL  21 324.737   8.812   0.334
  804   HG23  VAL  21          HG23      VAL  21 325.007   7.649  -0.960
  805    H    ALA  22           H        ALA  22 329.827   7.452  -1.086
  806    HA   ALA  22           HA       ALA  22 331.084   8.229   1.451
  807    HB1  ALA  22           HB1      ALA  22 331.829   6.467  -0.790
  808    HB2  ALA  22           HB2      ALA  22 332.145   6.306   0.938
  809    HB3  ALA  22           HB3      ALA  22 333.148   7.373  -0.045
  810    H    GLY  23           H        GLY  23 331.132  10.441   1.450
  811    HA2  GLY  23           HA2      GLY  23 332.056  11.836  -0.931
  812    HA3  GLY  23           HA3      GLY  23 331.409  12.581   0.514
  813    H    GLN  24           H        GLN  24 333.924  12.741  -1.273
  814    HA   GLN  24           HA       GLN  24 336.078  13.384  -1.035
  815    HB2  GLN  24           HB2      GLN  24 335.233  13.845   1.799
  816    HB3  GLN  24           HB3      GLN  24 336.691  14.473   1.056
  817    HG2  GLN  24           HG2      GLN  24 335.448  15.843  -0.429
  818    HG3  GLN  24           HG3      GLN  24 333.934  15.055   0.017
  819   HE21  GLN  24          HE21      GLN  24 333.160  15.377   2.201
  820   HE22  GLN  24          HE22      GLN  24 333.519  16.852   3.024
  821    H    ASP  25           H        ASP  25 335.195  10.586  -0.277
  822    HA   ASP  25           HA       ASP  25 336.075   8.642   0.559
  823    HB2  ASP  25           HB2      ASP  25 337.610   9.326  -1.352
  824    HB3  ASP  25           HB3      ASP  25 338.731   9.889  -0.120
  825    H    GLY  26           H        GLY  26 335.788  10.831   2.524
  826    HA2  GLY  26           HA2      GLY  26 337.958  10.141   4.365
  827    HA3  GLY  26           HA3      GLY  26 337.006  11.610   4.460
  828    H    SER  27           H        SER  27 334.641   9.727   3.770
  829    HA   SER  27           HA       SER  27 334.270   8.025   6.001
  830    HB2  SER  27           HB2      SER  27 333.061   9.304   7.469
  831    HB3  SER  27           HB3      SER  27 334.040  10.593   6.772
  832    HG   SER  27           HG       SER  27 332.227  10.785   5.209
  833    H    VAL  28           H        VAL  28 331.444   8.345   6.161
  834    HA   VAL  28           HA       VAL  28 330.491   8.018   3.440
  835    HB   VAL  28           HB       VAL  28 331.307   5.806   3.895
  836   HG11  VAL  28          HG11      VAL  28 329.592   5.737   6.366
  837   HG12  VAL  28          HG12      VAL  28 331.323   6.092   6.374
  838   HG13  VAL  28          HG13      VAL  28 330.745   4.520   5.816
  839   HG21  VAL  28          HG21      VAL  28 329.346   4.512   3.476
  840   HG22  VAL  28          HG22      VAL  28 329.010   6.109   2.815
  841   HG23  VAL  28          HG23      VAL  28 328.327   5.640   4.372
  842    H    VAL  29           H        VAL  29 328.213   7.792   3.306
  843    HA   VAL  29           HA       VAL  29 326.714   8.566   5.705
  844    HB   VAL  29           HB       VAL  29 325.121   9.680   3.936
  845   HG11  VAL  29          HG11      VAL  29 325.960  11.829   4.524
  846   HG12  VAL  29          HG12      VAL  29 327.554  11.160   4.890
  847   HG13  VAL  29          HG13      VAL  29 326.165  10.739   5.899
  848   HG21  VAL  29          HG21      VAL  29 326.627   9.048   2.060
  849   HG22  VAL  29          HG22      VAL  29 327.778  10.231   2.661
  850   HG23  VAL  29          HG23      VAL  29 326.183  10.745   2.114
  851    H    GLN  30           H        GLN  30 324.571   7.758   5.683
  852    HA   GLN  30           HA       GLN  30 324.270   5.529   3.780
  853    HB2  GLN  30           HB2      GLN  30 324.137   5.681   6.635
  854    HB3  GLN  30           HB3      GLN  30 322.708   4.909   5.980
  855    HG2  GLN  30           HG2      GLN  30 324.298   3.415   4.707
  856    HG3  GLN  30           HG3      GLN  30 325.591   4.107   5.698
  857   HE21  GLN  30          HE21      GLN  30 325.521   3.763   7.970
  858   HE22  GLN  30          HE22      GLN  30 324.698   2.395   8.630
  859    H    PHE  31           H        PHE  31 322.915   6.083   2.324
  860    HA   PHE  31           HA       PHE  31 320.533   7.655   2.890
  861    HB2  PHE  31           HB2      PHE  31 321.775   6.627   0.323
  862    HB3  PHE  31           HB3      PHE  31 320.344   7.583   0.376
  863    HD1  PHE  31           HD2      PHE  31 322.802   8.472   2.854
  864    HD2  PHE  31           HD1      PHE  31 321.605   9.174  -1.159
  865    HE1  PHE  31           HE2      PHE  31 324.155  10.506   2.803
  866    HE2  PHE  31           HE1      PHE  31 322.964  11.211  -1.209
  867    HZ   PHE  31           HZ       PHE  31 324.243  11.871   0.778
  868    H    LYS  32           H        LYS  32 318.466   6.860   2.215
  869    HA   LYS  32           HA       LYS  32 318.388   3.931   1.939
  870    HB2  LYS  32           HB2      LYS  32 317.293   4.266   3.981
  871    HB3  LYS  32           HB3      LYS  32 316.528   5.731   3.429
  872    HG2  LYS  32           HG2      LYS  32 315.496   3.811   1.727
  873    HG3  LYS  32           HG3      LYS  32 315.612   2.987   3.275
  874    HD2  LYS  32           HD2      LYS  32 314.542   5.663   3.566
  875    HD3  LYS  32           HD3      LYS  32 313.587   4.689   2.447
  876    HE2  LYS  32           HE2      LYS  32 314.220   3.047   4.661
  877    HE3  LYS  32           HE3      LYS  32 313.663   4.592   5.300
  878    HZ1  LYS  32           HZ1      LYS  32 312.221   2.695   3.557
  879    HZ2  LYS  32           HZ2      LYS  32 311.752   4.317   3.655
  880    HZ3  LYS  32           HZ3      LYS  32 311.736   3.348   5.041
  881    H    ILE  33           H        ILE  33 317.588   3.229   0.154
  882    HA   ILE  33           HA       ILE  33 315.786   4.847  -1.432
  883    HB   ILE  33           HB       ILE  33 318.019   5.734  -2.024
  884   HG12  ILE  33          HG12      ILE  33 317.134   4.152  -4.420
  885   HG13  ILE  33          HG13      ILE  33 315.992   5.260  -3.679
  886   HG21  ILE  33          HG21      ILE  33 318.712   2.968  -2.016
  887   HG22  ILE  33          HG22      ILE  33 319.751   4.385  -2.155
  888   HG23  ILE  33          HG23      ILE  33 319.065   3.649  -3.604
  889   HD11  ILE  33          HD11      ILE  33 318.651   5.917  -4.901
  890   HD12  ILE  33          HD12      ILE  33 317.698   7.063  -3.956
  891   HD13  ILE  33          HD13      ILE  33 317.046   6.399  -5.456
  892    H    LYS  34           H        LYS  34 314.476   3.705  -2.608
  893    HA   LYS  34           HA       LYS  34 314.261   0.955  -2.380
  894    HB2  LYS  34           HB2      LYS  34 312.351   2.326  -2.886
  895    HB3  LYS  34           HB3      LYS  34 313.087   2.847  -4.384
  896    HG2  LYS  34           HG2      LYS  34 313.032   0.315  -4.976
  897    HG3  LYS  34           HG3      LYS  34 311.796   0.261  -3.718
  898    HD2  LYS  34           HD2      LYS  34 310.685   0.596  -5.805
  899    HD3  LYS  34           HD3      LYS  34 310.615   2.114  -4.912
  900    HE2  LYS  34           HE2      LYS  34 312.565   2.917  -6.209
  901    HE3  LYS  34           HE3      LYS  34 312.517   1.424  -7.147
  902    HZ1  LYS  34           HZ1      LYS  34 310.616   2.051  -8.216
  903    HZ2  LYS  34           HZ2      LYS  34 311.332   3.567  -7.989
  904    HZ3  LYS  34           HZ3      LYS  34 310.090   3.056  -6.962
  905    H    ARG  35           H        ARG  35 314.221   1.968  -5.692
  906    HA   ARG  35           HA       ARG  35 316.824   0.979  -6.330
  907    HB2  ARG  35           HB2      ARG  35 314.434  -0.797  -6.718
  908    HB3  ARG  35           HB3      ARG  35 315.818  -0.917  -7.768
  909    HG2  ARG  35           HG2      ARG  35 316.418  -1.020  -4.895
  910    HG3  ARG  35           HG3      ARG  35 315.499  -2.361  -5.558
  911    HD2  ARG  35           HD2      ARG  35 318.037  -1.368  -6.804
  912    HD3  ARG  35           HD3      ARG  35 318.007  -2.612  -5.556
  913    HE   ARG  35           HE       ARG  35 316.318  -3.123  -7.846
  914   HH11  ARG  35          HH11      ARG  35 319.450  -3.595  -6.374
  915   HH12  ARG  35          HH12      ARG  35 319.824  -4.991  -7.325
  916   HH21  ARG  35          HH21      ARG  35 316.817  -4.957  -9.102
  917   HH22  ARG  35          HH22      ARG  35 318.332  -5.764  -8.874
  918    H    HIS  36           H        HIS  36 313.875   0.459  -8.197
  919    HA   HIS  36           HA       HIS  36 314.670   1.409 -10.607
  920    HB2  HIS  36           HB2      HIS  36 312.625   0.348 -10.664
  921    HB3  HIS  36           HB3      HIS  36 312.002   1.224  -9.273
  922    HD1  HIS  36           HD1      HIS  36 310.621   3.296  -9.742
  923    HD2  HIS  36           HD2      HIS  36 312.514   1.812 -13.133
  924    HE1  HIS  36           HE1      HIS  36 309.657   4.588 -11.670
  925    HE2  HIS  36           HE2      HIS  36 310.735   3.594 -13.719
  926    H    THR  37           H        THR  37 314.110   3.354  -7.856
  927    HA   THR  37           HA       THR  37 313.523   5.798  -9.266
  928    HB   THR  37           HB       THR  37 314.320   5.134  -6.446
  929    HG1  THR  37           HG1      THR  37 312.027   6.178  -7.731
  930   HG21  THR  37          HG21      THR  37 314.638   7.710  -7.776
  931   HG22  THR  37          HG22      THR  37 315.217   7.156  -6.200
  932   HG23  THR  37          HG23      THR  37 313.573   7.774  -6.365
  933    HA   PRO  38           HA       PRO  38 317.423   6.757 -10.987
  934    HB2  PRO  38           HB2      PRO  38 316.403   9.472 -10.370
  935    HB3  PRO  38           HB3      PRO  38 316.989   8.800 -11.902
  936    HG2  PRO  38           HG2      PRO  38 314.345   9.176 -11.355
  937    HG3  PRO  38           HG3      PRO  38 314.939   7.923 -12.450
  938    HD2  PRO  38           HD2      PRO  38 313.795   7.749  -9.772
  939    HD3  PRO  38           HD3      PRO  38 313.926   6.514 -11.030
  940    H    LEU  39           H        LEU  39 319.423   7.440 -10.187
  941    HA   LEU  39           HA       LEU  39 319.581   7.597  -7.359
  942    HB2  LEU  39           HB2      LEU  39 321.602   7.640  -9.547
  943    HB3  LEU  39           HB3      LEU  39 322.075   8.124  -7.921
  944    HG   LEU  39           HG       LEU  39 320.697   5.508  -8.486
  945   HD11  LEU  39          HD11      LEU  39 323.647   5.775  -8.062
  946   HD12  LEU  39          HD12      LEU  39 322.944   5.817  -9.681
  947   HD13  LEU  39          HD13      LEU  39 322.725   4.396  -8.657
  948   HD21  LEU  39          HD21      LEU  39 321.137   4.964  -6.302
  949   HD22  LEU  39          HD22      LEU  39 320.871   6.702  -6.153
  950   HD23  LEU  39          HD23      LEU  39 322.513   6.060  -6.190
  951    H    SER  40           H        SER  40 319.189  10.078  -9.780
  952    HA   SER  40           HA       SER  40 320.475  12.186  -8.470
  953    HB2  SER  40           HB2      SER  40 318.795  11.857 -10.730
  954    HB3  SER  40           HB3      SER  40 318.042  13.084  -9.715
  955    HG   SER  40           HG       SER  40 319.613  13.906 -11.229
  956    H    LYS  41           H        LYS  41 317.893  10.295  -7.447
  957    HA   LYS  41           HA       LYS  41 316.525  12.291  -5.897
  958    HB2  LYS  41           HB2      LYS  41 316.264   9.454  -6.579
  959    HB3  LYS  41           HB3      LYS  41 315.689   9.896  -4.993
  960    HG2  LYS  41           HG2      LYS  41 313.777  10.288  -6.096
  961    HG3  LYS  41           HG3      LYS  41 314.537  11.823  -6.473
  962    HD2  LYS  41           HD2      LYS  41 315.004  11.231  -8.634
  963    HD3  LYS  41           HD3      LYS  41 315.066   9.505  -8.265
  964    HE2  LYS  41           HE2      LYS  41 313.084  10.311  -9.626
  965    HE3  LYS  41           HE3      LYS  41 312.733   9.326  -8.208
  966    HZ1  LYS  41           HZ1      LYS  41 312.683  12.285  -8.143
  967    HZ2  LYS  41           HZ2      LYS  41 312.051  11.209  -7.002
  968    HZ3  LYS  41           HZ3      LYS  41 311.317  11.361  -8.518
  969    H    LEU  42           H        LEU  42 319.018   9.963  -5.757
  970    HA   LEU  42           HA       LEU  42 319.376   9.930  -2.892
  971    HB2  LEU  42           HB2      LEU  42 319.612   8.009  -4.602
  972    HB3  LEU  42           HB3      LEU  42 321.156   8.737  -4.995
  973    HG   LEU  42           HG       LEU  42 320.738   8.193  -2.133
  974   HD11  LEU  42          HD11      LEU  42 321.183   5.825  -2.370
  975   HD12  LEU  42          HD12      LEU  42 321.008   5.972  -4.120
  976   HD13  LEU  42          HD13      LEU  42 319.627   6.273  -3.066
  977   HD21  LEU  42          HD21      LEU  42 322.918   7.859  -4.173
  978   HD22  LEU  42          HD22      LEU  42 323.067   7.270  -2.513
  979   HD23  LEU  42          HD23      LEU  42 322.852   8.995  -2.824
  980    H    MET  43           H        MET  43 321.008  11.098  -5.798
  981    HA   MET  43           HA       MET  43 323.409  11.912  -4.699
  982    HB2  MET  43           HB2      MET  43 321.968  13.184  -7.024
  983    HB3  MET  43           HB3      MET  43 323.689  13.301  -6.681
  984    HG2  MET  43           HG2      MET  43 323.024  10.552  -6.756
  985    HG3  MET  43           HG3      MET  43 322.286  11.316  -8.160
  986    HE1  MET  43           HE1      MET  43 324.677   9.054  -7.833
  987    HE2  MET  43           HE2      MET  43 325.752   9.456  -9.180
  988    HE3  MET  43           HE3      MET  43 323.999   9.423  -9.418
  989    H    LYS  44           H        LYS  44 320.345  13.633  -4.656
  990    HA   LYS  44           HA       LYS  44 321.503  16.145  -3.862
  991    HB2  LYS  44           HB2      LYS  44 319.313  16.132  -4.889
  992    HB3  LYS  44           HB3      LYS  44 318.659  15.189  -3.560
  993    HG2  LYS  44           HG2      LYS  44 318.390  17.821  -3.713
  994    HG3  LYS  44           HG3      LYS  44 318.515  16.992  -2.177
  995    HD2  LYS  44           HD2      LYS  44 320.184  18.389  -1.719
  996    HD3  LYS  44           HD3      LYS  44 321.129  17.545  -2.929
  997    HE2  LYS  44           HE2      LYS  44 321.259  19.769  -3.582
  998    HE3  LYS  44           HE3      LYS  44 320.006  19.092  -4.616
  999    HZ1  LYS  44           HZ1      LYS  44 318.952  20.957  -3.912
 1000    HZ2  LYS  44           HZ2      LYS  44 319.772  21.021  -2.434
 1001    HZ3  LYS  44           HZ3      LYS  44 318.496  19.932  -2.646
 1002    H    ALA  45           H        ALA  45 319.915  13.512  -2.121
 1003    HA   ALA  45           HA       ALA  45 319.694  14.395   0.404
 1004    HB1  ALA  45           HB1      ALA  45 320.952  12.025   0.970
 1005    HB2  ALA  45           HB2      ALA  45 320.423  11.779  -0.702
 1006    HB3  ALA  45           HB3      ALA  45 319.245  12.196   0.542
 1007    H    TYR  46           H        TYR  46 322.793  13.186  -0.918
 1008    HA   TYR  46           HA       TYR  46 324.322  13.721   1.301
 1009    HB2  TYR  46           HB2      TYR  46 324.922  12.744  -1.135
 1010    HB3  TYR  46           HB3      TYR  46 325.647  14.346  -1.265
 1011    HD1  TYR  46           HD1      TYR  46 325.639  13.422   2.129
 1012    HD2  TYR  46           HD2      TYR  46 327.668  12.681  -1.523
 1013    HE1  TYR  46           HE1      TYR  46 327.562  12.625   3.383
 1014    HE2  TYR  46           HE2      TYR  46 329.624  11.865  -0.280
 1015    HH   TYR  46           HH       TYR  46 329.639  10.876   2.691
 1016    H    CYS  47           H        CYS  47 323.739  16.001  -1.470
 1017    HA   CYS  47           HA       CYS  47 325.195  18.137  -0.608
 1018    HB2  CYS  47           HB2      CYS  47 323.952  18.152  -2.703
 1019    HB3  CYS  47           HB3      CYS  47 322.443  17.971  -1.840
 1020    HG   CYS  47           HG       CYS  47 322.266  20.392  -1.959
 1021    H    GLU  48           H        GLU  48 321.770  17.523   0.095
 1022    HA   GLU  48           HA       GLU  48 321.402  19.516   1.993
 1023    HB2  GLU  48           HB2      GLU  48 319.925  16.925   2.235
 1024    HB3  GLU  48           HB3      GLU  48 319.330  18.563   2.457
 1025    HG2  GLU  48           HG2      GLU  48 319.386  18.926   0.040
 1026    HG3  GLU  48           HG3      GLU  48 320.052  17.318  -0.184
 1027    H    ARG  49           H        ARG  49 323.064  16.545   2.204
 1028    HA   ARG  49           HA       ARG  49 322.916  16.205   5.050
 1029    HB2  ARG  49           HB2      ARG  49 323.720  14.758   2.699
 1030    HB3  ARG  49           HB3      ARG  49 324.937  14.633   3.938
 1031    HG2  ARG  49           HG2      ARG  49 323.593  13.398   5.308
 1032    HG3  ARG  49           HG3      ARG  49 322.120  14.148   4.685
 1033    HD2  ARG  49           HD2      ARG  49 323.499  12.724   2.605
 1034    HD3  ARG  49           HD3      ARG  49 323.176  11.675   3.960
 1035    HE   ARG  49           HE       ARG  49 321.138  13.118   2.436
 1036   HH11  ARG  49          HH11      ARG  49 321.992  10.647   4.756
 1037   HH12  ARG  49          HH12      ARG  49 320.408   9.953   4.778
 1038   HH21  ARG  49          HH21      ARG  49 319.054  12.209   2.485
 1039   HH22  ARG  49          HH22      ARG  49 318.744  10.835   3.493
 1040    H    GLN  50           H        GLN  50 325.538  16.718   2.711
 1041    HA   GLN  50           HA       GLN  50 327.384  17.484   4.793
 1042    HB2  GLN  50           HB2      GLN  50 327.712  17.132   1.864
 1043    HB3  GLN  50           HB3      GLN  50 329.020  17.531   2.933
 1044    HG2  GLN  50           HG2      GLN  50 328.561  15.401   4.147
 1045    HG3  GLN  50           HG3      GLN  50 327.395  15.013   2.885
 1046   HE21  GLN  50          HE21      GLN  50 328.217  15.028   0.665
 1047   HE22  GLN  50          HE22      GLN  50 329.811  14.427   0.384
 1048    H    GLY  51           H        GLY  51 325.489  18.950   2.321
 1049    HA2  GLY  51           HA2      GLY  51 324.989  21.262   2.226
 1050    HA3  GLY  51           HA3      GLY  51 326.460  21.591   3.142
 1051    H    LEU  52           H        LEU  52 325.606  19.920   0.110
 1052    HA   LEU  52           HA       LEU  52 327.884  21.214  -1.218
 1053    HB2  LEU  52           HB2      LEU  52 326.397  18.719  -2.064
 1054    HB3  LEU  52           HB3      LEU  52 327.955  19.295  -2.635
 1055    HG   LEU  52           HG       LEU  52 327.843  18.805   0.255
 1056   HD11  LEU  52          HD11      LEU  52 327.269  16.677   0.344
 1057   HD12  LEU  52          HD12      LEU  52 328.231  16.277  -1.081
 1058   HD13  LEU  52          HD13      LEU  52 326.586  16.886  -1.271
 1059   HD21  LEU  52          HD21      LEU  52 330.022  18.019  -0.095
 1060   HD22  LEU  52          HD22      LEU  52 329.802  19.419  -1.156
 1061   HD23  LEU  52          HD23      LEU  52 329.733  17.782  -1.822
 1062    H    SER  53           H        SER  53 326.491  20.189  -3.823
 1063    HA   SER  53           HA       SER  53 324.287  22.082  -3.898
 1064    HB2  SER  53           HB2      SER  53 325.681  21.818  -6.424
 1065    HB3  SER  53           HB3      SER  53 325.273  23.251  -5.508
 1066    HG   SER  53           HG       SER  53 327.200  23.299  -4.643
 1067    H    MET  54           H        MET  54 325.215  18.943  -4.132
 1068    HA   MET  54           HA       MET  54 324.144  17.046  -4.812
 1069    HB2  MET  54           HB2      MET  54 321.978  17.952  -4.456
 1070    HB3  MET  54           HB3      MET  54 322.080  18.996  -5.840
 1071    HG2  MET  54           HG2      MET  54 322.447  16.251  -6.593
 1072    HG3  MET  54           HG3      MET  54 320.939  16.473  -5.720
 1073    HE1  MET  54           HE1      MET  54 319.110  18.304  -6.421
 1074    HE2  MET  54           HE2      MET  54 319.226  19.292  -7.877
 1075    HE3  MET  54           HE3      MET  54 320.339  19.563  -6.535
 1076    H    ARG  55           H        ARG  55 323.284  19.200  -7.432
 1077    HA   ARG  55           HA       ARG  55 324.083  17.529  -9.508
 1078    HB2  ARG  55           HB2      ARG  55 324.336  19.971 -10.628
 1079    HB3  ARG  55           HB3      ARG  55 322.777  19.213 -10.334
 1080    HG2  ARG  55           HG2      ARG  55 322.306  20.556  -8.524
 1081    HG3  ARG  55           HG3      ARG  55 324.005  20.889  -8.200
 1082    HD2  ARG  55           HD2      ARG  55 322.231  22.082 -10.304
 1083    HD3  ARG  55           HD3      ARG  55 323.152  22.899  -9.043
 1084    HE   ARG  55           HE       ARG  55 325.106  22.628 -10.317
 1085   HH11  ARG  55          HH11      ARG  55 322.309  21.307 -11.947
 1086   HH12  ARG  55          HH12      ARG  55 323.072  21.290 -13.499
 1087   HH21  ARG  55          HH21      ARG  55 326.103  22.601 -12.360
 1088   HH22  ARG  55          HH22      ARG  55 325.222  22.021 -13.735
 1089    H    GLN  56           H        GLN  56 325.827  20.019  -7.704
 1090    HA   GLN  56           HA       GLN  56 328.082  20.215  -9.294
 1091    HB2  GLN  56           HB2      GLN  56 327.399  20.854  -6.468
 1092    HB3  GLN  56           HB3      GLN  56 329.073  20.996  -7.001
 1093    HG2  GLN  56           HG2      GLN  56 328.058  22.385  -8.952
 1094    HG3  GLN  56           HG3      GLN  56 326.684  22.559  -7.864
 1095   HE21  GLN  56          HE21      GLN  56 326.799  24.579  -7.152
 1096   HE22  GLN  56          HE22      GLN  56 328.185  25.310  -6.424
 1097    H    ILE  57           H        ILE  57 327.425  17.865  -6.677
 1098    HA   ILE  57           HA       ILE  57 330.138  17.149  -6.421
 1099    HB   ILE  57           HB       ILE  57 329.128  15.030  -5.315
 1100   HG12  ILE  57          HG12      ILE  57 326.746  16.600  -6.018
 1101   HG13  ILE  57          HG13      ILE  57 326.892  14.895  -5.666
 1102   HG21  ILE  57          HG21      ILE  57 329.002  16.152  -3.247
 1103   HG22  ILE  57          HG22      ILE  57 328.589  17.684  -4.033
 1104   HG23  ILE  57          HG23      ILE  57 330.208  17.003  -4.221
 1105   HD11  ILE  57          HD11      ILE  57 325.509  15.970  -4.020
 1106   HD12  ILE  57          HD12      ILE  57 326.790  17.146  -3.691
 1107   HD13  ILE  57          HD13      ILE  57 327.023  15.445  -3.280
 1108    H    ARG  58           H        ARG  58 330.654  14.708  -6.510
 1109    HA   ARG  58           HA       ARG  58 329.961  13.716  -9.185
 1110    HB2  ARG  58           HB2      ARG  58 332.606  13.401  -7.806
 1111    HB3  ARG  58           HB3      ARG  58 332.218  13.007  -9.473
 1112    HG2  ARG  58           HG2      ARG  58 332.005  15.788  -8.393
 1113    HG3  ARG  58           HG3      ARG  58 333.500  15.145  -9.071
 1114    HD2  ARG  58           HD2      ARG  58 332.203  16.371 -10.713
 1115    HD3  ARG  58           HD3      ARG  58 332.377  14.683 -11.162
 1116    HE   ARG  58           HE       ARG  58 329.926  15.814  -9.994
 1117   HH11  ARG  58          HH11      ARG  58 331.532  13.756 -12.322
 1118   HH12  ARG  58          HH12      ARG  58 330.053  13.171 -13.000
 1119   HH21  ARG  58          HH21      ARG  58 327.991  15.041 -10.894
 1120   HH22  ARG  58          HH22      ARG  58 328.048  13.898 -12.194
 1121    H    PHE  59           H        PHE  59 329.028  11.702  -9.030
 1122    HA   PHE  59           HA       PHE  59 329.564  10.215  -6.551
 1123    HB2  PHE  59           HB2      PHE  59 327.115  10.323  -8.257
 1124    HB3  PHE  59           HB3      PHE  59 327.431   8.950  -7.247
 1125    HD1  PHE  59           HD2      PHE  59 328.197  12.459  -6.369
 1126    HD2  PHE  59           HD1      PHE  59 325.636   9.115  -5.794
 1127    HE1  PHE  59           HE2      PHE  59 327.154  13.579  -4.444
 1128    HE2  PHE  59           HE1      PHE  59 324.583  10.238  -3.887
 1129    HZ   PHE  59           HZ       PHE  59 325.347  12.483  -3.207
 1130    H    ARG  60           H        ARG  60 329.558   7.996  -6.599
 1131    HA   ARG  60           HA       ARG  60 329.846   6.544  -9.061
 1132    HB2  ARG  60           HB2      ARG  60 332.202   7.554  -8.128
 1133    HB3  ARG  60           HB3      ARG  60 332.131   6.040  -7.249
 1134    HG2  ARG  60           HG2      ARG  60 331.476   5.280  -9.786
 1135    HG3  ARG  60           HG3      ARG  60 332.649   6.554 -10.065
 1136    HD2  ARG  60           HD2      ARG  60 334.254   5.431  -8.644
 1137    HD3  ARG  60           HD3      ARG  60 333.060   4.202  -8.239
 1138    HE   ARG  60           HE       ARG  60 333.589   3.130 -10.176
 1139   HH11  ARG  60          HH11      ARG  60 334.594   6.461 -10.459
 1140   HH12  ARG  60          HH12      ARG  60 335.351   6.232 -12.000
 1141   HH21  ARG  60          HH21      ARG  60 334.586   2.828 -12.202
 1142   HH22  ARG  60          HH22      ARG  60 335.347   4.170 -12.990
 1143    H    PHE  61           H        PHE  61 329.091   4.495  -8.740
 1144    HA   PHE  61           HA       PHE  61 328.478   3.778  -5.976
 1145    HB2  PHE  61           HB2      PHE  61 326.519   3.472  -7.213
 1146    HB3  PHE  61           HB3      PHE  61 327.380   2.945  -8.651
 1147    HD1  PHE  61           HD1      PHE  61 326.881   1.856  -5.113
 1148    HD2  PHE  61           HD2      PHE  61 327.204   0.743  -9.210
 1149    HE1  PHE  61           HE1      PHE  61 326.463  -0.500  -4.517
 1150    HE2  PHE  61           HE2      PHE  61 326.780  -1.607  -8.618
 1151    HZ   PHE  61           HZ       PHE  61 326.409  -2.230  -6.265
 1152    H    ASP  62           H        ASP  62 329.133   1.626  -5.242
 1153    HA   ASP  62           HA       ASP  62 331.753   1.086  -5.474
 1154    HB2  ASP  62           HB2      ASP  62 329.410  -0.572  -4.784
 1155    HB3  ASP  62           HB3      ASP  62 330.901  -1.439  -5.121
 1156    H    GLY  63           H        GLY  63 332.276   1.523  -7.743
 1157    HA2  GLY  63           HA2      GLY  63 333.459   0.228  -9.373
 1158    HA3  GLY  63           HA3      GLY  63 332.156  -0.952  -9.332
 1159    H    GLN  64           H        GLN  64 330.408   1.733  -9.318
 1160    HA   GLN  64           HA       GLN  64 330.581   2.122 -12.229
 1161    HB2  GLN  64           HB2      GLN  64 328.658   0.718 -11.634
 1162    HB3  GLN  64           HB3      GLN  64 328.068   2.007 -10.602
 1163    HG2  GLN  64           HG2      GLN  64 327.569   3.391 -12.404
 1164    HG3  GLN  64           HG3      GLN  64 328.560   2.459 -13.508
 1165   HE21  GLN  64          HE21      GLN  64 326.644   2.497 -14.857
 1166   HE22  GLN  64          HE22      GLN  64 325.406   1.321 -14.597
 1167    HA   PRO  65           HA       PRO  65 330.883   6.471 -11.260
 1168    HB2  PRO  65           HB2      PRO  65 330.084   6.855 -14.067
 1169    HB3  PRO  65           HB3      PRO  65 331.594   7.287 -13.274
 1170    HG2  PRO  65           HG2      PRO  65 331.528   5.313 -15.030
 1171    HG3  PRO  65           HG3      PRO  65 332.458   5.122 -13.526
 1172    HD2  PRO  65           HD2      PRO  65 329.659   4.184 -14.118
 1173    HD3  PRO  65           HD3      PRO  65 331.034   3.253 -13.513
 1174    H    ILE  66           H        ILE  66 328.154   5.067 -12.737
 1175    HA   ILE  66           HA       ILE  66 325.995   5.559 -13.031
 1176    HB   ILE  66           HB       ILE  66 324.853   6.123 -11.004
 1177   HG12  ILE  66          HG12      ILE  66 327.533   6.802  -9.813
 1178   HG13  ILE  66          HG13      ILE  66 326.437   7.989 -10.423
 1179   HG21  ILE  66          HG21      ILE  66 327.303   4.575 -10.202
 1180   HG22  ILE  66          HG22      ILE  66 326.115   3.923 -11.327
 1181   HG23  ILE  66          HG23      ILE  66 325.635   4.341  -9.680
 1182   HD11  ILE  66          HD11      ILE  66 324.748   7.206  -8.804
 1183   HD12  ILE  66          HD12      ILE  66 326.218   7.794  -8.028
 1184   HD13  ILE  66          HD13      ILE  66 325.936   6.061  -8.180
 1185    H    ASN  67           H        ASN  67 324.265   7.352 -12.903
 1186    HA   ASN  67           HA       ASN  67 325.330  10.035 -13.257
 1187    HB2  ASN  67           HB2      ASN  67 323.872   8.638 -15.481
 1188    HB3  ASN  67           HB3      ASN  67 324.410  10.305 -15.509
 1189   HD21  ASN  67          HD21      ASN  67 326.865  10.343 -14.777
 1190   HD22  ASN  67          HD22      ASN  67 327.856   9.303 -15.724
 1191    H    GLU  68           H        GLU  68 323.828   9.417 -11.303
 1192    HA   GLU  68           HA       GLU  68 321.839   9.639 -10.190
 1193    HB2  GLU  68           HB2      GLU  68 320.939  11.989 -11.581
 1194    HB3  GLU  68           HB3      GLU  68 321.573  11.817  -9.951
 1195    HG2  GLU  68           HG2      GLU  68 323.769  12.158 -10.643
 1196    HG3  GLU  68           HG3      GLU  68 323.359  11.880 -12.329
 1197    H    THR  69           H        THR  69 321.566   8.425 -13.167
 1198    HA   THR  69           HA       THR  69 318.636   8.556 -13.112
 1199    HB   THR  69           HB       THR  69 318.619   8.552 -15.565
 1200    HG1  THR  69           HG1      THR  69 320.585   8.893 -16.667
 1201   HG21  THR  69          HG21      THR  69 318.702  10.715 -14.276
 1202   HG22  THR  69          HG22      THR  69 319.205  10.790 -15.965
 1203   HG23  THR  69          HG23      THR  69 320.417  10.785 -14.682
 1204    H    ASP  70           H        ASP  70 321.402   6.674 -13.056
 1205    HA   ASP  70           HA       ASP  70 320.706   4.324 -14.412
 1206    HB2  ASP  70           HB2      ASP  70 322.542   5.098 -12.233
 1207    HB3  ASP  70           HB3      ASP  70 322.123   3.392 -12.323
 1208    H    THR  71           H        THR  71 320.645   4.823 -11.004
 1209    HA   THR  71           HA       THR  71 318.938   4.638  -9.474
 1210    HB   THR  71           HB       THR  71 316.950   3.479  -9.820
 1211    HG1  THR  71           HG1      THR  71 317.758   2.254 -12.207
 1212   HG21  THR  71          HG21      THR  71 316.106   4.890 -11.291
 1213   HG22  THR  71          HG22      THR  71 316.778   3.924 -12.606
 1214   HG23  THR  71          HG23      THR  71 317.724   5.238 -11.905
 1215    HA   PRO  72           HA       PRO  72 321.405   1.566  -7.607
 1216    HB2  PRO  72           HB2      PRO  72 319.051   0.841  -5.965
 1217    HB3  PRO  72           HB3      PRO  72 320.667   1.372  -5.478
 1218    HG2  PRO  72           HG2      PRO  72 318.411   2.960  -5.411
 1219    HG3  PRO  72           HG3      PRO  72 320.080   3.551  -5.436
 1220    HD2  PRO  72           HD2      PRO  72 318.040   3.670  -7.502
 1221    HD3  PRO  72           HD3      PRO  72 319.593   4.517  -7.402
 1222    H    ALA  73           H        ALA  73 318.146   0.990  -8.670
 1223    HA   ALA  73           HA       ALA  73 318.208  -1.812  -8.871
 1224    HB1  ALA  73           HB1      ALA  73 316.111  -1.550  -9.571
 1225    HB2  ALA  73           HB2      ALA  73 316.629  -0.575 -10.955
 1226    HB3  ALA  73           HB3      ALA  73 316.359   0.186  -9.390
 1227    H    GLN  74           H        GLN  74 318.612   0.652 -11.556
 1228    HA   GLN  74           HA       GLN  74 319.210  -1.162 -13.493
 1229    HB2  GLN  74           HB2      GLN  74 319.420   1.612 -13.051
 1230    HB3  GLN  74           HB3      GLN  74 320.780   1.093 -13.983
 1231    HG2  GLN  74           HG2      GLN  74 317.877   0.774 -14.643
 1232    HG3  GLN  74           HG3      GLN  74 319.071   1.765 -15.482
 1233   HE21  GLN  74          HE21      GLN  74 317.316  -0.867 -15.869
 1234   HE22  GLN  74          HE22      GLN  74 318.379  -1.847 -16.814
 1235    H    LEU  75           H        LEU  75 321.215  -0.024 -10.938
 1236    HA   LEU  75           HA       LEU  75 323.601  -1.195 -12.108
 1237    HB2  LEU  75           HB2      LEU  75 323.396   0.309  -9.519
 1238    HB3  LEU  75           HB3      LEU  75 324.785   0.155 -10.583
 1239    HG   LEU  75           HG       LEU  75 322.281   1.796 -11.095
 1240   HD11  LEU  75          HD11      LEU  75 324.125   3.564 -11.345
 1241   HD12  LEU  75          HD12      LEU  75 325.134   2.419 -10.460
 1242   HD13  LEU  75          HD13      LEU  75 323.659   3.047  -9.725
 1243   HD21  LEU  75          HD21      LEU  75 323.957   0.507 -12.987
 1244   HD22  LEU  75          HD22      LEU  75 324.276   2.238 -13.053
 1245   HD23  LEU  75          HD23      LEU  75 322.626   1.637 -13.261
 1246    H    GLU  76           H        GLU  76 321.110  -2.003 -10.031
 1247    HA   GLU  76           HA       GLU  76 320.641  -3.828  -8.863
 1248    HB2  GLU  76           HB2      GLU  76 323.342  -4.797  -9.784
 1249    HB3  GLU  76           HB3      GLU  76 322.143  -5.791  -8.967
 1250    HG2  GLU  76           HG2      GLU  76 320.624  -4.854 -10.945
 1251    HG3  GLU  76           HG3      GLU  76 322.198  -4.774 -11.740
 1252    H    MET  77           H        MET  77 322.000  -1.556  -7.665
 1253    HA   MET  77           HA       MET  77 323.884  -2.150  -5.736
 1254    HB2  MET  77           HB2      MET  77 321.542  -0.259  -5.695
 1255    HB3  MET  77           HB3      MET  77 322.759  -0.268  -4.417
 1256    HG2  MET  77           HG2      MET  77 324.353  -0.172  -6.564
 1257    HG3  MET  77           HG3      MET  77 322.936   0.634  -7.222
 1258    HE1  MET  77           HE1      MET  77 324.172   2.565  -7.772
 1259    HE2  MET  77           HE2      MET  77 324.347   3.930  -6.671
 1260    HE3  MET  77           HE3      MET  77 322.740   3.269  -7.009
 1261    H    GLU  78           H        GLU  78 322.842  -1.771  -3.132
 1262    HA   GLU  78           HA       GLU  78 320.700  -3.573  -2.674
 1263    HB2  GLU  78           HB2      GLU  78 323.489  -4.544  -2.604
 1264    HB3  GLU  78           HB3      GLU  78 322.510  -4.965  -1.206
 1265    HG2  GLU  78           HG2      GLU  78 320.938  -5.483  -3.483
 1266    HG3  GLU  78           HG3      GLU  78 322.543  -6.133  -3.806
 1267    H    ASP  79           H        ASP  79 321.022  -4.253  -0.159
 1268    HA   ASP  79           HA       ASP  79 320.720  -1.803   1.236
 1269    HB2  ASP  79           HB2      ASP  79 319.961  -4.442   1.647
 1270    HB3  ASP  79           HB3      ASP  79 321.050  -4.080   2.982
 1271    H    GLU  80           H        GLU  80 322.301  -0.535   1.777
 1272    HA   GLU  80           HA       GLU  80 324.004   0.195   3.146
 1273    HB2  GLU  80           HB2      GLU  80 325.077  -2.609   3.245
 1274    HB3  GLU  80           HB3      GLU  80 325.561  -1.241   4.232
 1275    HG2  GLU  80           HG2      GLU  80 323.115  -1.168   5.001
 1276    HG3  GLU  80           HG3      GLU  80 323.008  -2.788   4.324
 1277    H    ASP  81           H        ASP  81 324.076  -0.881   0.060
 1278    HA   ASP  81           HA       ASP  81 326.825  -0.934  -0.510
 1279    HB2  ASP  81           HB2      ASP  81 324.588   0.011  -2.322
 1280    HB3  ASP  81           HB3      ASP  81 326.199  -0.438  -2.824
 1281    H    THR  82           H        THR  82 328.111   0.736  -1.395
 1282    HA   THR  82           HA       THR  82 327.320   3.397  -0.413
 1283    HB   THR  82           HB       THR  82 330.153   2.565  -0.977
 1284    HG1  THR  82           HG1      THR  82 329.232   2.530   1.638
 1285   HG21  THR  82          HG21      THR  82 329.098   4.550   1.012
 1286   HG22  THR  82          HG22      THR  82 329.567   4.986  -0.639
 1287   HG23  THR  82          HG23      THR  82 330.765   4.322   0.476
 1288    H    ILE  83           H        ILE  83 328.009   5.280  -1.628
 1289    HA   ILE  83           HA       ILE  83 328.692   4.837  -4.445
 1290    HB   ILE  83           HB       ILE  83 326.467   6.570  -3.366
 1291   HG12  ILE  83          HG12      ILE  83 326.358   4.464  -5.524
 1292   HG13  ILE  83          HG13      ILE  83 326.044   4.118  -3.825
 1293   HG21  ILE  83          HG21      ILE  83 326.144   7.311  -5.749
 1294   HG22  ILE  83          HG22      ILE  83 327.664   6.524  -6.157
 1295   HG23  ILE  83          HG23      ILE  83 327.652   7.885  -5.036
 1296   HD11  ILE  83          HD11      ILE  83 324.490   5.857  -5.688
 1297   HD12  ILE  83          HD12      ILE  83 324.297   5.934  -3.936
 1298   HD13  ILE  83          HD13      ILE  83 323.955   4.435  -4.797
 1299    H    ASP  84           H        ASP  84 330.799   5.728  -4.177
 1300    HA   ASP  84           HA       ASP  84 331.374   7.806  -2.439
 1301    HB2  ASP  84           HB2      ASP  84 332.781   6.153  -4.280
 1302    HB3  ASP  84           HB3      ASP  84 333.359   7.810  -4.411
 1303    H    VAL  85           H        VAL  85 331.598   9.858  -2.492
 1304    HA   VAL  85           HA       VAL  85 330.863  11.444  -4.873
 1305    HB   VAL  85           HB       VAL  85 330.593  12.095  -1.938
 1306   HG11  VAL  85          HG11      VAL  85 329.284  14.108  -2.885
 1307   HG12  VAL  85          HG12      VAL  85 330.208  13.804  -4.360
 1308   HG13  VAL  85          HG13      VAL  85 331.048  14.175  -2.856
 1309   HG21  VAL  85          HG21      VAL  85 328.156  12.330  -3.255
 1310   HG22  VAL  85          HG22      VAL  85 328.639  11.123  -2.071
 1311   HG23  VAL  85          HG23      VAL  85 328.857  10.804  -3.792
 1312    H    PHE  86           H        PHE  86 332.368  12.924  -5.606
 1313    HA   PHE  86           HA       PHE  86 334.483  13.787  -3.797
 1314    HB2  PHE  86           HB2      PHE  86 335.148  12.729  -6.553
 1315    HB3  PHE  86           HB3      PHE  86 336.270  13.262  -5.304
 1316    HD1  PHE  86           HD2      PHE  86 335.695  11.910  -2.948
 1317    HD2  PHE  86           HD1      PHE  86 335.211  10.483  -6.927
 1318    HE1  PHE  86           HE2      PHE  86 335.879   9.595  -2.137
 1319    HE2  PHE  86           HE1      PHE  86 335.397   8.165  -6.123
 1320    HZ   PHE  86           HZ       PHE  86 335.733   7.719  -3.725
 1321    H    GLN  87           H        GLN  87 334.052  15.881  -3.859
 1322    HA   GLN  87           HA       GLN  87 334.164  17.223  -6.440
 1323    HB2  GLN  87           HB2      GLN  87 331.764  16.620  -5.733
 1324    HB3  GLN  87           HB3      GLN  87 331.920  17.924  -4.573
 1325    HG2  GLN  87           HG2      GLN  87 332.793  18.844  -7.132
 1326    HG3  GLN  87           HG3      GLN  87 331.232  18.062  -7.297
 1327   HE21  GLN  87          HE21      GLN  87 329.695  18.692  -5.316
 1328   HE22  GLN  87          HE22      GLN  87 329.601  20.396  -5.045
 1329    H    GLN  88           H        GLN  88 335.757  18.657  -6.191
 1330    HA   GLN  88           HA       GLN  88 336.300  19.858  -3.612
 1331    HB2  GLN  88           HB2      GLN  88 337.604  20.318  -6.294
 1332    HB3  GLN  88           HB3      GLN  88 338.187  20.945  -4.761
 1333    HG2  GLN  88           HG2      GLN  88 337.799  18.045  -4.817
 1334    HG3  GLN  88           HG3      GLN  88 339.027  18.645  -5.931
 1335   HE21  GLN  88          HE21      GLN  88 340.501  20.346  -4.877
 1336   HE22  GLN  88          HE22      GLN  88 341.106  19.938  -3.311
 1337    H    GLN  89           H        GLN  89 336.771  22.359  -3.690
 1338    HA   GLN  89           HA       GLN  89 334.354  23.565  -4.794
 1339    HB2  GLN  89           HB2      GLN  89 336.067  24.130  -2.463
 1340    HB3  GLN  89           HB3      GLN  89 335.455  25.552  -3.298
 1341    HG2  GLN  89           HG2      GLN  89 333.287  25.125  -2.738
 1342    HG3  GLN  89           HG3      GLN  89 333.539  23.384  -2.638
 1343   HE21  GLN  89          HE21      GLN  89 333.623  22.534  -0.687
 1344   HE22  GLN  89          HE22      GLN  89 333.938  23.388   0.781
 1345    H    THR  90           H        THR  90 336.612  22.898  -6.384
 1346    HA   THR  90           HA       THR  90 337.007  25.491  -7.672
 1347    HB   THR  90           HB       THR  90 338.999  25.317  -6.361
 1348    HG1  THR  90           HG1      THR  90 339.805  26.008  -8.181
 1349   HG21  THR  90          HG21      THR  90 339.748  23.359  -5.669
 1350   HG22  THR  90          HG22      THR  90 340.376  23.085  -7.294
 1351   HG23  THR  90          HG23      THR  90 338.770  22.501  -6.859
 1352    H1   THR   2           HT1      THR   2 287.183  -9.831  17.927
 1353    H2   THR   2           HT2      THR   2 288.777 -10.054  18.523
 1354    H3   THR   2           HT3      THR   2 288.015 -11.297  17.617
 1355    HA   THR   2           HA       THR   2 288.547  -8.620  16.541
 1356    HB   THR   2           HB       THR   2 290.700  -9.392  17.079
 1357    HG1  THR   2           HG1      THR   2 290.272 -10.501  14.510
 1358   HG21  THR   2          HG21      THR   2 290.634 -11.532  17.854
 1359   HG22  THR   2          HG22      THR   2 291.343 -11.800  16.261
 1360   HG23  THR   2          HG23      THR   2 289.626 -12.103  16.524
 1361    H    VAL   3           H        VAL   3 286.240  -9.302  15.858
 1362    HA   VAL   3           HA       VAL   3 286.438 -10.305  13.159
 1363    HB   VAL   3           HB       VAL   3 286.137 -12.394  14.420
 1364   HG11  VAL   3          HG11      VAL   3 283.366 -11.790  15.192
 1365   HG12  VAL   3          HG12      VAL   3 284.607 -10.960  16.130
 1366   HG13  VAL   3          HG13      VAL   3 284.605 -12.721  16.033
 1367   HG21  VAL   3          HG21      VAL   3 283.481 -12.094  13.174
 1368   HG22  VAL   3          HG22      VAL   3 284.755 -13.274  12.866
 1369   HG23  VAL   3          HG23      VAL   3 284.861 -11.659  12.165
 1370    H    GLY   4           H        GLY   4 284.699  -9.693  11.853
 1371    HA2  GLY   4           HA2      GLY   4 282.220  -8.929  12.197
 1372    HA3  GLY   4           HA3      GLY   4 283.015  -7.607  13.038
 1373    H    ASP   5           H        ASP   5 281.958  -8.793  10.050
 1374    HA   ASP   5           HA       ASP   5 281.946  -7.922   7.949
 1375    HB2  ASP   5           HB2      ASP   5 281.551  -5.794   9.409
 1376    HB3  ASP   5           HB3      ASP   5 283.206  -5.393   8.961
 1377    H    GLU   6           H        GLU   6 283.276  -7.933   6.183
 1378    HA   GLU   6           HA       GLU   6 286.068  -8.530   6.699
 1379    HB2  GLU   6           HB2      GLU   6 284.236  -9.490   4.886
 1380    HB3  GLU   6           HB3      GLU   6 285.208  -8.408   3.897
 1381    HG2  GLU   6           HG2      GLU   6 286.708 -10.015   3.701
 1382    HG3  GLU   6           HG3      GLU   6 287.031  -9.876   5.428
 1383    H    ILE   7           H        ILE   7 284.144  -6.095   5.027
 1384    HA   ILE   7           HA       ILE   7 284.691  -4.134   4.002
 1385    HB   ILE   7           HB       ILE   7 284.822  -3.453   6.313
 1386   HG12  ILE   7          HG12      ILE   7 286.525  -1.587   6.100
 1387   HG13  ILE   7          HG13      ILE   7 286.994  -2.300   4.561
 1388   HG21  ILE   7          HG21      ILE   7 287.044  -3.366   7.475
 1389   HG22  ILE   7          HG22      ILE   7 287.667  -4.413   6.203
 1390   HG23  ILE   7          HG23      ILE   7 286.373  -4.981   7.253
 1391   HD11  ILE   7          HD11      ILE   7 284.402  -2.114   4.099
 1392   HD12  ILE   7          HD12      ILE   7 285.500  -0.760   3.831
 1393   HD13  ILE   7          HD13      ILE   7 284.534  -0.833   5.305
 1394    H    VAL   8           H        VAL   8 285.660  -5.339   2.187
 1395    HA   VAL   8           HA       VAL   8 288.235  -4.273   1.558
 1396    HB   VAL   8           HB       VAL   8 288.936  -6.803   0.897
 1397   HG11  VAL   8          HG11      VAL   8 289.648  -4.891   2.986
 1398   HG12  VAL   8          HG12      VAL   8 290.672  -5.791   1.869
 1399   HG13  VAL   8          HG13      VAL   8 290.105  -6.552   3.352
 1400   HG21  VAL   8          HG21      VAL   8 287.189  -7.955   2.004
 1401   HG22  VAL   8          HG22      VAL   8 287.384  -6.994   3.470
 1402   HG23  VAL   8          HG23      VAL   8 288.627  -8.155   3.005
 1403    H    ASP   9           H        ASP   9 288.868  -4.654  -0.645
 1404    HA   ASP   9           HA       ASP   9 287.460  -6.145  -2.525
 1405    HB2  ASP   9           HB2      ASP   9 285.777  -4.223  -1.665
 1406    HB3  ASP   9           HB3      ASP   9 286.603  -3.327  -2.935
 1407    H    LEU  10           H        LEU  10 287.507  -3.909  -4.568
 1408    HA   LEU  10           HA       LEU  10 288.970  -2.775  -5.915
 1409    HB2  LEU  10           HB2      LEU  10 290.031  -2.106  -3.689
 1410    HB3  LEU  10           HB3      LEU  10 291.180  -3.395  -3.973
 1411    HG   LEU  10           HG       LEU  10 291.667  -2.226  -6.207
 1412   HD11  LEU  10          HD11      LEU  10 290.108  -0.109  -4.757
 1413   HD12  LEU  10          HD12      LEU  10 289.883  -0.709  -6.400
 1414   HD13  LEU  10          HD13      LEU  10 291.291   0.276  -6.006
 1415   HD21  LEU  10          HD21      LEU  10 293.524  -1.603  -5.161
 1416   HD22  LEU  10          HD22      LEU  10 292.730  -1.965  -3.628
 1417   HD23  LEU  10          HD23      LEU  10 292.668  -0.331  -4.291
 1418    H    THR  11           H        THR  11 290.372  -3.333  -7.621
 1419    HA   THR  11           HA       THR  11 291.103  -6.191  -7.711
 1420    HB   THR  11           HB       THR  11 290.852  -4.502 -10.172
 1421    HG1  THR  11           HG1      THR  11 288.645  -5.173 -10.258
 1422   HG21  THR  11          HG21      THR  11 291.327  -6.452 -11.105
 1423   HG22  THR  11          HG22      THR  11 289.731  -6.997 -10.588
 1424   HG23  THR  11          HG23      THR  11 291.143  -7.311  -9.576
 1425    H    CYS  12           H        CYS  12 292.252  -2.929  -8.294
 1426    HA   CYS  12           HA       CYS  12 294.947  -3.679  -7.910
 1427    HB2  CYS  12           HB2      CYS  12 295.684  -2.956 -10.282
 1428    HB3  CYS  12           HB3      CYS  12 295.043  -4.578 -10.063
 1429    HG   CYS  12           HG       CYS  12 293.665  -2.306 -11.620
 1430    H    GLU  13           H        GLU  13 294.940  -1.261 -10.274
 1431    HA   GLU  13           HA       GLU  13 295.186   0.991 -10.204
 1432    HB2  GLU  13           HB2      GLU  13 293.113   0.482  -8.131
 1433    HB3  GLU  13           HB3      GLU  13 293.859   2.073  -8.157
 1434    HG2  GLU  13           HG2      GLU  13 292.144   2.488  -9.562
 1435    HG3  GLU  13           HG3      GLU  13 293.293   1.863 -10.744
 1436    H    SER  14           H        SER  14 296.788   2.288  -9.518
 1437    HA   SER  14           HA       SER  14 298.159   1.523  -7.034
 1438    HB2  SER  14           HB2      SER  14 299.449   1.414  -9.182
 1439    HB3  SER  14           HB3      SER  14 299.255   3.160  -9.331
 1440    HG   SER  14           HG       SER  14 301.144   1.913  -8.052
 1441    H    LEU  15           H        LEU  15 297.852   4.525  -8.935
 1442    HA   LEU  15           HA       LEU  15 297.559   6.693  -8.310
 1443    HB2  LEU  15           HB2      LEU  15 295.379   5.539  -7.570
 1444    HB3  LEU  15           HB3      LEU  15 296.020   5.670  -5.943
 1445    HG   LEU  15           HG       LEU  15 296.292   8.239  -6.943
 1446   HD11  LEU  15          HD11      LEU  15 294.457   8.855  -8.160
 1447   HD12  LEU  15          HD12      LEU  15 293.483   7.500  -7.589
 1448   HD13  LEU  15          HD13      LEU  15 294.734   7.237  -8.805
 1449   HD21  LEU  15          HD21      LEU  15 294.049   8.481  -5.542
 1450   HD22  LEU  15          HD22      LEU  15 295.605   8.156  -4.778
 1451   HD23  LEU  15          HD23      LEU  15 294.473   6.835  -5.069
 1452    H    GLU  16           H        GLU  16 299.836   5.184  -7.189
 1453    HA   GLU  16           HA       GLU  16 300.380   6.959  -4.909
 1454    HB2  GLU  16           HB2      GLU  16 300.031   4.268  -4.629
 1455    HB3  GLU  16           HB3      GLU  16 301.770   4.362  -4.870
 1456    HG2  GLU  16           HG2      GLU  16 301.578   4.501  -2.583
 1457    HG3  GLU  16           HG3      GLU  16 301.681   6.197  -3.052
 1458    HA   PRO  17           HA       PRO  17 303.622   7.368  -8.238
 1459    HB2  PRO  17           HB2      PRO  17 303.647  10.083  -8.248
 1460    HB3  PRO  17           HB3      PRO  17 302.530   9.130  -9.232
 1461    HG2  PRO  17           HG2      PRO  17 302.056  10.484  -6.604
 1462    HG3  PRO  17           HG3      PRO  17 301.015  10.432  -8.039
 1463    HD2  PRO  17           HD2      PRO  17 300.605   8.843  -5.887
 1464    HD3  PRO  17           HD3      PRO  17 300.222   8.324  -7.540
 1465    H    VAL  18           H        VAL  18 305.672   8.755  -8.083
 1466    HA   VAL  18           HA       VAL  18 307.574   9.316  -6.965
 1467    HB   VAL  18           HB       VAL  18 305.796   9.911  -4.599
 1468   HG11  VAL  18          HG11      VAL  18 307.565  10.916  -3.630
 1469   HG12  VAL  18          HG12      VAL  18 308.198  11.518  -5.162
 1470   HG13  VAL  18          HG13      VAL  18 308.495   9.847  -4.680
 1471   HG21  VAL  18          HG21      VAL  18 306.078  12.313  -5.590
 1472   HG22  VAL  18          HG22      VAL  18 304.821  11.241  -6.208
 1473   HG23  VAL  18          HG23      VAL  18 306.326  11.444  -7.105
 1474    H    VAL  19           H        VAL  19 309.045   7.941  -6.235
 1475    HA   VAL  19           HA       VAL  19 308.271   6.005  -4.156
 1476    HB   VAL  19           HB       VAL  19 310.224   4.660  -5.530
 1477   HG11  VAL  19          HG11      VAL  19 308.025   3.589  -6.646
 1478   HG12  VAL  19          HG12      VAL  19 307.285   4.524  -5.347
 1479   HG13  VAL  19          HG13      VAL  19 308.507   3.308  -4.973
 1480   HG21  VAL  19          HG21      VAL  19 309.789   4.750  -7.881
 1481   HG22  VAL  19          HG22      VAL  19 310.098   6.398  -7.333
 1482   HG23  VAL  19          HG23      VAL  19 308.445   5.869  -7.644
 1483    H    VAL  20           H        VAL  20 310.288   4.942  -3.190
 1484    HA   VAL  20           HA       VAL  20 312.263   5.073  -2.074
 1485    HB   VAL  20           HB       VAL  20 312.829   7.153  -4.174
 1486   HG11  VAL  20          HG11      VAL  20 314.613   6.266  -1.916
 1487   HG12  VAL  20          HG12      VAL  20 314.095   7.906  -2.300
 1488   HG13  VAL  20          HG13      VAL  20 315.203   7.057  -3.377
 1489   HG21  VAL  20          HG21      VAL  20 314.538   5.384  -4.790
 1490   HG22  VAL  20          HG22      VAL  20 312.846   4.979  -5.065
 1491   HG23  VAL  20          HG23      VAL  20 313.689   4.333  -3.671
 1492    H    ASP  21           H        ASP  21 313.317   6.229  -0.434
 1493    HA   ASP  21           HA       ASP  21 312.144   8.802   0.341
 1494    HB2  ASP  21           HB2      ASP  21 312.461   6.392   2.150
 1495    HB3  ASP  21           HB3      ASP  21 312.027   8.007   2.700
 1496    H    LEU  22           H        LEU  22 313.515   9.232   2.679
 1497    HA   LEU  22           HA       LEU  22 316.340   8.776   2.041
 1498    HB2  LEU  22           HB2      LEU  22 314.946  11.399   2.275
 1499    HB3  LEU  22           HB3      LEU  22 316.587  11.272   2.882
 1500    HG   LEU  22           HG       LEU  22 315.677  10.755   0.051
 1501   HD11  LEU  22          HD11      LEU  22 316.995  12.698  -0.503
 1502   HD12  LEU  22          HD12      LEU  22 317.490  12.881   1.180
 1503   HD13  LEU  22          HD13      LEU  22 315.803  13.124   0.725
 1504   HD21  LEU  22          HD21      LEU  22 318.192  10.603  -0.334
 1505   HD22  LEU  22          HD22      LEU  22 317.409   9.212   0.415
 1506   HD23  LEU  22          HD23      LEU  22 318.327  10.346   1.405
 1507    H    THR  23           H        THR  23 317.730   8.731   3.796
 1508    HA   THR  23           HA       THR  23 316.388   8.616   6.409
 1509    HB   THR  23           HB       THR  23 318.652   7.349   6.946
 1510    HG1  THR  23           HG1      THR  23 319.632   6.499   5.247
 1511   HG21  THR  23          HG21      THR  23 317.359   5.327   5.602
 1512   HG22  THR  23          HG22      THR  23 316.070   6.466   5.985
 1513   HG23  THR  23          HG23      THR  23 317.085   5.818   7.273
 1514    H    HIS  24           H        HIS  24 318.030   9.004   8.272
 1515    HA   HIS  24           HA       HIS  24 319.570  11.439   7.651
 1516    HB2  HIS  24           HB2      HIS  24 318.963  12.270   9.895
 1517    HB3  HIS  24           HB3      HIS  24 317.546  12.010   8.882
 1518    HD1  HIS  24           HD1      HIS  24 316.418   9.493   9.328
 1519    HD2  HIS  24           HD2      HIS  24 318.681  11.207  12.361
 1520    HE1  HIS  24           HE1      HIS  24 315.738   8.296  11.431
 1521    HE2  HIS  24           HE2      HIS  24 317.060   9.406  13.266
 1522    H    ASN  25           H        ASN  25 321.599  11.599   8.455
 1523    HA   ASN  25           HA       ASN  25 322.558  10.073  10.654
 1524    HB2  ASN  25           HB2      ASN  25 324.230   8.734   9.348
 1525    HB3  ASN  25           HB3      ASN  25 322.560   8.222   9.121
 1526   HD21  ASN  25          HD21      ASN  25 321.558   8.563   7.152
 1527   HD22  ASN  25          HD22      ASN  25 322.439   8.975   5.725
 1528    H    ASP  26           H        ASP  26 325.015  10.282  10.826
 1529    HA   ASP  26           HA       ASP  26 325.677  13.041  10.451
 1530    HB2  ASP  26           HB2      ASP  26 326.378  11.329  12.344
 1531    HB3  ASP  26           HB3      ASP  26 327.733  11.030  11.260
  Start of MODEL    5
    1    H1   GLY   1           HT1      GLY   1 286.785 -21.415  -6.456
    2    H2   GLY   1           HT2      GLY   1 285.133 -21.058  -6.511
    3    H3   GLY   1           HT3      GLY   1 285.950 -21.051  -5.030
    4    HA2  GLY   1           HA3      GLY   1 285.437 -18.852  -6.446
    5    HA3  GLY   1           HA2      GLY   1 286.764 -19.000  -5.304
    6    H    THR   2           H        THR   2 288.853 -19.076  -6.040
    7    HA   THR   2           HA       THR   2 290.589 -18.597  -7.430
    8    HB   THR   2           HB       THR   2 290.782 -19.907  -9.408
    9    HG1  THR   2           HG1      THR   2 288.854 -19.387 -10.429
   10   HG21  THR   2          HG21      THR   2 290.346 -22.076  -8.707
   11   HG22  THR   2          HG22      THR   2 288.910 -21.597  -7.802
   12   HG23  THR   2          HG23      THR   2 290.513 -21.171  -7.202
   13    H    GLU   3           H        GLU   3 290.999 -17.866  -9.928
   14    HA   GLU   3           HA       GLU   3 290.824 -16.165 -11.426
   15    HB2  GLU   3           HB2      GLU   3 288.366 -17.277 -11.376
   16    HB3  GLU   3           HB3      GLU   3 287.972 -15.633 -10.891
   17    HG2  GLU   3           HG2      GLU   3 289.387 -14.955 -12.949
   18    HG3  GLU   3           HG3      GLU   3 289.135 -16.623 -13.458
   19    H    ASN   4           H        ASN   4 289.020 -13.882 -11.304
   20    HA   ASN   4           HA       ASN   4 290.412 -12.430  -9.204
   21    HB2  ASN   4           HB2      ASN   4 289.966 -10.469 -10.380
   22    HB3  ASN   4           HB3      ASN   4 290.162 -11.654 -11.667
   23   HD21  ASN   4          HD21      ASN   4 288.132  -9.353 -10.243
   24   HD22  ASN   4          HD22      ASN   4 286.734  -9.621 -11.225
   25    H    ASP   5           H        ASP   5 288.350 -14.277  -8.414
   26    HA   ASP   5           HA       ASP   5 286.152 -12.544  -7.551
   27    HB2  ASP   5           HB2      ASP   5 286.118 -15.139  -8.400
   28    HB3  ASP   5           HB3      ASP   5 286.215 -15.366  -6.656
   29    H    HIS   6           H        HIS   6 285.527 -13.693  -5.088
   30    HA   HIS   6           HA       HIS   6 287.680 -12.564  -3.530
   31    HB2  HIS   6           HB2      HIS   6 284.955 -13.527  -2.680
   32    HB3  HIS   6           HB3      HIS   6 286.178 -12.938  -1.645
   33    HD1  HIS   6           HD1      HIS   6 284.272 -11.608  -4.624
   34    HD2  HIS   6           HD2      HIS   6 285.975 -10.395  -1.032
   35    HE1  HIS   6           HE1      HIS   6 283.641  -9.185  -4.380
   36    HE2  HIS   6           HE2      HIS   6 284.821  -8.428  -2.288
   37    H    ILE   7           H        ILE   7 288.402 -13.477  -1.632
   38    HA   ILE   7           HA       ILE   7 288.079 -16.245  -1.034
   39    HB   ILE   7           HB       ILE   7 290.169 -17.110  -1.484
   40   HG12  ILE   7          HG12      ILE   7 291.293 -14.313  -1.640
   41   HG13  ILE   7          HG13      ILE   7 291.454 -15.407  -0.271
   42   HG21  ILE   7          HG21      ILE   7 289.019 -16.396  -3.599
   43   HG22  ILE   7          HG22      ILE   7 290.744 -16.723  -3.717
   44   HG23  ILE   7          HG23      ILE   7 290.167 -15.056  -3.665
   45   HD11  ILE   7          HD11      ILE   7 292.956 -15.286  -2.756
   46   HD12  ILE   7          HD12      ILE   7 292.412 -16.908  -2.331
   47   HD13  ILE   7          HD13      ILE   7 293.390 -15.978  -1.191
   48    H    ASN   8           H        ASN   8 288.554 -16.594   1.084
   49    HA   ASN   8           HA       ASN   8 288.827 -14.176   2.624
   50    HB2  ASN   8           HB2      ASN   8 287.638 -16.708   3.005
   51    HB3  ASN   8           HB3      ASN   8 288.870 -16.566   4.255
   52   HD21  ASN   8          HD21      ASN   8 288.847 -13.967   4.884
   53   HD22  ASN   8          HD22      ASN   8 287.311 -13.495   5.516
   54    H    LEU   9           H        LEU   9 290.629 -13.580   3.930
   55    HA   LEU   9           HA       LEU   9 292.955 -15.359   3.857
   56    HB2  LEU   9           HB2      LEU   9 292.718 -12.449   3.409
   57    HB3  LEU   9           HB3      LEU   9 294.074 -12.955   4.306
   58    HG   LEU   9           HG       LEU   9 295.162 -13.468   2.425
   59   HD11  LEU   9          HD11      LEU   9 292.791 -15.172   1.641
   60   HD12  LEU   9          HD12      LEU   9 294.212 -15.711   2.536
   61   HD13  LEU   9          HD13      LEU   9 294.374 -15.187   0.862
   62   HD21  LEU   9          HD21      LEU   9 292.603 -12.556   1.153
   63   HD22  LEU   9          HD22      LEU   9 294.061 -12.933   0.235
   64   HD23  LEU   9          HD23      LEU   9 294.078 -11.624   1.420
   65    H    LYS  10           H        LYS  10 293.985 -15.739   5.720
   66    HA   LYS  10           HA       LYS  10 292.761 -14.651   8.158
   67    HB2  LYS  10           HB2      LYS  10 294.313 -17.048   7.443
   68    HB3  LYS  10           HB3      LYS  10 294.479 -16.483   9.059
   69    HG2  LYS  10           HG2      LYS  10 292.247 -16.929   9.560
   70    HG3  LYS  10           HG3      LYS  10 291.788 -16.967   7.853
   71    HD2  LYS  10           HD2      LYS  10 291.841 -19.217   8.702
   72    HD3  LYS  10           HD3      LYS  10 293.172 -18.982   7.563
   73    HE2  LYS  10           HE2      LYS  10 294.388 -19.947   9.212
   74    HE3  LYS  10           HE3      LYS  10 294.412 -18.303   9.862
   75    HZ1  LYS  10           HZ1      LYS  10 292.220 -20.133  10.590
   76    HZ2  LYS  10           HZ2      LYS  10 292.853 -18.823  11.452
   77    HZ3  LYS  10           HZ3      LYS  10 293.717 -20.275  11.365
   78    H    VAL  11           H        VAL  11 293.829 -12.775   8.764
   79    HA   VAL  11           HA       VAL  11 296.705 -12.728   8.317
   80    HB   VAL  11           HB       VAL  11 295.739 -10.753   7.556
   81   HG11  VAL  11          HG11      VAL  11 293.755 -10.146   8.221
   82   HG12  VAL  11          HG12      VAL  11 294.484  -9.477   9.680
   83   HG13  VAL  11          HG13      VAL  11 293.866 -11.130   9.681
   84   HG21  VAL  11          HG21      VAL  11 297.238  -9.425   8.447
   85   HG22  VAL  11          HG22      VAL  11 297.586 -10.712   9.597
   86   HG23  VAL  11          HG23      VAL  11 296.438  -9.438  10.020
   87    H    ALA  12           H        ALA  12 298.051 -13.216   9.865
   88    HA   ALA  12           HA       ALA  12 297.054 -13.469  12.626
   89    HB1  ALA  12           HB1      ALA  12 297.838 -15.547  12.276
   90    HB2  ALA  12           HB2      ALA  12 299.385 -14.807  12.711
   91    HB3  ALA  12           HB3      ALA  12 298.956 -15.021  11.013
   92    H    GLY  13           H        GLY  13 297.901 -12.339  14.291
   93    HA2  GLY  13           HA2      GLY  13 299.826 -10.263  13.592
   94    HA3  GLY  13           HA3      GLY  13 298.803 -10.291  15.008
   95    H    GLN  14           H        GLN  14 300.940 -12.907  13.972
   96    HA   GLN  14           HA       GLN  14 302.743 -13.850  14.911
   97    HB2  GLN  14           HB2      GLN  14 303.014 -11.004  15.787
   98    HB3  GLN  14           HB3      GLN  14 304.185 -12.233  16.203
   99    HG2  GLN  14           HG2      GLN  14 304.565 -12.675  13.833
  100    HG3  GLN  14           HG3      GLN  14 303.401 -11.409  13.441
  101   HE21  GLN  14          HE21      GLN  14 306.593 -12.123  14.553
  102   HE22  GLN  14          HE22      GLN  14 307.200 -10.506  14.510
  103    H    ASP  15           H        ASP  15 300.788 -11.956  17.166
  104    HA   ASP  15           HA       ASP  15 301.723 -13.418  19.466
  105    HB2  ASP  15           HB2      ASP  15 299.829 -11.181  18.976
  106    HB3  ASP  15           HB3      ASP  15 299.575 -12.143  20.429
  107    H    GLY  16           H        GLY  16 299.785 -14.330  17.012
  108    HA2  GLY  16           HA2      GLY  16 298.715 -16.459  17.040
  109    HA3  GLY  16           HA3      GLY  16 298.341 -16.215  18.740
  110    H    SER  17           H        SER  17 297.729 -13.328  17.365
  111    HA   SER  17           HA       SER  17 294.880 -13.917  17.127
  112    HB2  SER  17           HB2      SER  17 296.325 -11.264  17.382
  113    HB3  SER  17           HB3      SER  17 294.574 -11.474  17.336
  114    HG   SER  17           HG       SER  17 294.667 -12.548  19.282
  115    H    VAL  18           H        VAL  18 294.318 -14.459  15.135
  116    HA   VAL  18           HA       VAL  18 295.425 -12.937  12.865
  117    HB   VAL  18           HB       VAL  18 296.020 -15.043  12.255
  118   HG11  VAL  18          HG11      VAL  18 295.603 -16.402  14.017
  119   HG12  VAL  18          HG12      VAL  18 294.466 -17.070  12.846
  120   HG13  VAL  18          HG13      VAL  18 293.894 -15.971  14.101
  121   HG21  VAL  18          HG21      VAL  18 294.361 -16.130  10.799
  122   HG22  VAL  18          HG22      VAL  18 294.489 -14.391  10.543
  123   HG23  VAL  18          HG23      VAL  18 293.125 -15.051  11.443
  124    H    VAL  19           H        VAL  19 293.759 -12.753  11.001
  125    HA   VAL  19           HA       VAL  19 291.001 -12.590  11.993
  126    HB   VAL  19           HB       VAL  19 292.313 -10.290  10.579
  127   HG11  VAL  19          HG11      VAL  19 289.949 -10.399  10.124
  128   HG12  VAL  19          HG12      VAL  19 290.272  -9.053  11.226
  129   HG13  VAL  19          HG13      VAL  19 289.597 -10.564  11.845
  130   HG21  VAL  19          HG21      VAL  19 291.712 -10.667  13.489
  131   HG22  VAL  19          HG22      VAL  19 291.999  -9.088  12.750
  132   HG23  VAL  19          HG23      VAL  19 293.265 -10.320  12.731
  133    H    GLN  20           H        GLN  20 289.436 -12.751  10.351
  134    HA   GLN  20           HA       GLN  20 290.533 -13.815   7.870
  135    HB2  GLN  20           HB2      GLN  20 287.697 -13.887   8.907
  136    HB3  GLN  20           HB3      GLN  20 288.291 -14.715   7.471
  137    HG2  GLN  20           HG2      GLN  20 289.916 -15.374   9.729
  138    HG3  GLN  20           HG3      GLN  20 288.218 -15.671  10.101
  139   HE21  GLN  20          HE21      GLN  20 290.348 -17.581   9.783
  140   HE22  GLN  20          HE22      GLN  20 289.899 -18.625   8.484
  141    H    PHE  21           H        PHE  21 290.152 -13.024   5.889
  142    HA   PHE  21           HA       PHE  21 288.319 -10.833   5.501
  143    HB2  PHE  21           HB2      PHE  21 291.268 -10.473   5.010
  144    HB3  PHE  21           HB3      PHE  21 290.000  -9.350   4.532
  145    HD1  PHE  21           HD2      PHE  21 288.532  -8.409   6.407
  146    HD2  PHE  21           HD1      PHE  21 292.294 -10.278   7.025
  147    HE1  PHE  21           HE2      PHE  21 288.737  -7.276   8.576
  148    HE2  PHE  21           HE1      PHE  21 292.506  -9.128   9.188
  149    HZ   PHE  21           HZ       PHE  21 290.741  -7.645   9.951
  150    H    LYS  22           H        LYS  22 287.314 -11.451   3.748
  151    HA   LYS  22           HA       LYS  22 288.908 -12.656   1.647
  152    HB2  LYS  22           HB2      LYS  22 287.339 -14.111   1.225
  153    HB3  LYS  22           HB3      LYS  22 286.552 -13.594   2.700
  154    HG2  LYS  22           HG2      LYS  22 285.418 -11.956   1.366
  155    HG3  LYS  22           HG3      LYS  22 286.165 -12.640  -0.019
  156    HD2  LYS  22           HD2      LYS  22 284.980 -14.705   1.560
  157    HD3  LYS  22           HD3      LYS  22 283.768 -13.485   1.149
  158    HE2  LYS  22           HE2      LYS  22 284.035 -13.844  -1.136
  159    HE3  LYS  22           HE3      LYS  22 285.595 -14.637  -0.913
  160    HZ1  LYS  22           HZ1      LYS  22 284.525 -16.541  -0.006
  161    HZ2  LYS  22           HZ2      LYS  22 283.736 -16.167  -1.454
  162    HZ3  LYS  22           HZ3      LYS  22 283.020 -15.770   0.026
  163    H    ILE  23           H        ILE  23 289.412 -11.583  -0.027
  164    HA   ILE  23           HA       ILE  23 287.722  -9.421  -0.918
  165    HB   ILE  23           HB       ILE  23 288.913  -7.890   0.158
  166   HG12  ILE  23          HG12      ILE  23 290.452  -8.550  -2.172
  167   HG13  ILE  23          HG13      ILE  23 290.181  -6.993  -1.422
  168   HG21  ILE  23          HG21      ILE  23 291.078  -9.927   0.642
  169   HG22  ILE  23          HG22      ILE  23 289.721  -9.572   1.712
  170   HG23  ILE  23          HG23      ILE  23 290.952  -8.346   1.412
  171   HD11  ILE  23          HD11      ILE  23 292.511  -7.307  -1.516
  172   HD12  ILE  23          HD12      ILE  23 292.382  -8.935  -0.850
  173   HD13  ILE  23          HD13      ILE  23 292.036  -7.534   0.171
  174    H    LYS  24           H        LYS  24 287.639  -9.332  -2.982
  175    HA   LYS  24           HA       LYS  24 288.217 -11.129  -4.809
  176    HB2  LYS  24           HB2      LYS  24 288.434  -8.181  -5.197
  177    HB3  LYS  24           HB3      LYS  24 288.500  -9.330  -6.534
  178    HG2  LYS  24           HG2      LYS  24 286.298  -9.574  -4.578
  179    HG3  LYS  24           HG3      LYS  24 286.216  -8.286  -5.763
  180    HD2  LYS  24           HD2      LYS  24 286.888 -10.999  -6.719
  181    HD3  LYS  24           HD3      LYS  24 285.227 -10.718  -6.197
  182    HE2  LYS  24           HE2      LYS  24 285.317  -8.655  -7.715
  183    HE3  LYS  24           HE3      LYS  24 286.763  -9.397  -8.395
  184    HZ1  LYS  24           HZ1      LYS  24 284.082 -10.671  -8.288
  185    HZ2  LYS  24           HZ2      LYS  24 285.470 -11.336  -8.989
  186    HZ3  LYS  24           HZ3      LYS  24 284.764  -9.953  -9.660
  187    H    ARG  25           H        ARG  25 289.893 -12.047  -5.911
  188    HA   ARG  25           HA       ARG  25 292.425 -11.983  -4.852
  189    HB2  ARG  25           HB2      ARG  25 291.489 -12.828  -7.578
  190    HB3  ARG  25           HB3      ARG  25 293.116 -13.072  -7.007
  191    HG2  ARG  25           HG2      ARG  25 291.787 -14.187  -4.979
  192    HG3  ARG  25           HG3      ARG  25 290.647 -14.482  -6.295
  193    HD2  ARG  25           HD2      ARG  25 292.207 -15.720  -7.524
  194    HD3  ARG  25           HD3      ARG  25 293.566 -15.103  -6.589
  195    HE   ARG  25           HE       ARG  25 292.283 -16.432  -4.709
  196   HH11  ARG  25          HH11      ARG  25 292.956 -17.375  -8.005
  197   HH12  ARG  25          HH12      ARG  25 292.973 -19.068  -7.646
  198   HH21  ARG  25          HH21      ARG  25 292.308 -18.659  -4.243
  199   HH22  ARG  25          HH22      ARG  25 292.610 -19.797  -5.513
  200    H    HIS  26           H        HIS  26 291.248 -10.254  -7.736
  201    HA   HIS  26           HA       HIS  26 293.836  -9.087  -8.173
  202    HB2  HIS  26           HB2      HIS  26 291.152  -8.549  -9.438
  203    HB3  HIS  26           HB3      HIS  26 292.635  -7.706  -9.884
  204    HD1  HIS  26           HD1      HIS  26 293.158  -8.614 -12.139
  205    HD2  HIS  26           HD2      HIS  26 292.216 -11.613  -9.421
  206    HE1  HIS  26           HE1      HIS  26 293.594 -10.776 -13.346
  207    HE2  HIS  26           HE2      HIS  26 293.107 -12.575 -11.651
  208    H    THR  27           H        THR  27 292.378  -8.564  -5.569
  209    HA   THR  27           HA       THR  27 292.204  -5.647  -5.763
  210    HB   THR  27           HB       THR  27 291.261  -7.495  -3.565
  211    HG1  THR  27           HG1      THR  27 289.204  -6.705  -4.269
  212   HG21  THR  27          HG21      THR  27 291.914  -5.345  -2.628
  213   HG22  THR  27          HG22      THR  27 290.158  -5.524  -2.622
  214   HG23  THR  27          HG23      THR  27 290.936  -4.512  -3.837
  215    HA   PRO  28           HA       PRO  28 296.050  -5.467  -3.626
  216    HB2  PRO  28           HB2      PRO  28 295.348  -2.860  -2.553
  217    HB3  PRO  28           HB3      PRO  28 296.519  -3.259  -3.811
  218    HG2  PRO  28           HG2      PRO  28 294.188  -1.922  -4.288
  219    HG3  PRO  28           HG3      PRO  28 295.023  -2.914  -5.496
  220    HD2  PRO  28           HD2      PRO  28 292.632  -3.557  -3.827
  221    HD3  PRO  28           HD3      PRO  28 292.985  -3.984  -5.515
  222    H    LEU  29           H        LEU  29 296.383  -6.560  -1.853
  223    HA   LEU  29           HA       LEU  29 294.588  -7.049   0.168
  224    HB2  LEU  29           HB2      LEU  29 297.608  -7.059   0.262
  225    HB3  LEU  29           HB3      LEU  29 296.584  -7.746   1.511
  226    HG   LEU  29           HG       LEU  29 296.264  -8.641  -1.322
  227   HD11  LEU  29          HD11      LEU  29 298.018 -10.311   0.313
  228   HD12  LEU  29          HD12      LEU  29 298.726  -8.759  -0.168
  229   HD13  LEU  29          HD13      LEU  29 298.115  -9.877  -1.401
  230   HD21  LEU  29          HD21      LEU  29 295.489  -9.553   1.381
  231   HD22  LEU  29          HD22      LEU  29 295.921 -10.802   0.202
  232   HD23  LEU  29          HD23      LEU  29 294.629  -9.660  -0.167
  233    H    SER  30           H        SER  30 296.357  -4.161  -0.376
  234    HA   SER  30           HA       SER  30 296.840  -3.077   2.071
  235    HB2  SER  30           HB2      SER  30 297.421  -1.615   0.397
  236    HB3  SER  30           HB3      SER  30 295.960  -1.933  -0.536
  237    HG   SER  30           HG       SER  30 295.403  -0.055   0.261
  238    H    LYS  31           H        LYS  31 293.759  -3.972   0.782
  239    HA   LYS  31           HA       LYS  31 292.245  -2.304   2.570
  240    HB2  LYS  31           HB2      LYS  31 291.655  -3.431   0.226
  241    HB3  LYS  31           HB3      LYS  31 290.988  -4.652   1.298
  242    HG2  LYS  31           HG2      LYS  31 289.316  -3.312   1.997
  243    HG3  LYS  31           HG3      LYS  31 290.307  -1.852   1.914
  244    HD2  LYS  31           HD2      LYS  31 289.626  -3.199  -0.640
  245    HD3  LYS  31           HD3      LYS  31 288.340  -2.313   0.184
  246    HE2  LYS  31           HE2      LYS  31 290.552  -0.626   0.279
  247    HE3  LYS  31           HE3      LYS  31 290.596  -1.334  -1.336
  248    HZ1  LYS  31           HZ1      LYS  31 289.271   0.541  -1.569
  249    HZ2  LYS  31           HZ2      LYS  31 288.470   0.300  -0.099
  250    HZ3  LYS  31           HZ3      LYS  31 288.136  -0.706  -1.417
  251    H    LEU  32           H        LEU  32 292.727  -5.841   2.184
  252    HA   LEU  32           HA       LEU  32 291.506  -6.806   4.393
  253    HB2  LEU  32           HB2      LEU  32 292.457  -8.271   2.804
  254    HB3  LEU  32           HB3      LEU  32 294.038  -7.550   2.958
  255    HG   LEU  32           HG       LEU  32 292.975  -9.019   5.331
  256   HD11  LEU  32          HD11      LEU  32 293.101 -11.071   4.488
  257   HD12  LEU  32          HD12      LEU  32 294.321 -10.637   3.290
  258   HD13  LEU  32          HD13      LEU  32 292.623 -10.246   3.006
  259   HD21  LEU  32          HD21      LEU  32 295.261  -7.804   5.000
  260   HD22  LEU  32          HD22      LEU  32 295.670  -9.258   4.078
  261   HD23  LEU  32          HD23      LEU  32 295.203  -9.387   5.788
  262    H    MET  33           H        MET  33 294.825  -5.527   4.231
  263    HA   MET  33           HA       MET  33 295.395  -5.821   6.955
  264    HB2  MET  33           HB2      MET  33 296.895  -3.613   6.037
  265    HB3  MET  33           HB3      MET  33 297.431  -5.252   6.303
  266    HG2  MET  33           HG2      MET  33 297.119  -5.863   4.104
  267    HG3  MET  33           HG3      MET  33 296.103  -4.467   3.799
  268    HE1  MET  33           HE1      MET  33 300.022  -5.275   4.806
  269    HE2  MET  33           HE2      MET  33 300.490  -4.870   3.149
  270    HE3  MET  33           HE3      MET  33 299.249  -6.092   3.445
  271    H    LYS  34           H        LYS  34 293.873  -3.252   5.161
  272    HA   LYS  34           HA       LYS  34 293.988  -1.283   7.188
  273    HB2  LYS  34           HB2      LYS  34 292.308  -1.682   4.743
  274    HB3  LYS  34           HB3      LYS  34 291.836  -0.457   5.913
  275    HG2  LYS  34           HG2      LYS  34 294.623  -0.544   4.845
  276    HG3  LYS  34           HG3      LYS  34 293.327   0.219   3.928
  277    HD2  LYS  34           HD2      LYS  34 292.886   1.355   6.305
  278    HD3  LYS  34           HD3      LYS  34 294.618   1.061   6.454
  279    HE2  LYS  34           HE2      LYS  34 294.506   2.093   3.961
  280    HE3  LYS  34           HE3      LYS  34 293.152   2.933   4.715
  281    HZ1  LYS  34           HZ1      LYS  34 295.197   4.185   4.950
  282    HZ2  LYS  34           HZ2      LYS  34 295.942   2.883   5.731
  283    HZ3  LYS  34           HZ3      LYS  34 294.645   3.680   6.468
  284    H    ALA  35           H        ALA  35 291.980  -4.060   6.694
  285    HA   ALA  35           HA       ALA  35 289.941  -3.252   8.571
  286    HB1  ALA  35           HB1      ALA  35 289.072  -5.515   8.176
  287    HB2  ALA  35           HB2      ALA  35 290.525  -5.914   7.249
  288    HB3  ALA  35           HB3      ALA  35 289.406  -4.685   6.654
  289    H    TYR  36           H        TYR  36 292.679  -5.497   8.483
  290    HA   TYR  36           HA       TYR  36 292.504  -6.559  11.112
  291    HB2  TYR  36           HB2      TYR  36 294.054  -7.324   9.248
  292    HB3  TYR  36           HB3      TYR  36 295.004  -5.870   9.500
  293    HD1  TYR  36           HD2      TYR  36 293.517  -8.475  11.660
  294    HD2  TYR  36           HD1      TYR  36 297.012  -6.281  10.629
  295    HE1  TYR  36           HE2      TYR  36 294.769  -9.659  13.387
  296    HE2  TYR  36           HE1      TYR  36 298.269  -7.452  12.347
  297    HH   TYR  36           HH       TYR  36 297.919  -8.687  14.373
  298    H    CYS  37           H        CYS  37 293.886  -3.588   9.765
  299    HA   CYS  37           HA       CYS  37 295.144  -2.664  12.118
  300    HB2  CYS  37           HB2      CYS  37 294.266  -1.475   9.530
  301    HB3  CYS  37           HB3      CYS  37 294.559  -0.364  10.862
  302    HG   CYS  37           HG       CYS  37 296.834  -2.312  10.108
  303    H    GLU  38           H        GLU  38 291.908  -2.603  10.862
  304    HA   GLU  38           HA       GLU  38 290.776  -0.747  12.671
  305    HB2  GLU  38           HB2      GLU  38 289.860  -1.865  10.449
  306    HB3  GLU  38           HB3      GLU  38 289.205  -3.048  11.569
  307    HG2  GLU  38           HG2      GLU  38 288.554  -0.546  12.638
  308    HG3  GLU  38           HG3      GLU  38 288.253  -0.433  10.904
  309    H    ARG  39           H        ARG  39 290.352  -4.319  12.570
  310    HA   ARG  39           HA       ARG  39 289.339  -4.862  14.993
  311    HB2  ARG  39           HB2      ARG  39 291.240  -6.835  14.611
  312    HB3  ARG  39           HB3      ARG  39 289.654  -6.834  14.031
  313    HG2  ARG  39           HG2      ARG  39 291.557  -5.521  12.342
  314    HG3  ARG  39           HG3      ARG  39 291.701  -7.272  12.534
  315    HD2  ARG  39           HD2      ARG  39 289.249  -5.778  11.792
  316    HD3  ARG  39           HD3      ARG  39 290.217  -6.737  10.703
  317    HE   ARG  39           HE       ARG  39 289.407  -8.371  12.796
  318   HH11  ARG  39          HH11      ARG  39 287.908  -6.569  10.204
  319   HH12  ARG  39          HH12      ARG  39 286.574  -7.664  10.046
  320   HH21  ARG  39          HH21      ARG  39 287.647  -9.804  12.591
  321   HH22  ARG  39          HH22      ARG  39 286.426  -9.495  11.402
  322    H    GLN  40           H        GLN  40 292.672  -4.953  14.152
  323    HA   GLN  40           HA       GLN  40 293.649  -5.403  16.778
  324    HB2  GLN  40           HB2      GLN  40 295.161  -4.523  14.325
  325    HB3  GLN  40           HB3      GLN  40 295.860  -5.208  15.786
  326    HG2  GLN  40           HG2      GLN  40 293.772  -6.785  14.408
  327    HG3  GLN  40           HG3      GLN  40 295.348  -6.653  13.627
  328   HE21  GLN  40          HE21      GLN  40 297.108  -6.728  15.615
  329   HE22  GLN  40          HE22      GLN  40 296.989  -8.196  16.516
  330    H    GLY  41           H        GLY  41 293.870  -2.502  14.642
  331    HA2  GLY  41           HA2      GLY  41 293.571  -0.323  15.622
  332    HA3  GLY  41           HA3      GLY  41 294.320  -0.938  17.094
  333    H    LEU  42           H        LEU  42 295.820  -2.198  14.391
  334    HA   LEU  42           HA       LEU  42 298.300  -1.026  14.890
  335    HB2  LEU  42           HB2      LEU  42 297.272  -2.407  12.424
  336    HB3  LEU  42           HB3      LEU  42 298.960  -2.030  12.701
  337    HG   LEU  42           HG       LEU  42 297.580  -3.599  14.804
  338   HD11  LEU  42          HD11      LEU  42 298.431  -4.833  12.188
  339   HD12  LEU  42          HD12      LEU  42 296.760  -4.614  12.711
  340   HD13  LEU  42          HD13      LEU  42 297.835  -5.683  13.614
  341   HD21  LEU  42          HD21      LEU  42 299.684  -4.271  15.306
  342   HD22  LEU  42          HD22      LEU  42 300.083  -2.759  14.485
  343   HD23  LEU  42          HD23      LEU  42 300.201  -4.293  13.619
  344    H    SER  43           H        SER  43 299.593   0.061  13.229
  345    HA   SER  43           HA       SER  43 298.310   2.545  12.466
  346    HB2  SER  43           HB2      SER  43 300.487   2.650  13.548
  347    HB3  SER  43           HB3      SER  43 301.185   1.607  12.311
  348    HG   SER  43           HG       SER  43 300.022   4.138  11.772
  349    H    MET  44           H        MET  44 299.694  -0.269  10.969
  350    HA   MET  44           HA       MET  44 299.319  -1.158   8.909
  351    HB2  MET  44           HB2      MET  44 297.352   0.639   8.804
  352    HB3  MET  44           HB3      MET  44 298.430   1.364   7.619
  353    HG2  MET  44           HG2      MET  44 298.515  -1.160   6.770
  354    HG3  MET  44           HG3      MET  44 296.913  -1.169   7.498
  355    HE1  MET  44           HE1      MET  44 298.391  -1.307   4.442
  356    HE2  MET  44           HE2      MET  44 297.198  -0.569   3.373
  357    HE3  MET  44           HE3      MET  44 296.707  -1.830   4.502
  358    H    ARG  45           H        ARG  45 300.955   1.784   9.558
  359    HA   ARG  45           HA       ARG  45 302.678   1.528   7.213
  360    HB2  ARG  45           HB2      ARG  45 301.729   3.724   8.701
  361    HB3  ARG  45           HB3      ARG  45 303.467   3.671   8.906
  362    HG2  ARG  45           HG2      ARG  45 302.421   3.352   6.163
  363    HG3  ARG  45           HG3      ARG  45 302.278   4.950   6.901
  364    HD2  ARG  45           HD2      ARG  45 304.752   4.630   7.528
  365    HD3  ARG  45           HD3      ARG  45 304.742   3.357   6.309
  366    HE   ARG  45           HE       ARG  45 304.807   6.159   5.840
  367   HH11  ARG  45          HH11      ARG  45 303.550   3.166   4.555
  368   HH12  ARG  45          HH12      ARG  45 303.470   3.754   2.929
  369   HH21  ARG  45          HH21      ARG  45 304.700   6.932   3.701
  370   HH22  ARG  45          HH22      ARG  45 304.121   5.891   2.444
  371    H    GLN  46           H        GLN  46 302.466   1.223  10.616
  372    HA   GLN  46           HA       GLN  46 305.281   0.619  11.074
  373    HB2  GLN  46           HB2      GLN  46 303.717   1.942  12.590
  374    HB3  GLN  46           HB3      GLN  46 302.978   0.393  12.979
  375    HG2  GLN  46           HG2      GLN  46 305.916   0.550  13.219
  376    HG3  GLN  46           HG3      GLN  46 304.988   1.487  14.392
  377   HE21  GLN  46          HE21      GLN  46 302.847  -0.033  14.881
  378   HE22  GLN  46          HE22      GLN  46 303.306  -1.555  15.549
  379    H    ILE  47           H        ILE  47 302.840  -0.893   9.750
  380    HA   ILE  47           HA       ILE  47 303.333  -3.565  10.909
  381    HB   ILE  47           HB       ILE  47 301.034  -2.320  10.981
  382   HG12  ILE  47          HG12      ILE  47 301.302  -4.660  11.725
  383   HG13  ILE  47          HG13      ILE  47 299.783  -4.330  10.865
  384   HG21  ILE  47          HG21      ILE  47 300.959  -3.537   8.245
  385   HG22  ILE  47          HG22      ILE  47 301.041  -1.819   8.614
  386   HG23  ILE  47          HG23      ILE  47 299.625  -2.761   9.090
  387   HD11  ILE  47          HD11      ILE  47 300.137  -6.128   9.808
  388   HD12  ILE  47          HD12      ILE  47 301.850  -6.208  10.286
  389   HD13  ILE  47          HD13      ILE  47 301.365  -5.221   8.904
  390    H    ARG  48           H        ARG  48 303.725  -5.182   9.517
  391    HA   ARG  48           HA       ARG  48 303.621  -4.654   6.640
  392    HB2  ARG  48           HB2      ARG  48 305.928  -5.797   8.215
  393    HB3  ARG  48           HB3      ARG  48 305.708  -6.103   6.498
  394    HG2  ARG  48           HG2      ARG  48 305.982  -3.395   7.767
  395    HG3  ARG  48           HG3      ARG  48 307.258  -4.267   6.911
  396    HD2  ARG  48           HD2      ARG  48 306.520  -3.412   5.022
  397    HD3  ARG  48           HD3      ARG  48 305.023  -4.296   5.229
  398    HE   ARG  48           HE       ARG  48 303.986  -2.340   5.861
  399   HH11  ARG  48          HH11      ARG  48 307.441  -1.846   5.796
  400   HH12  ARG  48          HH12      ARG  48 307.323  -0.128   5.973
  401   HH21  ARG  48          HH21      ARG  48 303.832  -0.081   6.095
  402   HH22  ARG  48          HH22      ARG  48 305.276   0.874   6.144
  403    H    PHE  49           H        PHE  49 302.235  -6.095   5.867
  404    HA   PHE  49           HA       PHE  49 301.640  -8.407   7.500
  405    HB2  PHE  49           HB2      PHE  49 300.404  -7.417   4.917
  406    HB3  PHE  49           HB3      PHE  49 299.998  -8.943   5.622
  407    HD1  PHE  49           HD1      PHE  49 300.654  -5.819   7.517
  408    HD2  PHE  49           HD2      PHE  49 297.788  -8.603   6.068
  409    HE1  PHE  49           HE1      PHE  49 298.971  -4.784   8.902
  410    HE2  PHE  49           HE2      PHE  49 296.085  -7.558   7.497
  411    HZ   PHE  49           HZ       PHE  49 296.715  -5.649   8.934
  412    H    ARG  50           H        ARG  50 302.216 -10.502   6.915
  413    HA   ARG  50           HA       ARG  50 303.648 -10.791   4.386
  414    HB2  ARG  50           HB2      ARG  50 305.017 -11.012   6.549
  415    HB3  ARG  50           HB3      ARG  50 304.198 -12.531   6.766
  416    HG2  ARG  50           HG2      ARG  50 305.092 -12.484   4.178
  417    HG3  ARG  50           HG3      ARG  50 306.404 -11.805   5.088
  418    HD2  ARG  50           HD2      ARG  50 305.058 -14.374   5.836
  419    HD3  ARG  50           HD3      ARG  50 306.428 -14.294   4.744
  420    HE   ARG  50           HE       ARG  50 307.352 -12.964   6.878
  421   HH11  ARG  50          HH11      ARG  50 305.775 -16.063   6.566
  422   HH12  ARG  50          HH12      ARG  50 306.587 -16.754   7.930
  423   HH21  ARG  50          HH21      ARG  50 308.421 -13.875   8.674
  424   HH22  ARG  50          HH22      ARG  50 308.087 -15.513   9.126
  425    H    PHE  51           H        PHE  51 303.082 -12.527   3.227
  426    HA   PHE  51           HA       PHE  51 300.594 -13.766   4.054
  427    HB2  PHE  51           HB2      PHE  51 300.277 -13.138   1.875
  428    HB3  PHE  51           HB3      PHE  51 301.954 -13.345   1.457
  429    HD1  PHE  51           HD2      PHE  51 299.065 -15.445   2.503
  430    HD2  PHE  51           HD1      PHE  51 302.427 -15.018  -0.061
  431    HE1  PHE  51           HE2      PHE  51 298.497 -17.575   1.410
  432    HE2  PHE  51           HE1      PHE  51 301.868 -17.142  -1.162
  433    HZ   PHE  51           HZ       PHE  51 299.899 -18.425  -0.428
  434    H    ASP  52           H        ASP  52 300.377 -16.047   3.779
  435    HA   ASP  52           HA       ASP  52 301.943 -17.517   5.455
  436    HB2  ASP  52           HB2      ASP  52 299.859 -18.338   4.135
  437    HB3  ASP  52           HB3      ASP  52 301.021 -18.861   2.923
  438    H    GLY  53           H        GLY  53 303.992 -16.972   5.397
  439    HA2  GLY  53           HA2      GLY  53 306.185 -16.885   4.825
  440    HA3  GLY  53           HA3      GLY  53 305.861 -18.310   3.865
  441    H    GLN  54           H        GLN  54 305.149 -14.719   3.610
  442    HA   GLN  54           HA       GLN  54 306.750 -14.435   1.324
  443    HB2  GLN  54           HB2      GLN  54 304.542 -15.841   0.634
  444    HB3  GLN  54           HB3      GLN  54 303.937 -14.201   0.439
  445    HG2  GLN  54           HG2      GLN  54 304.753 -14.452  -1.636
  446    HG3  GLN  54           HG3      GLN  54 306.263 -13.968  -0.862
  447   HE21  GLN  54          HE21      GLN  54 307.899 -15.151  -1.496
  448   HE22  GLN  54          HE22      GLN  54 307.867 -16.841  -1.854
  449    HA   PRO  55           HA       PRO  55 306.170 -10.488   3.479
  450    HB2  PRO  55           HB2      PRO  55 307.495  -9.288   1.229
  451    HB3  PRO  55           HB3      PRO  55 308.129  -9.561   2.852
  452    HG2  PRO  55           HG2      PRO  55 308.481 -11.170   0.401
  453    HG3  PRO  55           HG3      PRO  55 309.510 -11.071   1.840
  454    HD2  PRO  55           HD2      PRO  55 308.018 -13.233   1.291
  455    HD3  PRO  55           HD3      PRO  55 308.282 -12.692   2.960
  456    H    ILE  56           H        ILE  56 304.695  -8.855   3.227
  457    HA   ILE  56           HA       ILE  56 303.152  -8.910   0.715
  458    HB   ILE  56           HB       ILE  56 302.238  -8.372   3.498
  459   HG12  ILE  56          HG12      ILE  56 302.171 -10.611   1.707
  460   HG13  ILE  56          HG13      ILE  56 301.783 -10.535   3.417
  461   HG21  ILE  56          HG21      ILE  56 301.213  -6.658   2.246
  462   HG22  ILE  56          HG22      ILE  56 300.007  -7.903   2.578
  463   HG23  ILE  56          HG23      ILE  56 300.750  -7.794   0.973
  464   HD11  ILE  56          HD11      ILE  56 299.860  -9.640   1.319
  465   HD12  ILE  56          HD12      ILE  56 299.556 -10.043   3.010
  466   HD13  ILE  56          HD13      ILE  56 299.976 -11.313   1.856
  467    H    ASN  57           H        ASN  57 302.218  -7.131  -0.060
  468    HA   ASN  57           HA       ASN  57 303.324  -4.533   0.734
  469    HB2  ASN  57           HB2      ASN  57 302.882  -5.710  -1.966
  470    HB3  ASN  57           HB3      ASN  57 303.087  -3.984  -1.748
  471   HD21  ASN  57          HD21      ASN  57 305.048  -3.830   0.066
  472   HD22  ASN  57          HD22      ASN  57 306.481  -4.566  -0.531
  473    H    GLU  58           H        GLU  58 301.914  -2.706   0.266
  474    HA   GLU  58           HA       GLU  58 299.243  -3.172   0.986
  475    HB2  GLU  58           HB2      GLU  58 300.882  -0.865   0.203
  476    HB3  GLU  58           HB3      GLU  58 299.183  -0.703  -0.212
  477    HG2  GLU  58           HG2      GLU  58 298.598  -1.200   2.134
  478    HG3  GLU  58           HG3      GLU  58 300.318  -1.245   2.521
  479    H    THR  59           H        THR  59 300.836  -3.023  -2.107
  480    HA   THR  59           HA       THR  59 298.296  -2.972  -3.517
  481    HB   THR  59           HB       THR  59 299.803  -2.947  -5.553
  482    HG1  THR  59           HG1      THR  59 301.685  -3.761  -4.668
  483   HG21  THR  59          HG21      THR  59 299.409  -0.779  -5.416
  484   HG22  THR  59          HG22      THR  59 300.837  -0.616  -4.393
  485   HG23  THR  59          HG23      THR  59 299.252  -0.883  -3.661
  486    H    ASP  60           H        ASP  60 300.486  -5.312  -2.359
  487    HA   ASP  60           HA       ASP  60 300.322  -7.288  -4.337
  488    HB2  ASP  60           HB2      ASP  60 300.834  -7.319  -1.396
  489    HB3  ASP  60           HB3      ASP  60 300.480  -8.845  -2.193
  490    H    THR  61           H        THR  61 298.840  -8.851  -4.830
  491    HA   THR  61           HA       THR  61 296.357  -8.858  -3.261
  492    HB   THR  61           HB       THR  61 295.003  -8.845  -5.096
  493    HG1  THR  61           HG1      THR  61 296.788  -9.222  -7.133
  494   HG21  THR  61          HG21      THR  61 295.703  -7.160  -6.710
  495   HG22  THR  61          HG22      THR  61 297.361  -7.277  -6.109
  496   HG23  THR  61          HG23      THR  61 296.083  -6.669  -5.056
  497    HA   PRO  62           HA       PRO  62 296.424 -13.176  -2.542
  498    HB2  PRO  62           HB2      PRO  62 293.874 -13.175  -4.122
  499    HB3  PRO  62           HB3      PRO  62 294.217 -13.921  -2.559
  500    HG2  PRO  62           HG2      PRO  62 292.826 -11.647  -2.780
  501    HG3  PRO  62           HG3      PRO  62 293.928 -11.938  -1.419
  502    HD2  PRO  62           HD2      PRO  62 294.212 -10.109  -3.714
  503    HD3  PRO  62           HD3      PRO  62 294.987 -10.050  -2.120
  504    H    ALA  63           H        ALA  63 295.290 -12.204  -5.848
  505    HA   ALA  63           HA       ALA  63 296.010 -14.601  -7.168
  506    HB1  ALA  63           HB1      ALA  63 296.113 -11.851  -8.354
  507    HB2  ALA  63           HB2      ALA  63 294.570 -12.628  -7.974
  508    HB3  ALA  63           HB3      ALA  63 295.664 -13.372  -9.140
  509    H    GLN  64           H        GLN  64 297.485 -11.537  -6.613
  510    HA   GLN  64           HA       GLN  64 299.896 -11.873  -8.026
  511    HB2  GLN  64           HB2      GLN  64 298.484  -9.945  -6.490
  512    HB3  GLN  64           HB3      GLN  64 300.071 -10.077  -5.812
  513    HG2  GLN  64           HG2      GLN  64 299.533  -9.638  -8.718
  514    HG3  GLN  64           HG3      GLN  64 299.784  -8.330  -7.565
  515   HE21  GLN  64          HE21      GLN  64 301.837  -8.050  -6.640
  516   HE22  GLN  64          HE22      GLN  64 303.255  -8.728  -7.357
  517    H    LEU  65           H        LEU  65 298.658 -12.978  -5.094
  518    HA   LEU  65           HA       LEU  65 301.288 -13.776  -4.077
  519    HB2  LEU  65           HB2      LEU  65 298.695 -13.046  -2.773
  520    HB3  LEU  65           HB3      LEU  65 299.956 -13.843  -1.889
  521    HG   LEU  65           HG       LEU  65 299.955 -11.097  -3.115
  522   HD11  LEU  65          HD11      LEU  65 299.105 -11.616  -0.760
  523   HD12  LEU  65          HD12      LEU  65 300.258 -10.297  -0.961
  524   HD13  LEU  65          HD13      LEU  65 300.800 -11.861  -0.347
  525   HD21  LEU  65          HD21      LEU  65 302.345 -10.971  -2.348
  526   HD22  LEU  65          HD22      LEU  65 302.048 -11.979  -3.766
  527   HD23  LEU  65          HD23      LEU  65 302.306 -12.728  -2.190
  528    H    GLU  66           H        GLU  66 298.848 -14.987  -5.779
  529    HA   GLU  66           HA       GLU  66 297.811 -16.997  -6.063
  530    HB2  GLU  66           HB2      GLU  66 300.538 -17.842  -5.057
  531    HB3  GLU  66           HB3      GLU  66 299.358 -18.974  -5.702
  532    HG2  GLU  66           HG2      GLU  66 299.526 -18.120  -7.854
  533    HG3  GLU  66           HG3      GLU  66 300.236 -16.604  -7.300
  534    H    MET  67           H        MET  67 296.827 -15.895  -3.912
  535    HA   MET  67           HA       MET  67 297.042 -17.662  -1.617
  536    HB2  MET  67           HB2      MET  67 295.715 -15.024  -2.143
  537    HB3  MET  67           HB3      MET  67 295.354 -15.930  -0.696
  538    HG2  MET  67           HG2      MET  67 298.064 -15.953  -0.677
  539    HG3  MET  67           HG3      MET  67 297.729 -14.386  -1.411
  540    HE1  MET  67           HE1      MET  67 297.253 -12.496  -0.431
  541    HE2  MET  67           HE2      MET  67 298.522 -12.682   0.782
  542    HE3  MET  67           HE3      MET  67 296.912 -12.147   1.264
  543    H    GLU  68           H        GLU  68 294.999 -18.358  -0.522
  544    HA   GLU  68           HA       GLU  68 293.004 -19.187  -2.533
  545    HB2  GLU  68           HB2      GLU  68 294.466 -20.734  -0.586
  546    HB3  GLU  68           HB3      GLU  68 292.732 -20.880  -0.337
  547    HG2  GLU  68           HG2      GLU  68 292.433 -22.054  -2.235
  548    HG3  GLU  68           HG3      GLU  68 293.652 -21.143  -3.125
  549    H    ASP  69           H        ASP  69 291.062 -20.147  -1.196
  550    HA   ASP  69           HA       ASP  69 289.981 -17.865   0.217
  551    HB2  ASP  69           HB2      ASP  69 287.900 -18.612  -0.384
  552    HB3  ASP  69           HB3      ASP  69 288.869 -19.302  -1.679
  553    H    GLU  70           H        GLU  70 290.403 -17.732   2.129
  554    HA   GLU  70           HA       GLU  70 290.039 -18.163   4.448
  555    HB2  GLU  70           HB2      GLU  70 288.856 -20.346   3.767
  556    HB3  GLU  70           HB3      GLU  70 290.438 -21.101   3.896
  557    HG2  GLU  70           HG2      GLU  70 290.528 -20.188   6.254
  558    HG3  GLU  70           HG3      GLU  70 288.818 -19.805   6.062
  559    H    ASP  71           H        ASP  71 292.416 -18.469   2.312
  560    HA   ASP  71           HA       ASP  71 294.549 -19.713   3.463
  561    HB2  ASP  71           HB2      ASP  71 294.188 -18.091   1.281
  562    HB3  ASP  71           HB3      ASP  71 295.228 -17.101   2.291
  563    H    THR  72           H        THR  72 296.539 -17.927   4.032
  564    HA   THR  72           HA       THR  72 295.519 -16.413   6.326
  565    HB   THR  72           HB       THR  72 297.659 -18.505   6.423
  566    HG1  THR  72           HG1      THR  72 295.646 -18.193   8.314
  567   HG21  THR  72          HG21      THR  72 297.531 -16.061   7.935
  568   HG22  THR  72          HG22      THR  72 298.787 -17.298   7.898
  569   HG23  THR  72          HG23      THR  72 297.398 -17.481   8.971
  570    H    ILE  73           H        ILE  73 296.301 -14.547   6.538
  571    HA   ILE  73           HA       ILE  73 298.666 -13.705   5.026
  572    HB   ILE  73           HB       ILE  73 296.189 -12.261   5.962
  573   HG12  ILE  73          HG12      ILE  73 296.305 -12.591   3.676
  574   HG13  ILE  73          HG13      ILE  73 296.861 -10.951   3.926
  575   HG21  ILE  73          HG21      ILE  73 297.174 -10.200   6.389
  576   HG22  ILE  73          HG22      ILE  73 298.656 -10.577   5.504
  577   HG23  ILE  73          HG23      ILE  73 298.382 -11.253   7.113
  578   HD11  ILE  73          HD11      ILE  73 298.385 -11.682   2.469
  579   HD12  ILE  73          HD12      ILE  73 298.399 -13.311   3.138
  580   HD13  ILE  73          HD13      ILE  73 299.177 -11.986   4.011
  581    H    ASP  74           H        ASP  74 300.417 -13.422   6.173
  582    HA   ASP  74           HA       ASP  74 300.264 -13.744   9.070
  583    HB2  ASP  74           HB2      ASP  74 302.761 -13.586   7.359
  584    HB3  ASP  74           HB3      ASP  74 302.636 -14.167   9.017
  585    H    VAL  75           H        VAL  75 300.734 -12.082  10.477
  586    HA   VAL  75           HA       VAL  75 301.311  -9.534   9.140
  587    HB   VAL  75           HB       VAL  75 299.506 -10.154  11.384
  588   HG11  VAL  75          HG11      VAL  75 299.829  -7.878  12.385
  589   HG12  VAL  75          HG12      VAL  75 301.316  -7.717  11.453
  590   HG13  VAL  75          HG13      VAL  75 301.175  -8.978  12.690
  591   HG21  VAL  75          HG21      VAL  75 299.115  -9.190   8.990
  592   HG22  VAL  75          HG22      VAL  75 299.551  -7.663   9.747
  593   HG23  VAL  75          HG23      VAL  75 298.184  -8.582  10.353
  594    H    PHE  76           H        PHE  76 302.905  -8.319   9.679
  595    HA   PHE  76           HA       PHE  76 304.518  -8.918  12.017
  596    HB2  PHE  76           HB2      PHE  76 305.588  -8.609   9.232
  597    HB3  PHE  76           HB3      PHE  76 306.577  -8.664  10.659
  598    HD1  PHE  76           HD1      PHE  76 306.329 -10.729  12.152
  599    HD2  PHE  76           HD2      PHE  76 305.182 -10.680   8.032
  600    HE1  PHE  76           HE1      PHE  76 306.461 -13.180  12.087
  601    HE2  PHE  76           HE2      PHE  76 305.311 -13.130   7.993
  602    HZ   PHE  76           HZ       PHE  76 305.951 -14.381  10.004
  603    H    GLN  77           H        GLN  77 305.215  -7.096  12.898
  604    HA   GLN  77           HA       GLN  77 304.282  -4.593  11.708
  605    HB2  GLN  77           HB2      GLN  77 304.437  -5.614  14.362
  606    HB3  GLN  77           HB3      GLN  77 305.433  -4.165  14.286
  607    HG2  GLN  77           HG2      GLN  77 303.663  -2.804  13.977
  608    HG3  GLN  77           HG3      GLN  77 302.781  -3.990  13.014
  609   HE21  GLN  77          HE21      GLN  77 301.998  -5.913  14.283
  610   HE22  GLN  77          HE22      GLN  77 301.319  -5.594  15.839
  611    H    GLN  78           H        GLN  78 305.705  -3.426  10.531
  612    HA   GLN  78           HA       GLN  78 307.656  -2.725   9.619
  613    HB2  GLN  78           HB2      GLN  78 307.574  -2.013  12.438
  614    HB3  GLN  78           HB3      GLN  78 309.214  -2.055  11.803
  615    HG2  GLN  78           HG2      GLN  78 307.722  -0.726   9.864
  616    HG3  GLN  78           HG3      GLN  78 307.140  -0.100  11.407
  617   HE21  GLN  78          HE21      GLN  78 308.074   1.807  11.657
  618   HE22  GLN  78          HE22      GLN  78 309.765   2.131  11.511
  619    H    GLN  79           H        GLN  79 308.649  -4.398   8.623
  620    HA   GLN  79           HA       GLN  79 311.177  -5.155   9.276
  621    HB2  GLN  79           HB2      GLN  79 310.917  -7.519  10.035
  622    HB3  GLN  79           HB3      GLN  79 310.448  -6.324  11.231
  623    HG2  GLN  79           HG2      GLN  79 308.158  -6.761  10.913
  624    HG3  GLN  79           HG3      GLN  79 308.461  -7.672   9.433
  625   HE21  GLN  79          HE21      GLN  79 308.999  -9.797   9.556
  626   HE22  GLN  79          HE22      GLN  79 309.045 -10.696  11.030
  627    H    THR  80           H        THR  80 309.704  -4.547   6.984
  628    HA   THR  80           HA       THR  80 310.441  -6.809   5.328
  629    HB   THR  80           HB       THR  80 308.357  -7.082   4.229
  630    HG1  THR  80           HG1      THR  80 306.795  -5.659   4.271
  631   HG21  THR  80          HG21      THR  80 308.524  -8.109   6.509
  632   HG22  THR  80          HG22      THR  80 306.890  -7.865   5.885
  633   HG23  THR  80          HG23      THR  80 307.546  -6.762   7.094
  634    H    GLY  81           H        GLY  81 308.291  -4.136   4.457
  635    HA2  GLY  81           HA2      GLY  81 308.554  -2.369   3.026
  636    HA3  GLY  81           HA3      GLY  81 310.216  -2.307   3.585
  637    H    GLY  82           H        GLY  82 308.808  -2.031   0.872
  638    HA2  GLY  82           HA2      GLY  82 309.233  -2.557  -1.308
  639    HA3  GLY  82           HA3      GLY  82 310.872  -2.857  -0.757
  640    H1   GLY   1           HT1      GLY   1 315.999   7.846  18.571
  641    H2   GLY   1           HT2      GLY   1 317.529   8.558  18.449
  642    H3   GLY   1           HT3      GLY   1 317.234   7.058  17.724
  643    HA2  GLY   1           HA3      GLY   1 315.807   9.539  16.953
  644    HA3  GLY   1           HA2      GLY   1 317.281   9.000  16.163
  645    H    SER   2           H        SER   2 314.721   9.363  14.929
  646    HA   SER   2           HA       SER   2 313.602   6.733  14.512
  647    HB2  SER   2           HB2      SER   2 312.455   9.138  14.397
  648    HB3  SER   2           HB3      SER   2 312.928   9.007  12.704
  649    HG   SER   2           HG       SER   2 311.738   7.107  12.555
  650    H    GLU   3           H        GLU   3 313.629   5.567  12.572
  651    HA   GLU   3           HA       GLU   3 315.421   6.446  10.456
  652    HB2  GLU   3           HB2      GLU   3 316.422   4.862  12.470
  653    HB3  GLU   3           HB3      GLU   3 315.980   3.681  11.244
  654    HG2  GLU   3           HG2      GLU   3 317.263   5.262   9.633
  655    HG3  GLU   3           HG3      GLU   3 317.993   5.879  11.115
  656    H    GLU   4           H        GLU   4 313.988   6.340   8.831
  657    HA   GLU   4           HA       GLU   4 312.102   4.154   8.612
  658    HB2  GLU   4           HB2      GLU   4 312.532   6.141   6.408
  659    HB3  GLU   4           HB3      GLU   4 311.043   5.393   6.967
  660    HG2  GLU   4           HG2      GLU   4 310.670   7.432   7.819
  661    HG3  GLU   4           HG3      GLU   4 311.656   6.821   9.145
  662    H    LYS   5           H        LYS   5 312.076   4.005   5.776
  663    HA   LYS   5           HA       LYS   5 313.234   3.230   3.924
  664    HB2  LYS   5           HB2      LYS   5 315.485   2.505   5.793
  665    HB3  LYS   5           HB3      LYS   5 315.503   2.348   4.055
  666    HG2  LYS   5           HG2      LYS   5 316.309   4.549   5.622
  667    HG3  LYS   5           HG3      LYS   5 316.334   4.360   3.873
  668    HD2  LYS   5           HD2      LYS   5 314.257   5.379   3.616
  669    HD3  LYS   5           HD3      LYS   5 313.873   5.265   5.329
  670    HE2  LYS   5           HE2      LYS   5 316.330   6.743   4.730
  671    HE3  LYS   5           HE3      LYS   5 314.858   7.489   4.122
  672    HZ1  LYS   5           HZ1      LYS   5 314.423   8.209   6.152
  673    HZ2  LYS   5           HZ2      LYS   5 315.848   7.506   6.729
  674    HZ3  LYS   5           HZ3      LYS   5 314.405   6.626   6.750
  675    HA   PRO   6           HA       PRO   6 311.677  -0.897   4.340
  676    HB2  PRO   6           HB2      PRO   6 313.389  -1.560   2.022
  677    HB3  PRO   6           HB3      PRO   6 311.636  -1.676   2.189
  678    HG2  PRO   6           HG2      PRO   6 312.774   0.218   0.685
  679    HG3  PRO   6           HG3      PRO   6 311.304   0.540   1.620
  680    HD2  PRO   6           HD2      PRO   6 314.134   1.331   2.209
  681    HD3  PRO   6           HD3      PRO   6 312.634   2.234   2.471
  682    H    LYS   7           H        LYS   7 312.487  -2.106   5.993
  683    HA   LYS   7           HA       LYS   7 315.255  -2.520   6.421
  684    HB2  LYS   7           HB2      LYS   7 312.939  -4.100   7.548
  685    HB3  LYS   7           HB3      LYS   7 314.570  -4.022   8.201
  686    HG2  LYS   7           HG2      LYS   7 313.146  -1.453   7.885
  687    HG3  LYS   7           HG3      LYS   7 312.553  -2.550   9.133
  688    HD2  LYS   7           HD2      LYS   7 315.297  -2.615   9.459
  689    HD3  LYS   7           HD3      LYS   7 314.967  -0.926   9.068
  690    HE2  LYS   7           HE2      LYS   7 312.979  -1.501  10.855
  691    HE3  LYS   7           HE3      LYS   7 314.317  -2.470  11.471
  692    HZ1  LYS   7           HZ1      LYS   7 315.460  -0.655  12.081
  693    HZ2  LYS   7           HZ2      LYS   7 313.951   0.109  12.049
  694    HZ3  LYS   7           HZ3      LYS   7 314.996   0.247  10.726
  695    H    GLU   8           H        GLU   8 315.791  -3.273   4.251
  696    HA   GLU   8           HA       GLU   8 316.903  -5.171   3.401
  697    HB2  GLU   8           HB2      GLU   8 315.362  -6.573   5.082
  698    HB3  GLU   8           HB3      GLU   8 314.545  -6.923   3.564
  699    HG2  GLU   8           HG2      GLU   8 316.268  -8.154   2.772
  700    HG3  GLU   8           HG3      GLU   8 317.482  -7.165   3.583
  701    H    GLY   9           H        GLY   9 313.671  -4.234   3.017
  702    HA2  GLY   9           HA2      GLY   9 312.705  -4.913   0.676
  703    HA3  GLY   9           HA3      GLY   9 312.768  -3.205   1.078
  704    H    VAL  10           H        VAL  10 314.208  -5.785  -0.729
  705    HA   VAL  10           HA       VAL  10 315.327  -3.948  -2.630
  706    HB   VAL  10           HB       VAL  10 317.062  -4.235  -0.907
  707   HG11  VAL  10          HG11      VAL  10 316.260  -6.700  -0.555
  708   HG12  VAL  10          HG12      VAL  10 317.929  -6.226  -0.229
  709   HG13  VAL  10          HG13      VAL  10 317.526  -7.043  -1.738
  710   HG21  VAL  10          HG21      VAL  10 317.340  -4.419  -3.679
  711   HG22  VAL  10          HG22      VAL  10 318.436  -5.637  -3.027
  712   HG23  VAL  10          HG23      VAL  10 318.585  -3.955  -2.521
  713    H    LYS  11           H        LYS  11 313.436  -5.130  -3.590
  714    HA   LYS  11           HA       LYS  11 313.635  -7.876  -4.230
  715    HB2  LYS  11           HB2      LYS  11 311.940  -5.619  -5.015
  716    HB3  LYS  11           HB3      LYS  11 312.033  -6.967  -6.141
  717    HG2  LYS  11           HG2      LYS  11 310.410  -7.798  -4.858
  718    HG3  LYS  11           HG3      LYS  11 311.742  -8.328  -3.878
  719    HD2  LYS  11           HD2      LYS  11 309.904  -7.248  -2.587
  720    HD3  LYS  11           HD3      LYS  11 311.493  -6.516  -2.372
  721    HE2  LYS  11           HE2      LYS  11 310.194  -5.232  -4.549
  722    HE3  LYS  11           HE3      LYS  11 309.074  -5.286  -3.197
  723    HZ1  LYS  11           HZ3      LYS  11 310.199  -3.392  -2.694
  724    H    THR  12           H        THR  12 313.639  -5.217  -6.580
  725    HA   THR  12           HA       THR  12 316.108  -6.132  -7.780
  726    HB   THR  12           HB       THR  12 315.202  -6.715  -9.891
  727    HG1  THR  12           HG1      THR  12 312.778  -5.667  -8.880
  728   HG21  THR  12          HG21      THR  12 313.744  -8.562  -9.452
  729   HG22  THR  12          HG22      THR  12 313.313  -7.893  -7.874
  730   HG23  THR  12          HG23      THR  12 314.958  -8.459  -8.175
  731    H    GLU  13           H        GLU  13 313.365  -3.929  -7.815
  732    HA   GLU  13           HA       GLU  13 314.983  -1.637  -8.272
  733    HB2  GLU  13           HB2      GLU  13 313.166  -2.534 -10.527
  734    HB3  GLU  13           HB3      GLU  13 313.770  -0.895 -10.358
  735    HG2  GLU  13           HG2      GLU  13 315.465  -1.520 -11.626
  736    HG3  GLU  13           HG3      GLU  13 316.059  -2.411 -10.231
  737    H    ASN  14           H        ASN  14 313.512   0.334  -8.569
  738    HA   ASN  14           HA       ASN  14 311.890   1.657  -7.684
  739    HB2  ASN  14           HB2      ASN  14 310.676  -0.011  -9.308
  740    HB3  ASN  14           HB3      ASN  14 309.951  -0.565  -7.805
  741   HD21  ASN  14          HD21      ASN  14 308.571   0.787  -6.662
  742   HD22  ASN  14          HD22      ASN  14 307.886   2.207  -7.369
  743    H    ASP  15           H        ASP  15 310.277   1.902  -5.863
  744    HA   ASP  15           HA       ASP  15 309.634   1.661  -3.684
  745    HB2  ASP  15           HB2      ASP  15 310.184  -1.020  -4.483
  746    HB3  ASP  15           HB3      ASP  15 310.838  -0.784  -2.868
  747    H    HIS  16           H        HIS  16 311.133   3.375  -3.345
  748    HA   HIS  16           HA       HIS  16 313.564   3.826  -2.982
  749    HB2  HIS  16           HB2      HIS  16 311.431   4.390  -1.023
  750    HB3  HIS  16           HB3      HIS  16 313.071   4.718  -0.553
  751    HD1  HIS  16           HD1      HIS  16 310.404   5.891  -2.863
  752    HD2  HIS  16           HD2      HIS  16 314.328   6.819  -1.883
  753    HE1  HIS  16           HE1      HIS  16 310.855   8.124  -3.931
  754    HE2  HIS  16           HE2      HIS  16 313.210   8.700  -3.249
  755    H    ILE  17           H        ILE  17 315.248   3.728  -1.598
  756    HA   ILE  17           HA       ILE  17 315.374   1.687   0.475
  757    HB   ILE  17           HB       ILE  17 317.400   0.677  -0.299
  758   HG12  ILE  17          HG12      ILE  17 317.270   2.611  -2.613
  759   HG13  ILE  17          HG13      ILE  17 318.496   2.552  -1.368
  760   HG21  ILE  17          HG21      ILE  17 316.189  -0.785  -1.427
  761   HG22  ILE  17          HG22      ILE  17 316.285   0.234  -2.865
  762   HG23  ILE  17          HG23      ILE  17 314.958   0.441  -1.724
  763   HD11  ILE  17          HD11      ILE  17 318.338   1.109  -3.865
  764   HD12  ILE  17          HD12      ILE  17 318.614   0.043  -2.486
  765   HD13  ILE  17          HD13      ILE  17 319.718   1.393  -2.789
  766    H    ASN  18           H        ASN  18 317.389   1.988   1.801
  767    HA   ASN  18           HA       ASN  18 317.955   4.806   1.968
  768    HB2  ASN  18           HB2      ASN  18 317.596   3.051   3.929
  769    HB3  ASN  18           HB3      ASN  18 319.277   2.684   3.636
  770   HD21  ASN  18          HD21      ASN  18 317.610   5.776   3.520
  771   HD22  ASN  18          HD22      ASN  18 318.579   6.512   4.734
  772    H    LEU  19           H        LEU  19 319.862   5.684   1.334
  773    HA   LEU  19           HA       LEU  19 321.917   3.847   0.386
  774    HB2  LEU  19           HB2      LEU  19 320.659   6.085  -1.031
  775    HB3  LEU  19           HB3      LEU  19 322.407   6.209  -1.003
  776    HG   LEU  19           HG       LEU  19 320.785   3.843  -1.988
  777   HD11  LEU  19          HD11      LEU  19 321.187   6.026  -3.392
  778   HD12  LEU  19          HD12      LEU  19 321.223   4.421  -4.114
  779   HD13  LEU  19          HD13      LEU  19 322.726   5.240  -3.709
  780   HD21  LEU  19          HD21      LEU  19 323.642   3.790  -2.545
  781   HD22  LEU  19          HD22      LEU  19 322.562   2.520  -1.957
  782   HD23  LEU  19          HD23      LEU  19 323.272   3.681  -0.822
  783    H    LYS  20           H        LYS  20 324.105   4.867   0.388
  784    HA   LYS  20           HA       LYS  20 324.374   6.790   2.606
  785    HB2  LYS  20           HB2      LYS  20 324.897   4.090   2.860
  786    HB3  LYS  20           HB3      LYS  20 326.455   4.747   2.576
  787    HG2  LYS  20           HG2      LYS  20 326.367   6.043   4.431
  788    HG3  LYS  20           HG3      LYS  20 324.639   5.937   4.554
  789    HD2  LYS  20           HD2      LYS  20 326.494   4.462   5.960
  790    HD3  LYS  20           HD3      LYS  20 324.767   4.142   5.860
  791    HE2  LYS  20           HE2      LYS  20 325.062   2.327   4.579
  792    HE3  LYS  20           HE3      LYS  20 326.368   3.063   3.645
  793    HZ1  LYS  20           HZ1      LYS  20 326.653   1.988   6.396
  794    HZ2  LYS  20           HZ2      LYS  20 327.894   2.599   5.423
  795    HZ3  LYS  20           HZ3      LYS  20 327.106   1.167   4.987
  796    H    VAL  21           H        VAL  21 325.959   8.311   2.190
  797    HA   VAL  21           HA       VAL  21 327.738   7.749  -0.076
  798    HB   VAL  21           HB       VAL  21 327.141  10.578   0.660
  799   HG11  VAL  21          HG11      VAL  21 327.751  11.022  -1.547
  800   HG12  VAL  21          HG12      VAL  21 327.434   9.366  -2.065
  801   HG13  VAL  21          HG13      VAL  21 328.838   9.723  -1.057
  802   HG21  VAL  21          HG21      VAL  21 325.327   8.982  -1.155
  803   HG22  VAL  21          HG22      VAL  21 325.158  10.674  -0.689
  804   HG23  VAL  21          HG23      VAL  21 324.920   9.403   0.509
  805    H    ALA  22           H        ALA  22 329.837   7.837   0.342
  806    HA   ALA  22           HA       ALA  22 330.648   8.753   3.014
  807    HB1  ALA  22           HB1      ALA  22 331.944   6.940   3.111
  808    HB2  ALA  22           HB2      ALA  22 332.684   7.310   1.551
  809    HB3  ALA  22           HB3      ALA  22 331.174   6.393   1.618
  810    H    GLY  23           H        GLY  23 331.868  10.584   3.169
  811    HA2  GLY  23           HA2      GLY  23 332.943  11.603   0.626
  812    HA3  GLY  23           HA3      GLY  23 332.309  12.635   1.872
  813    H    GLN  24           H        GLN  24 334.948  11.799   0.340
  814    HA   GLN  24           HA       GLN  24 337.146  12.140   0.650
  815    HB2  GLN  24           HB2      GLN  24 336.197  13.315   3.228
  816    HB3  GLN  24           HB3      GLN  24 337.881  13.322   2.733
  817    HG2  GLN  24           HG2      GLN  24 337.078  14.441   0.594
  818    HG3  GLN  24           HG3      GLN  24 335.550  14.710   1.439
  819   HE21  GLN  24          HE21      GLN  24 335.508  16.098   3.219
  820   HE22  GLN  24          HE22      GLN  24 336.757  17.258   3.501
  821    H    ASP  25           H        ASP  25 335.541  10.595   3.402
  822    HA   ASP  25           HA       ASP  25 336.441   8.170   3.468
  823    HB2  ASP  25           HB2      ASP  25 338.741   8.617   3.043
  824    HB3  ASP  25           HB3      ASP  25 338.809   9.841   4.304
  825    H    GLY  26           H        GLY  26 337.040  10.905   5.645
  826    HA2  GLY  26           HA2      GLY  26 336.895  10.097   8.112
  827    HA3  GLY  26           HA3      GLY  26 335.848  11.406   7.602
  828    H    SER  27           H        SER  27 333.632  10.960   7.172
  829    HA   SER  27           HA       SER  27 332.698   8.438   8.389
  830    HB2  SER  27           HB2      SER  27 332.302  10.889   9.440
  831    HB3  SER  27           HB3      SER  27 330.892  10.791   8.387
  832    HG   SER  27           HG       SER  27 330.751   9.921  10.643
  833    H    VAL  28           H        VAL  28 329.929   9.160   7.779
  834    HA   VAL  28           HA       VAL  28 329.800   9.013   4.879
  835    HB   VAL  28           HB       VAL  28 330.142   6.712   5.409
  836   HG11  VAL  28          HG11      VAL  28 329.649   6.830   7.793
  837   HG12  VAL  28          HG12      VAL  28 328.791   5.491   7.029
  838   HG13  VAL  28          HG13      VAL  28 327.927   6.973   7.437
  839   HG21  VAL  28          HG21      VAL  28 328.124   5.678   4.548
  840   HG22  VAL  28          HG22      VAL  28 328.319   7.251   3.772
  841   HG23  VAL  28          HG23      VAL  28 327.148   7.054   5.078
  842    H    VAL  29           H        VAL  29 327.587   9.047   4.111
  843    HA   VAL  29           HA       VAL  29 325.690  10.200   6.040
  844    HB   VAL  29           HB       VAL  29 324.683  11.281   3.874
  845   HG11  VAL  29          HG11      VAL  29 327.080  12.441   5.274
  846   HG12  VAL  29          HG12      VAL  29 325.410  12.485   5.845
  847   HG13  VAL  29          HG13      VAL  29 325.863  13.348   4.371
  848   HG21  VAL  29          HG21      VAL  29 327.593  11.260   3.144
  849   HG22  VAL  29          HG22      VAL  29 326.245  11.920   2.217
  850   HG23  VAL  29          HG23      VAL  29 326.395  10.183   2.436
  851    H    GLN  30           H        GLN  30 323.505   9.699   5.629
  852    HA   GLN  30           HA       GLN  30 323.216   7.283   3.969
  853    HB2  GLN  30           HB2      GLN  30 322.609   7.816   6.727
  854    HB3  GLN  30           HB3      GLN  30 321.254   7.085   5.890
  855    HG2  GLN  30           HG2      GLN  30 322.890   5.326   5.112
  856    HG3  GLN  30           HG3      GLN  30 324.047   6.025   6.251
  857   HE21  GLN  30          HE21      GLN  30 321.934   3.593   5.869
  858   HE22  GLN  30          HE22      GLN  30 321.500   3.297   7.515
  859    H    PHE  31           H        PHE  31 322.142   7.736   2.262
  860    HA   PHE  31           HA       PHE  31 320.016   9.714   2.185
  861    HB2  PHE  31           HB2      PHE  31 321.511   8.121   0.078
  862    HB3  PHE  31           HB3      PHE  31 320.169   9.136  -0.311
  863    HD1  PHE  31           HD1      PHE  31 322.915   9.735   2.111
  864    HD2  PHE  31           HD2      PHE  31 321.042  10.909  -1.524
  865    HE1  PHE  31           HE1      PHE  31 324.389  11.686   1.986
  866    HE2  PHE  31           HE2      PHE  31 322.534  12.856  -1.649
  867    HZ   PHE  31           HZ       PHE  31 324.208  13.246   0.103
  868    H    LYS  32           H        LYS  32 318.119   9.107   0.802
  869    HA   LYS  32           HA       LYS  32 317.435   6.282   0.898
  870    HB2  LYS  32           HB2      LYS  32 316.179   6.830   2.767
  871    HB3  LYS  32           HB3      LYS  32 315.844   8.444   2.204
  872    HG2  LYS  32           HG2      LYS  32 314.558   6.927   0.328
  873    HG3  LYS  32           HG3      LYS  32 314.355   5.953   1.784
  874    HD2  LYS  32           HD2      LYS  32 313.870   8.817   2.189
  875    HD3  LYS  32           HD3      LYS  32 312.773   8.070   1.029
  876    HE2  LYS  32           HE2      LYS  32 311.590   7.218   2.712
  877    HE3  LYS  32           HE3      LYS  32 312.996   6.317   3.240
  878    HZ1  LYS  32           HZ1      LYS  32 313.436   8.860   4.140
  879    HZ2  LYS  32           HZ2      LYS  32 312.904   7.551   5.069
  880    HZ3  LYS  32           HZ3      LYS  32 311.780   8.620   4.396
  881    H    ILE  33           H        ILE  33 317.364   5.887  -1.106
  882    HA   ILE  33           HA       ILE  33 315.876   7.673  -2.891
  883    HB   ILE  33           HB       ILE  33 318.320   8.087  -3.121
  884   HG12  ILE  33          HG12      ILE  33 316.901   6.726  -5.433
  885   HG13  ILE  33          HG13      ILE  33 316.831   8.433  -5.023
  886   HG21  ILE  33          HG21      ILE  33 319.440   6.159  -2.623
  887   HG22  ILE  33          HG22      ILE  33 319.511   6.133  -4.387
  888   HG23  ILE  33          HG23      ILE  33 318.334   5.133  -3.540
  889   HD11  ILE  33          HD11      ILE  33 318.302   7.705  -6.967
  890   HD12  ILE  33          HD12      ILE  33 319.414   7.115  -5.728
  891   HD13  ILE  33          HD13      ILE  33 318.981   8.824  -5.783
  892    H    LYS  34           H        LYS  34 314.816   6.620  -4.607
  893    HA   LYS  34           HA       LYS  34 314.105   3.953  -4.037
  894    HB2  LYS  34           HB2      LYS  34 312.653   5.671  -5.189
  895    HB3  LYS  34           HB3      LYS  34 313.590   5.350  -6.632
  896    HG2  LYS  34           HG2      LYS  34 312.938   2.897  -6.301
  897    HG3  LYS  34           HG3      LYS  34 311.730   3.509  -5.172
  898    HD2  LYS  34           HD2      LYS  34 310.762   3.226  -7.381
  899    HD3  LYS  34           HD3      LYS  34 310.811   4.931  -6.944
  900    HE2  LYS  34           HE2      LYS  34 311.973   5.384  -8.783
  901    HE3  LYS  34           HE3      LYS  34 313.242   4.282  -8.272
  902    HZ1  LYS  34           HZ1      LYS  34 311.888   3.930 -10.492
  903    HZ2  LYS  34           HZ2      LYS  34 310.851   3.100  -9.448
  904    HZ3  LYS  34           HZ3      LYS  34 312.467   2.626  -9.582
  905    H    ARG  35           H        ARG  35 314.351   3.688  -7.269
  906    HA   ARG  35           HA       ARG  35 317.077   2.625  -7.133
  907    HB2  ARG  35           HB2      ARG  35 314.542   1.202  -7.817
  908    HB3  ARG  35           HB3      ARG  35 316.085   0.611  -8.368
  909    HG2  ARG  35           HG2      ARG  35 316.007   1.196  -5.518
  910    HG3  ARG  35           HG3      ARG  35 314.893  -0.063  -6.039
  911    HD2  ARG  35           HD2      ARG  35 316.609  -1.393  -6.894
  912    HD3  ARG  35           HD3      ARG  35 317.756  -0.068  -6.868
  913    HE   ARG  35           HE       ARG  35 318.260  -0.647  -4.725
  914   HH11  ARG  35          HH11      ARG  35 315.097  -1.897  -5.502
  915   HH12  ARG  35          HH12      ARG  35 314.916  -2.727  -3.996
  916   HH21  ARG  35          HH21      ARG  35 318.031  -1.751  -2.752
  917   HH22  ARG  35          HH22      ARG  35 316.586  -2.640  -2.427
  918    H    HIS  36           H        HIS  36 314.423   2.537  -9.518
  919    HA   HIS  36           HA       HIS  36 316.183   2.957 -11.697
  920    HB2  HIS  36           HB2      HIS  36 314.252   1.791 -12.265
  921    HB3  HIS  36           HB3      HIS  36 313.200   2.870 -11.365
  922    HD1  HIS  36           HD1      HIS  36 312.234   4.867 -12.617
  923    HD2  HIS  36           HD2      HIS  36 315.001   2.716 -14.847
  924    HE1  HIS  36           HE1      HIS  36 312.049   5.761 -14.960
  925    HE2  HIS  36           HE2      HIS  36 313.677   4.390 -16.308
  926    H    THR  37           H        THR  37 315.838   5.040  -9.432
  927    HA   THR  37           HA       THR  37 315.306   7.427 -11.054
  928    HB   THR  37           HB       THR  37 315.443   6.907  -8.103
  929    HG1  THR  37           HG1      THR  37 313.389   7.035  -8.519
  930   HG21  THR  37          HG21      THR  37 315.045   9.545  -8.112
  931   HG22  THR  37          HG22      THR  37 316.172   9.423  -9.471
  932   HG23  THR  37          HG23      THR  37 316.627   8.800  -7.879
  933    HA   PRO  38           HA       PRO  38 319.618   8.010 -12.050
  934    HB2  PRO  38           HB2      PRO  38 318.726  10.800 -11.702
  935    HB3  PRO  38           HB3      PRO  38 319.520  10.032 -13.088
  936    HG2  PRO  38           HG2      PRO  38 316.772  10.607 -12.825
  937    HG3  PRO  38           HG3      PRO  38 317.531   9.607 -14.070
  938    HD2  PRO  38           HD2      PRO  38 315.767   8.813 -12.033
  939    HD3  PRO  38           HD3      PRO  38 316.662   7.771 -13.147
  940    H    LEU  39           H        LEU  39 321.429   8.613 -10.875
  941    HA   LEU  39           HA       LEU  39 320.983   8.933  -8.063
  942    HB2  LEU  39           HB2      LEU  39 323.350   8.411  -9.773
  943    HB3  LEU  39           HB3      LEU  39 323.606   9.026  -8.146
  944    HG   LEU  39           HG       LEU  39 321.931   6.594  -8.759
  945   HD11  LEU  39          HD11      LEU  39 324.048   5.548  -7.573
  946   HD12  LEU  39          HD12      LEU  39 324.846   6.910  -8.347
  947   HD13  LEU  39          HD13      LEU  39 323.967   5.733  -9.322
  948   HD21  LEU  39          HD21      LEU  39 323.190   6.945  -6.132
  949   HD22  LEU  39          HD22      LEU  39 321.557   6.433  -6.545
  950   HD23  LEU  39          HD23      LEU  39 321.963   8.149  -6.522
  951    H    SER  40           H        SER  40 321.558  11.191 -10.652
  952    HA   SER  40           HA       SER  40 322.988  13.169  -9.418
  953    HB2  SER  40           HB2      SER  40 320.876  13.083 -11.510
  954    HB3  SER  40           HB3      SER  40 321.282  14.660 -10.829
  955    HG   SER  40           HG       SER  40 322.597  14.214 -12.615
  956    H    LYS  41           H        LYS  41 319.906  11.994  -8.464
  957    HA   LYS  41           HA       LYS  41 319.017  14.401  -7.184
  958    HB2  LYS  41           HB2      LYS  41 318.118  11.605  -7.508
  959    HB3  LYS  41           HB3      LYS  41 317.420  12.554  -6.239
  960    HG2  LYS  41           HG2      LYS  41 316.143  13.732  -7.653
  961    HG3  LYS  41           HG3      LYS  41 317.450  13.885  -8.831
  962    HD2  LYS  41           HD2      LYS  41 316.554  11.161  -8.611
  963    HD3  LYS  41           HD3      LYS  41 315.211  12.228  -9.015
  964    HE2  LYS  41           HE2      LYS  41 317.570  12.874 -10.546
  965    HE3  LYS  41           HE3      LYS  41 317.132  11.175 -10.731
  966    HZ1  LYS  41           HZ1      LYS  41 315.279  11.691 -11.859
  967    HZ2  LYS  41           HZ2      LYS  41 316.054  13.166 -12.153
  968    HZ3  LYS  41           HZ3      LYS  41 314.923  13.040 -10.901
  969    H    LEU  42           H        LEU  42 320.900  11.640  -6.568
  970    HA   LEU  42           HA       LEU  42 320.899  11.804  -3.683
  971    HB2  LEU  42           HB2      LEU  42 320.777   9.657  -4.872
  972    HB3  LEU  42           HB3      LEU  42 322.288  10.008  -5.680
  973    HG   LEU  42           HG       LEU  42 322.061   9.675  -2.699
  974   HD11  LEU  42          HD11      LEU  42 323.224   7.550  -4.365
  975   HD12  LEU  42          HD12      LEU  42 321.467   7.697  -4.381
  976   HD13  LEU  42          HD13      LEU  42 322.320   7.452  -2.856
  977   HD21  LEU  42          HD21      LEU  42 324.170  10.365  -4.584
  978   HD22  LEU  42          HD22      LEU  42 324.574   8.940  -3.620
  979   HD23  LEU  42          HD23      LEU  42 324.165  10.460  -2.817
  980    H    MET  43           H        MET  43 322.935  12.442  -6.451
  981    HA   MET  43           HA       MET  43 325.372  12.866  -5.131
  982    HB2  MET  43           HB2      MET  43 324.760  14.323  -7.661
  983    HB3  MET  43           HB3      MET  43 326.254  13.551  -7.153
  984    HG2  MET  43           HG2      MET  43 323.750  12.100  -7.946
  985    HG3  MET  43           HG3      MET  43 325.129  12.377  -8.996
  986    HE1  MET  43           HE1      MET  43 326.475  10.294  -9.516
  987    HE2  MET  43           HE2      MET  43 327.534   9.703  -8.236
  988    HE3  MET  43           HE3      MET  43 327.474  11.425  -8.603
  989    H    LYS  44           H        LYS  44 322.774  15.151  -5.750
  990    HA   LYS  44           HA       LYS  44 324.443  17.413  -4.929
  991    HB2  LYS  44           HB2      LYS  44 322.817  17.740  -6.698
  992    HB3  LYS  44           HB3      LYS  44 321.517  17.362  -5.577
  993    HG2  LYS  44           HG2      LYS  44 322.140  19.848  -6.104
  994    HG3  LYS  44           HG3      LYS  44 321.690  19.370  -4.479
  995    HD2  LYS  44           HD2      LYS  44 323.582  20.339  -3.836
  996    HD3  LYS  44           HD3      LYS  44 324.428  19.016  -4.575
  997    HE2  LYS  44           HE2      LYS  44 325.411  20.891  -5.515
  998    HE3  LYS  44           HE3      LYS  44 324.288  20.316  -6.742
  999    HZ1  LYS  44           HZ1      LYS  44 323.513  22.391  -6.751
 1000    HZ2  LYS  44           HZ2      LYS  44 324.311  22.803  -5.318
 1001    HZ3  LYS  44           HZ3      LYS  44 322.800  22.046  -5.255
 1002    H    ALA  45           H        ALA  45 322.349  15.180  -3.331
 1003    HA   ALA  45           HA       ALA  45 321.491  16.932  -1.250
 1004    HB1  ALA  45           HB1      ALA  45 320.294  15.117  -0.755
 1005    HB2  ALA  45           HB2      ALA  45 321.764  14.406  -0.073
 1006    HB3  ALA  45           HB3      ALA  45 321.315  14.093  -1.761
 1007    H    TYR  46           H        TYR  46 324.141  14.617  -1.583
 1008    HA   TYR  46           HA       TYR  46 325.352  15.075   0.856
 1009    HB2  TYR  46           HB2      TYR  46 325.917  13.342  -1.033
 1010    HB3  TYR  46           HB3      TYR  46 327.073  14.578  -1.527
 1011    HD1  TYR  46           HD1      TYR  46 326.299  14.464   1.983
 1012    HD2  TYR  46           HD2      TYR  46 328.855  12.871  -1.029
 1013    HE1  TYR  46           HE1      TYR  46 327.811  13.691   3.710
 1014    HE2  TYR  46           HE2      TYR  46 330.392  12.058   0.718
 1015    HH   TYR  46           HH       TYR  46 329.620  11.735   3.855
 1016    H    CYS  47           H        CYS  47 325.237  17.082  -1.935
 1017    HA   CYS  47           HA       CYS  47 327.556  18.639  -1.297
 1018    HB2  CYS  47           HB2      CYS  47 325.160  19.162  -3.054
 1019    HB3  CYS  47           HB3      CYS  47 326.695  19.983  -3.145
 1020    HG   CYS  47           HG       CYS  47 327.728  18.012  -4.266
 1021    H    GLU  48           H        GLU  48 324.061  19.284  -1.496
 1022    HA   GLU  48           HA       GLU  48 324.042  21.640  -0.072
 1023    HB2  GLU  48           HB2      GLU  48 321.804  19.651   0.120
 1024    HB3  GLU  48           HB3      GLU  48 321.709  21.407   0.099
 1025    HG2  GLU  48           HG2      GLU  48 322.631  21.245  -2.304
 1026    HG3  GLU  48           HG3      GLU  48 322.252  19.549  -2.172
 1027    H    ARG  49           H        ARG  49 324.697  18.466   0.940
 1028    HA   ARG  49           HA       ARG  49 324.050  18.702   3.720
 1029    HB2  ARG  49           HB2      ARG  49 324.842  16.689   1.807
 1030    HB3  ARG  49           HB3      ARG  49 325.789  16.562   3.262
 1031    HG2  ARG  49           HG2      ARG  49 324.006  15.902   4.524
 1032    HG3  ARG  49           HG3      ARG  49 322.865  16.820   3.543
 1033    HD2  ARG  49           HD2      ARG  49 324.137  14.709   2.027
 1034    HD3  ARG  49           HD3      ARG  49 323.286  14.090   3.423
 1035    HE   ARG  49           HE       ARG  49 322.045  15.671   1.293
 1036   HH11  ARG  49          HH11      ARG  49 321.778  13.477   4.004
 1037   HH12  ARG  49          HH12      ARG  49 320.080  13.230   3.789
 1038   HH21  ARG  49          HH21      ARG  49 319.802  15.363   1.043
 1039   HH22  ARG  49          HH22      ARG  49 318.961  14.300   2.121
 1040    H    GLN  50           H        GLN  50 326.995  18.485   1.731
 1041    HA   GLN  50           HA       GLN  50 328.657  19.277   4.010
 1042    HB2  GLN  50           HB2      GLN  50 329.530  18.254   1.359
 1043    HB3  GLN  50           HB3      GLN  50 330.524  18.418   2.772
 1044    HG2  GLN  50           HG2      GLN  50 329.096  16.691   3.871
 1045    HG3  GLN  50           HG3      GLN  50 328.301  16.458   2.315
 1046   HE21  GLN  50          HE21      GLN  50 329.314  15.353   0.727
 1047   HE22  GLN  50          HE22      GLN  50 330.849  14.588   0.901
 1048    H    GLY  51           H        GLY  51 327.694  20.249   0.834
 1049    HA2  GLY  51           HA2      GLY  51 327.753  22.541   0.116
 1050    HA3  GLY  51           HA3      GLY  51 329.178  22.775   1.132
 1051    H    LEU  52           H        LEU  52 328.182  20.457  -1.357
 1052    HA   LEU  52           HA       LEU  52 330.810  20.774  -2.641
 1053    HB2  LEU  52           HB2      LEU  52 329.003  18.384  -2.835
 1054    HB3  LEU  52           HB3      LEU  52 330.688  18.507  -3.282
 1055    HG   LEU  52           HG       LEU  52 330.094  19.059  -0.457
 1056   HD11  LEU  52          HD11      LEU  52 329.253  17.102   0.155
 1057   HD12  LEU  52          HD12      LEU  52 330.308  16.206  -0.940
 1058   HD13  LEU  52          HD13      LEU  52 328.801  16.901  -1.542
 1059   HD21  LEU  52          HD21      LEU  52 332.306  18.911  -1.777
 1060   HD22  LEU  52          HD22      LEU  52 332.100  17.160  -1.555
 1061   HD23  LEU  52          HD23      LEU  52 332.199  18.223  -0.145
 1062    H    SER  53           H        SER  53 330.865  21.411  -4.706
 1063    HA   SER  53           HA       SER  53 328.807  22.533  -6.060
 1064    HB2  SER  53           HB2      SER  53 330.622  21.094  -7.876
 1065    HB3  SER  53           HB3      SER  53 330.267  22.816  -7.757
 1066    HG   SER  53           HG       SER  53 332.035  23.032  -6.666
 1067    H    MET  54           H        MET  54 329.271  19.125  -5.695
 1068    HA   MET  54           HA       MET  54 327.789  17.413  -6.099
 1069    HB2  MET  54           HB2      MET  54 325.864  18.928  -6.179
 1070    HB3  MET  54           HB3      MET  54 326.240  19.379  -7.809
 1071    HG2  MET  54           HG2      MET  54 326.098  16.704  -8.048
 1072    HG3  MET  54           HG3      MET  54 324.901  17.007  -6.797
 1073    HE1  MET  54           HE1      MET  54 326.245  18.974  -9.738
 1074    HE2  MET  54           HE2      MET  54 324.872  19.208 -10.821
 1075    HE3  MET  54           HE3      MET  54 325.692  17.647 -10.760
 1076    H    ARG  55           H        ARG  55 328.747  19.435  -8.754
 1077    HA   ARG  55           HA       ARG  55 329.035  17.149 -10.514
 1078    HB2  ARG  55           HB2      ARG  55 330.075  19.316 -11.849
 1079    HB3  ARG  55           HB3      ARG  55 328.397  18.793 -11.931
 1080    HG2  ARG  55           HG2      ARG  55 327.768  20.356 -10.204
 1081    HG3  ARG  55           HG3      ARG  55 329.458  20.810  -9.963
 1082    HD2  ARG  55           HD2      ARG  55 327.651  21.434 -12.270
 1083    HD3  ARG  55           HD3      ARG  55 328.611  22.529 -11.278
 1084    HE   ARG  55           HE       ARG  55 330.465  22.065 -12.577
 1085   HH11  ARG  55          HH11      ARG  55 327.835  19.941 -13.460
 1086   HH12  ARG  55          HH12      ARG  55 328.599  19.403 -14.917
 1087   HH21  ARG  55          HH21      ARG  55 331.466  21.352 -14.490
 1088   HH22  ARG  55          HH22      ARG  55 330.658  20.202 -15.502
 1089    H    GLN  56           H        GLN  56 330.881  19.200  -8.404
 1090    HA   GLN  56           HA       GLN  56 333.417  18.617  -9.564
 1091    HB2  GLN  56           HB2      GLN  56 332.331  20.207  -7.334
 1092    HB3  GLN  56           HB3      GLN  56 333.989  19.644  -7.139
 1093    HG2  GLN  56           HG2      GLN  56 334.596  20.678  -9.263
 1094    HG3  GLN  56           HG3      GLN  56 332.936  21.234  -9.467
 1095   HE21  GLN  56          HE21      GLN  56 335.288  21.245  -6.804
 1096   HE22  GLN  56          HE22      GLN  56 335.140  22.931  -6.455
 1097    H    ILE  57           H        ILE  57 331.482  17.207  -6.962
 1098    HA   ILE  57           HA       ILE  57 333.703  15.795  -5.833
 1099    HB   ILE  57           HB       ILE  57 331.961  14.298  -4.783
 1100   HG12  ILE  57          HG12      ILE  57 330.256  16.106  -6.340
 1101   HG13  ILE  57          HG13      ILE  57 329.945  14.475  -5.756
 1102   HG21  ILE  57          HG21      ILE  57 331.736  17.172  -4.021
 1103   HG22  ILE  57          HG22      ILE  57 333.139  16.166  -3.659
 1104   HG23  ILE  57          HG23      ILE  57 331.555  15.748  -2.991
 1105   HD11  ILE  57          HD11      ILE  57 329.793  17.010  -4.176
 1106   HD12  ILE  57          HD12      ILE  57 329.559  15.383  -3.515
 1107   HD13  ILE  57          HD13      ILE  57 328.435  16.017  -4.722
 1108    H    ARG  58           H        ARG  58 333.559  13.367  -5.667
 1109    HA   ARG  58           HA       ARG  58 332.838  12.230  -8.265
 1110    HB2  ARG  58           HB2      ARG  58 335.179  11.034  -6.990
 1111    HB3  ARG  58           HB3      ARG  58 334.925  11.513  -8.664
 1112    HG2  ARG  58           HG2      ARG  58 335.480  13.509  -6.493
 1113    HG3  ARG  58           HG3      ARG  58 336.764  12.709  -7.387
 1114    HD2  ARG  58           HD2      ARG  58 335.987  13.646  -9.434
 1115    HD3  ARG  58           HD3      ARG  58 334.545  14.279  -8.670
 1116    HE   ARG  58           HE       ARG  58 335.773  16.093  -8.038
 1117   HH11  ARG  58          HH11      ARG  58 337.971  13.475  -8.738
 1118   HH12  ARG  58          HH12      ARG  58 339.390  14.444  -8.526
 1119   HH21  ARG  58          HH21      ARG  58 337.641  17.370  -7.761
 1120   HH22  ARG  58          HH22      ARG  58 339.203  16.653  -7.973
 1121    H    PHE  59           H        PHE  59 331.374  10.640  -7.891
 1122    HA   PHE  59           HA       PHE  59 331.373   9.388  -5.244
 1123    HB2  PHE  59           HB2      PHE  59 329.252   9.603  -7.366
 1124    HB3  PHE  59           HB3      PHE  59 329.117   8.518  -6.011
 1125    HD1  PHE  59           HD2      PHE  59 330.656  11.812  -5.500
 1126    HD2  PHE  59           HD1      PHE  59 327.061   9.540  -5.371
 1127    HE1  PHE  59           HE2      PHE  59 329.582  13.564  -4.166
 1128    HE2  PHE  59           HE1      PHE  59 325.990  11.299  -4.054
 1129    HZ   PHE  59           HZ       PHE  59 327.252  13.323  -3.441
 1130    H    ARG  60           H        ARG  60 331.029   7.073  -5.094
 1131    HA   ARG  60           HA       ARG  60 331.318   5.534  -7.496
 1132    HB2  ARG  60           HB2      ARG  60 333.684   6.169  -6.338
 1133    HB3  ARG  60           HB3      ARG  60 333.277   4.719  -5.436
 1134    HG2  ARG  60           HG2      ARG  60 332.748   3.924  -7.971
 1135    HG3  ARG  60           HG3      ARG  60 334.085   5.037  -8.232
 1136    HD2  ARG  60           HD2      ARG  60 335.482   3.808  -6.720
 1137    HD3  ARG  60           HD3      ARG  60 334.128   2.796  -6.226
 1138    HE   ARG  60           HE       ARG  60 334.278   2.344  -8.881
 1139   HH11  ARG  60          HH11      ARG  60 336.650   2.241  -6.323
 1140   HH12  ARG  60          HH12      ARG  60 337.605   1.017  -7.088
 1141   HH21  ARG  60          HH21      ARG  60 335.532   0.733  -9.888
 1142   HH22  ARG  60          HH22      ARG  60 336.972   0.161  -9.112
 1143    H    PHE  61           H        PHE  61 330.508   3.563  -7.307
 1144    HA   PHE  61           HA       PHE  61 329.351   2.817  -4.722
 1145    HB2  PHE  61           HB2      PHE  61 327.629   3.224  -6.392
 1146    HB3  PHE  61           HB3      PHE  61 328.410   2.119  -7.504
 1147    HD1  PHE  61           HD1      PHE  61 326.674   2.364  -4.270
 1148    HD2  PHE  61           HD2      PHE  61 328.006  -0.227  -7.375
 1149    HE1  PHE  61           HE1      PHE  61 325.358   0.521  -3.301
 1150    HE2  PHE  61           HE2      PHE  61 326.694  -2.067  -6.412
 1151    HZ   PHE  61           HZ       PHE  61 325.367  -1.696  -4.371
 1152    H    ASP  62           H        ASP  62 329.426   0.416  -4.286
 1153    HA   ASP  62           HA       ASP  62 331.868  -0.599  -4.228
 1154    HB2  ASP  62           HB2      ASP  62 329.404  -1.589  -3.694
 1155    HB3  ASP  62           HB3      ASP  62 329.980  -2.664  -4.950
 1156    H    GLY  63           H        GLY  63 333.333  -0.588  -5.688
 1157    HA2  GLY  63           HA2      GLY  63 334.583  -1.134  -7.498
 1158    HA3  GLY  63           HA3      GLY  63 333.450  -2.441  -7.786
 1159    H    GLN  64           H        GLN  64 331.641   0.331  -7.905
 1160    HA   GLN  64           HA       GLN  64 332.270   0.796 -10.734
 1161    HB2  GLN  64           HB2      GLN  64 330.400  -0.126 -11.450
 1162    HB3  GLN  64           HB3      GLN  64 330.060  -0.646  -9.807
 1163    HG2  GLN  64           HG2      GLN  64 329.285   2.025  -9.910
 1164    HG3  GLN  64           HG3      GLN  64 328.741   1.325 -11.417
 1165   HE21  GLN  64          HE21      GLN  64 327.337   2.219  -8.939
 1166   HE22  GLN  64          HE22      GLN  64 326.355   0.881  -8.475
 1167    HA   PRO  65           HA       PRO  65 331.512   5.080  -9.773
 1168    HB2  PRO  65           HB2      PRO  65 331.634   5.655 -12.572
 1169    HB3  PRO  65           HB3      PRO  65 332.962   5.763 -11.419
 1170    HG2  PRO  65           HG2      PRO  65 332.876   4.001 -13.504
 1171    HG3  PRO  65           HG3      PRO  65 333.738   3.673 -11.985
 1172    HD2  PRO  65           HD2      PRO  65 330.945   2.858 -12.766
 1173    HD3  PRO  65           HD3      PRO  65 332.251   1.867 -12.124
 1174    H    ILE  66           H        ILE  66 329.618   6.253  -9.551
 1175    HA   ILE  66           HA       ILE  66 327.423   5.484 -11.327
 1176    HB   ILE  66           HB       ILE  66 325.917   6.170  -9.747
 1177   HG12  ILE  66          HG12      ILE  66 328.280   7.358  -8.418
 1178   HG13  ILE  66          HG13      ILE  66 326.644   7.971  -8.575
 1179   HG21  ILE  66          HG21      ILE  66 327.366   3.960  -9.613
 1180   HG22  ILE  66          HG22      ILE  66 326.124   4.322  -8.405
 1181   HG23  ILE  66          HG23      ILE  66 327.821   4.650  -8.052
 1182   HD11  ILE  66          HD11      ILE  66 326.974   7.529  -6.292
 1183   HD12  ILE  66          HD12      ILE  66 327.674   5.941  -6.624
 1184   HD13  ILE  66          HD13      ILE  66 325.955   6.226  -6.897
 1185    H    ASN  67           H        ASN  67 328.731   6.917 -12.594
 1186    HA   ASN  67           HA       ASN  67 329.000   9.589 -12.647
 1187    HB2  ASN  67           HB2      ASN  67 327.840   8.452 -15.130
 1188    HB3  ASN  67           HB3      ASN  67 329.194   9.554 -14.944
 1189   HD21  ASN  67          HD21      ASN  67 328.727   6.847 -16.284
 1190   HD22  ASN  67          HD22      ASN  67 330.087   5.907 -15.780
 1191    H    GLU  68           H        GLU  68 327.219  10.189 -11.275
 1192    HA   GLU  68           HA       GLU  68 325.224  11.116 -10.751
 1193    HB2  GLU  68           HB2      GLU  68 324.975  12.754 -13.097
 1194    HB3  GLU  68           HB3      GLU  68 325.361  13.193 -11.439
 1195    HG2  GLU  68           HG2      GLU  68 327.646  12.926 -11.771
 1196    HG3  GLU  68           HG3      GLU  68 327.402  11.997 -13.246
 1197    H    THR  69           H        THR  69 325.034   9.727 -13.997
 1198    HA   THR  69           HA       THR  69 322.140  10.009 -13.936
 1199    HB   THR  69           HB       THR  69 322.137   9.452 -16.228
 1200    HG1  THR  69           HG1      THR  69 323.558   7.720 -16.256
 1201   HG21  THR  69          HG21      THR  69 324.717  10.943 -16.000
 1202   HG22  THR  69          HG22      THR  69 323.180  11.670 -15.526
 1203   HG23  THR  69          HG23      THR  69 323.422  11.126 -17.188
 1204    H    ASP  70           H        ASP  70 324.487   7.733 -13.078
 1205    HA   ASP  70           HA       ASP  70 323.131   5.341 -13.753
 1206    HB2  ASP  70           HB2      ASP  70 325.026   5.711 -11.440
 1207    HB3  ASP  70           HB3      ASP  70 324.743   4.272 -12.368
 1208    H    THR  71           H        THR  71 321.262   4.641 -12.865
 1209    HA   THR  71           HA       THR  71 320.430   5.794 -10.313
 1210    HB   THR  71           HB       THR  71 318.276   5.216 -10.818
 1211    HG1  THR  71           HG1      THR  71 318.939   3.207 -12.664
 1212   HG21  THR  71          HG21      THR  71 319.153   6.602 -12.721
 1213   HG22  THR  71          HG22      THR  71 317.729   5.630 -13.087
 1214   HG23  THR  71          HG23      THR  71 319.320   5.101 -13.634
 1215    HA   PRO  72           HA       PRO  72 322.022   2.566  -7.883
 1216    HB2  PRO  72           HB2      PRO  72 319.496   2.121  -6.493
 1217    HB3  PRO  72           HB3      PRO  72 321.044   2.728  -5.887
 1218    HG2  PRO  72           HG2      PRO  72 318.702   4.236  -6.508
 1219    HG3  PRO  72           HG3      PRO  72 320.266   4.824  -5.929
 1220    HD2  PRO  72           HD2      PRO  72 319.135   5.227  -8.482
 1221    HD3  PRO  72           HD3      PRO  72 320.781   5.612  -7.959
 1222    H    ALA  73           H        ALA  73 318.608   1.798  -8.718
 1223    HA   ALA  73           HA       ALA  73 318.739  -0.939  -8.840
 1224    HB1  ALA  73           HB1      ALA  73 317.039   1.045  -9.998
 1225    HB2  ALA  73           HB2      ALA  73 316.681  -0.649  -9.651
 1226    HB3  ALA  73           HB3      ALA  73 317.371  -0.190 -11.207
 1227    H    GLN  74           H        GLN  74 319.481   1.269 -11.510
 1228    HA   GLN  74           HA       GLN  74 320.284  -0.492 -13.415
 1229    HB2  GLN  74           HB2      GLN  74 320.635   2.268 -12.834
 1230    HB3  GLN  74           HB3      GLN  74 322.044   1.632 -13.635
 1231    HG2  GLN  74           HG2      GLN  74 320.763   0.941 -15.502
 1232    HG3  GLN  74           HG3      GLN  74 319.251   1.272 -14.655
 1233   HE21  GLN  74          HE21      GLN  74 318.302   3.118 -15.096
 1234   HE22  GLN  74          HE22      GLN  74 319.057   4.520 -15.767
 1235    H    LEU  75           H        LEU  75 321.979   0.580 -10.551
 1236    HA   LEU  75           HA       LEU  75 324.264  -1.112 -11.251
 1237    HB2  LEU  75           HB2      LEU  75 324.465   0.868  -9.066
 1238    HB3  LEU  75           HB3      LEU  75 325.648   0.390 -10.264
 1239    HG   LEU  75           HG       LEU  75 323.333   2.266 -10.760
 1240   HD11  LEU  75          HD11      LEU  75 326.124   3.159 -10.945
 1241   HD12  LEU  75          HD12      LEU  75 325.497   2.846  -9.327
 1242   HD13  LEU  75          HD13      LEU  75 324.686   4.006 -10.374
 1243   HD21  LEU  75          HD21      LEU  75 323.775   2.169 -12.933
 1244   HD22  LEU  75          HD22      LEU  75 324.710   0.711 -12.584
 1245   HD23  LEU  75          HD23      LEU  75 325.514   2.286 -12.661
 1246    H    GLU  76           H        GLU  76 321.813  -2.076 -10.170
 1247    HA   GLU  76           HA       GLU  76 320.819  -2.988  -8.333
 1248    HB2  GLU  76           HB2      GLU  76 323.438  -4.457  -8.552
 1249    HB3  GLU  76           HB3      GLU  76 321.955  -5.092  -7.848
 1250    HG2  GLU  76           HG2      GLU  76 320.927  -4.525 -10.162
 1251    HG3  GLU  76           HG3      GLU  76 322.605  -4.531 -10.705
 1252    H    MET  77           H        MET  77 321.610  -0.744  -7.130
 1253    HA   MET  77           HA       MET  77 323.376  -1.127  -4.909
 1254    HB2  MET  77           HB2      MET  77 321.230   0.884  -5.556
 1255    HB3  MET  77           HB3      MET  77 322.119   0.948  -4.033
 1256    HG2  MET  77           HG2      MET  77 324.125   0.681  -5.865
 1257    HG3  MET  77           HG3      MET  77 322.956   1.647  -6.750
 1258    HE1  MET  77           HE1      MET  77 323.923   3.674  -7.111
 1259    HE2  MET  77           HE2      MET  77 325.543   3.251  -6.526
 1260    HE3  MET  77           HE3      MET  77 324.760   4.742  -5.974
 1261    H    GLU  78           H        GLU  78 322.182  -0.611  -2.583
 1262    HA   GLU  78           HA       GLU  78 319.759  -2.170  -2.340
 1263    HB2  GLU  78           HB2      GLU  78 322.429  -3.115  -1.424
 1264    HB3  GLU  78           HB3      GLU  78 321.047  -3.425  -0.385
 1265    HG2  GLU  78           HG2      GLU  78 320.304  -5.064  -1.684
 1266    HG3  GLU  78           HG3      GLU  78 320.521  -4.115  -3.152
 1267    H    ASP  79           H        ASP  79 319.239  -2.354   0.129
 1268    HA   ASP  79           HA       ASP  79 318.972   0.265   1.114
 1269    HB2  ASP  79           HB2      ASP  79 317.714  -2.050   1.638
 1270    HB3  ASP  79           HB3      ASP  79 318.767  -1.945   3.042
 1271    H    GLU  80           H        GLU  80 320.158   1.463   2.463
 1272    HA   GLU  80           HA       GLU  80 321.842   2.159   3.813
 1273    HB2  GLU  80           HB2      GLU  80 322.585  -0.676   4.421
 1274    HB3  GLU  80           HB3      GLU  80 322.738   0.750   5.434
 1275    HG2  GLU  80           HG2      GLU  80 320.294   0.870   5.623
 1276    HG3  GLU  80           HG3      GLU  80 320.166  -0.595   4.656
 1277    H    ASP  81           H        ASP  81 322.336   0.541   0.970
 1278    HA   ASP  81           HA       ASP  81 325.021  -0.071   0.914
 1279    HB2  ASP  81           HB2      ASP  81 323.063   0.804  -1.121
 1280    HB3  ASP  81           HB3      ASP  81 324.743   0.988  -1.564
 1281    H    THR  82           H        THR  82 326.705   1.236  -0.155
 1282    HA   THR  82           HA       THR  82 326.541   4.037   0.756
 1283    HB   THR  82           HB       THR  82 329.136   2.523   0.695
 1284    HG1  THR  82           HG1      THR  82 328.789   2.179   2.940
 1285   HG21  THR  82          HG21      THR  82 328.180   4.957   2.183
 1286   HG22  THR  82          HG22      THR  82 329.378   4.910   0.878
 1287   HG23  THR  82          HG23      THR  82 329.738   4.168   2.442
 1288    H    ILE  83           H        ILE  83 327.927   5.557  -0.318
 1289    HA   ILE  83           HA       ILE  83 328.827   4.814  -3.003
 1290    HB   ILE  83           HB       ILE  83 326.919   7.031  -2.248
 1291   HG12  ILE  83          HG12      ILE  83 326.495   5.241  -4.582
 1292   HG13  ILE  83          HG13      ILE  83 326.305   4.537  -2.977
 1293   HG21  ILE  83          HG21      ILE  83 327.111   7.892  -4.518
 1294   HG22  ILE  83          HG22      ILE  83 328.334   6.684  -4.901
 1295   HG23  ILE  83          HG23      ILE  83 328.677   7.944  -3.716
 1296   HD11  ILE  83          HD11      ILE  83 324.398   5.905  -4.396
 1297   HD12  ILE  83          HD12      ILE  83 324.965   7.083  -3.213
 1298   HD13  ILE  83          HD13      ILE  83 324.355   5.518  -2.676
 1299    H    ASP  84           H        ASP  84 331.000   5.177  -2.540
 1300    HA   ASP  84           HA       ASP  84 331.897   7.155  -0.796
 1301    HB2  ASP  84           HB2      ASP  84 333.011   5.041  -2.301
 1302    HB3  ASP  84           HB3      ASP  84 333.973   6.486  -2.587
 1303    H    VAL  85           H        VAL  85 332.542   9.095  -0.950
 1304    HA   VAL  85           HA       VAL  85 332.551  10.542  -3.539
 1305    HB   VAL  85           HB       VAL  85 331.940  11.576  -0.768
 1306   HG11  VAL  85          HG11      VAL  85 333.152  13.345  -1.710
 1307   HG12  VAL  85          HG12      VAL  85 331.463  13.760  -2.023
 1308   HG13  VAL  85          HG13      VAL  85 332.460  13.074  -3.310
 1309   HG21  VAL  85          HG21      VAL  85 329.851  11.236  -1.236
 1310   HG22  VAL  85          HG22      VAL  85 330.287  10.571  -2.815
 1311   HG23  VAL  85          HG23      VAL  85 329.991  12.303  -2.631
 1312    H    PHE  86           H        PHE  86 334.538  11.251  -4.152
 1313    HA   PHE  86           HA       PHE  86 336.501  11.837  -2.056
 1314    HB2  PHE  86           HB2      PHE  86 336.918  10.038  -4.449
 1315    HB3  PHE  86           HB3      PHE  86 338.257  10.827  -3.624
 1316    HD1  PHE  86           HD1      PHE  86 338.175  10.504  -0.965
 1317    HD2  PHE  86           HD2      PHE  86 336.438   7.888  -3.839
 1318    HE1  PHE  86           HE1      PHE  86 338.262   8.660   0.663
 1319    HE2  PHE  86           HE2      PHE  86 336.519   6.042  -2.214
 1320    HZ   PHE  86           HZ       PHE  86 337.433   6.427   0.040
 1321    H    GLN  87           H        GLN  87 336.670  13.892  -2.310
 1322    HA   GLN  87           HA       GLN  87 337.498  14.942  -4.900
 1323    HB2  GLN  87           HB2      GLN  87 334.907  15.048  -4.428
 1324    HB3  GLN  87           HB3      GLN  87 335.335  16.484  -3.526
 1325    HG2  GLN  87           HG2      GLN  87 336.639  16.543  -6.075
 1326    HG3  GLN  87           HG3      GLN  87 334.941  16.191  -6.286
 1327   HE21  GLN  87          HE21      GLN  87 333.371  17.661  -5.068
 1328   HE22  GLN  87          HE22      GLN  87 333.806  19.335  -5.002
 1329    H    GLN  88           H        GLN  88 339.267  16.088  -4.598
 1330    HA   GLN  88           HA       GLN  88 339.980  17.059  -1.984
 1331    HB2  GLN  88           HB2      GLN  88 341.359  17.106  -4.656
 1332    HB3  GLN  88           HB3      GLN  88 342.039  17.887  -3.236
 1333    HG2  GLN  88           HG2      GLN  88 341.243  15.014  -3.122
 1334    HG3  GLN  88           HG3      GLN  88 342.768  15.482  -3.871
 1335   HE21  GLN  88          HE21      GLN  88 340.907  15.524  -0.905
 1336   HE22  GLN  88          HE22      GLN  88 342.252  15.722   0.162
 1337    H    GLN  89           H        GLN  89 338.805  18.789  -1.356
 1338    HA   GLN  89           HA       GLN  89 337.911  20.858  -3.030
 1339    HB2  GLN  89           HB2      GLN  89 337.526  22.114  -0.923
 1340    HB3  GLN  89           HB3      GLN  89 336.872  20.482  -0.884
 1341    HG2  GLN  89           HG2      GLN  89 338.887  19.760   0.365
 1342    HG3  GLN  89           HG3      GLN  89 339.410  21.443   0.415
 1343   HE21  GLN  89          HE21      GLN  89 339.133  22.165   2.399
 1344   HE22  GLN  89          HE22      GLN  89 337.724  21.946   3.374
 1345    H    THR  90           H        THR  90 338.575  23.145  -2.909
 1346    HA   THR  90           HA       THR  90 341.162  23.880  -2.004
 1347    HB   THR  90           HB       THR  90 341.849  24.379  -4.538
 1348    HG1  THR  90           HG1      THR  90 340.035  23.362  -5.433
 1349   HG21  THR  90          HG21      THR  90 343.459  22.803  -4.352
 1350   HG22  THR  90          HG22      THR  90 342.342  21.567  -3.772
 1351   HG23  THR  90          HG23      THR  90 342.912  22.826  -2.675
 1352    H1   THR   2           HT1      THR   2 290.110 -13.005  16.867
 1353    H2   THR   2           HT2      THR   2 291.486 -12.127  16.337
 1354    H3   THR   2           HT3      THR   2 289.961 -11.868  15.593
 1355    HA   THR   2           HA       THR   2 290.442 -11.387  18.446
 1356    HB   THR   2           HB       THR   2 290.570  -9.352  16.217
 1357    HG1  THR   2           HG1      THR   2 292.518 -10.025  15.917
 1358   HG21  THR   2          HG21      THR   2 290.066  -8.181  18.152
 1359   HG22  THR   2          HG22      THR   2 291.825  -8.087  18.057
 1360   HG23  THR   2          HG23      THR   2 291.061  -9.229  19.163
 1361    H    VAL   3           H        VAL   3 288.714 -10.318  15.511
 1362    HA   VAL   3           HA       VAL   3 286.218 -10.351  17.057
 1363    HB   VAL   3           HB       VAL   3 285.504  -8.262  15.876
 1364   HG11  VAL   3          HG11      VAL   3 287.747  -8.283  17.858
 1365   HG12  VAL   3          HG12      VAL   3 286.037  -7.931  18.111
 1366   HG13  VAL   3          HG13      VAL   3 287.066  -6.761  17.285
 1367   HG21  VAL   3          HG21      VAL   3 287.339  -8.513  14.118
 1368   HG22  VAL   3          HG22      VAL   3 288.418  -7.802  15.318
 1369   HG23  VAL   3          HG23      VAL   3 287.026  -6.890  14.735
 1370    H    GLY   4           H        GLY   4 284.374 -10.873  15.898
 1371    HA2  GLY   4           HA2      GLY   4 284.798 -12.391  13.509
 1372    HA3  GLY   4           HA3      GLY   4 283.253 -12.091  14.292
 1373    H    ASP   5           H        ASP   5 282.079 -10.206  13.766
 1374    HA   ASP   5           HA       ASP   5 281.111  -8.870  12.186
 1375    HB2  ASP   5           HB2      ASP   5 282.438  -6.923  11.600
 1376    HB3  ASP   5           HB3      ASP   5 282.754  -7.370  13.272
 1377    H    GLU   6           H        GLU   6 281.985  -7.662   9.876
 1378    HA   GLU   6           HA       GLU   6 282.318  -9.992   8.130
 1379    HB2  GLU   6           HB2      GLU   6 281.330  -8.652   6.378
 1380    HB3  GLU   6           HB3      GLU   6 280.316  -8.566   7.810
 1381    HG2  GLU   6           HG2      GLU   6 280.793  -6.366   8.193
 1382    HG3  GLU   6           HG3      GLU   6 282.364  -6.453   7.396
 1383    H    ILE   7           H        ILE   7 283.172  -8.799   5.818
 1384    HA   ILE   7           HA       ILE   7 285.786  -7.641   6.515
 1385    HB   ILE   7           HB       ILE   7 286.883  -8.992   4.842
 1386   HG12  ILE   7          HG12      ILE   7 284.613  -9.161   3.490
 1387   HG13  ILE   7          HG13      ILE   7 285.842 -10.406   3.335
 1388   HG21  ILE   7          HG21      ILE   7 285.320 -10.326   6.989
 1389   HG22  ILE   7          HG22      ILE   7 287.064 -10.117   6.823
 1390   HG23  ILE   7          HG23      ILE   7 286.225 -11.336   5.861
 1391   HD11  ILE   7          HD11      ILE   7 283.679 -10.711   5.365
 1392   HD12  ILE   7          HD12      ILE   7 284.615 -11.946   4.523
 1393   HD13  ILE   7          HD13      ILE   7 283.356 -11.057   3.666
 1394    H    VAL   8           H        VAL   8 286.821  -7.241   4.033
 1395    HA   VAL   8           HA       VAL   8 285.043  -5.178   2.972
 1396    HB   VAL   8           HB       VAL   8 287.904  -5.649   2.151
 1397   HG11  VAL   8          HG11      VAL   8 287.435  -3.974   0.770
 1398   HG12  VAL   8          HG12      VAL   8 287.297  -2.932   2.186
 1399   HG13  VAL   8          HG13      VAL   8 285.861  -3.710   1.521
 1400   HG21  VAL   8          HG21      VAL   8 287.800  -3.511   3.983
 1401   HG22  VAL   8          HG22      VAL   8 288.615  -5.063   4.177
 1402   HG23  VAL   8          HG23      VAL   8 286.954  -4.862   4.739
 1403    H    ASP   9           H        ASP   9 284.568  -4.996   0.725
 1404    HA   ASP   9           HA       ASP   9 285.210  -7.333  -0.919
 1405    HB2  ASP   9           HB2      ASP   9 282.429  -6.290  -0.380
 1406    HB3  ASP   9           HB3      ASP   9 282.813  -7.374  -1.714
 1407    H    LEU  10           H        LEU  10 286.168  -6.601  -2.678
 1408    HA   LEU  10           HA       LEU  10 285.027  -5.016  -4.627
 1409    HB2  LEU  10           HB2      LEU  10 286.508  -2.945  -4.370
 1410    HB3  LEU  10           HB3      LEU  10 285.079  -3.059  -3.369
 1411    HG   LEU  10           HG       LEU  10 287.441  -2.276  -2.429
 1412   HD11  LEU  10          HD11      LEU  10 286.465  -2.321  -0.401
 1413   HD12  LEU  10          HD12      LEU  10 285.969  -4.006  -0.547
 1414   HD13  LEU  10          HD13      LEU  10 285.050  -2.742  -1.363
 1415   HD21  LEU  10          HD21      LEU  10 288.845  -4.078  -2.651
 1416   HD22  LEU  10          HD22      LEU  10 287.574  -5.258  -2.356
 1417   HD23  LEU  10          HD23      LEU  10 288.231  -4.329  -1.020
 1418    H    THR  11           H        THR  11 286.979  -3.909  -6.027
 1419    HA   THR  11           HA       THR  11 289.476  -5.299  -5.882
 1420    HB   THR  11           HB       THR  11 288.152  -5.897  -8.461
 1421    HG1  THR  11           HG1      THR  11 287.265  -7.832  -7.455
 1422   HG21  THR  11          HG21      THR  11 289.730  -7.770  -6.709
 1423   HG22  THR  11          HG22      THR  11 290.483  -6.641  -7.835
 1424   HG23  THR  11          HG23      THR  11 289.400  -7.894  -8.438
 1425    H    CYS  12           H        CYS  12 290.429  -3.325  -5.972
 1426    HA   CYS  12           HA       CYS  12 290.217  -1.913  -8.548
 1427    HB2  CYS  12           HB2      CYS  12 289.387  -0.870  -6.165
 1428    HB3  CYS  12           HB3      CYS  12 291.053  -0.304  -6.222
 1429    HG   CYS  12           HG       CYS  12 289.486   1.452  -7.362
 1430    H    GLU  13           H        GLU  13 292.305  -0.049  -7.938
 1431    HA   GLU  13           HA       GLU  13 294.665  -1.506  -7.202
 1432    HB2  GLU  13           HB2      GLU  13 295.768  -1.201  -9.442
 1433    HB3  GLU  13           HB3      GLU  13 294.503  -2.422  -9.397
 1434    HG2  GLU  13           HG2      GLU  13 293.848   0.362 -10.242
 1435    HG3  GLU  13           HG3      GLU  13 294.628  -0.743 -11.372
 1436    H    SER  14           H        SER  14 296.527  -0.180  -7.048
 1437    HA   SER  14           HA       SER  14 296.542   2.545  -7.856
 1438    HB2  SER  14           HB2      SER  14 294.926   2.716  -5.989
 1439    HB3  SER  14           HB3      SER  14 296.132   2.031  -4.900
 1440    HG   SER  14           HG       SER  14 296.398   4.166  -4.660
 1441    H    LEU  15           H        LEU  15 298.609   2.544  -8.476
 1442    HA   LEU  15           HA       LEU  15 300.639   1.818  -6.475
 1443    HB2  LEU  15           HB2      LEU  15 300.137   0.268  -8.640
 1444    HB3  LEU  15           HB3      LEU  15 301.340   1.357  -9.305
 1445    HG   LEU  15           HG       LEU  15 302.508   0.624  -6.939
 1446   HD11  LEU  15          HD11      LEU  15 301.987  -1.456  -6.277
 1447   HD12  LEU  15          HD12      LEU  15 301.713  -2.024  -7.924
 1448   HD13  LEU  15          HD13      LEU  15 300.449  -1.132  -7.077
 1449   HD21  LEU  15          HD21      LEU  15 303.583  -1.179  -8.615
 1450   HD22  LEU  15          HD22      LEU  15 303.957   0.544  -8.670
 1451   HD23  LEU  15          HD23      LEU  15 302.766  -0.136  -9.779
 1452    H    GLU  16           H        GLU  16 302.867   2.659  -7.213
 1453    HA   GLU  16           HA       GLU  16 302.609   5.249  -8.573
 1454    HB2  GLU  16           HB2      GLU  16 302.973   4.922  -5.801
 1455    HB3  GLU  16           HB3      GLU  16 304.537   5.415  -6.436
 1456    HG2  GLU  16           HG2      GLU  16 302.344   6.977  -7.527
 1457    HG3  GLU  16           HG3      GLU  16 302.447   7.074  -5.769
 1458    HA   PRO  17           HA       PRO  17 306.134   3.089 -10.477
 1459    HB2  PRO  17           HB2      PRO  17 306.095   4.506 -12.785
 1460    HB3  PRO  17           HB3      PRO  17 305.003   3.152 -12.475
 1461    HG2  PRO  17           HG2      PRO  17 304.490   6.092 -12.241
 1462    HG3  PRO  17           HG3      PRO  17 303.455   4.826 -12.930
 1463    HD2  PRO  17           HD2      PRO  17 303.086   5.828 -10.437
 1464    HD3  PRO  17           HD3      PRO  17 302.692   4.152 -10.866
 1465    H    VAL  18           H        VAL  18 308.044   3.649  -9.674
 1466    HA   VAL  18           HA       VAL  18 309.951   4.799  -9.247
 1467    HB   VAL  18           HB       VAL  18 309.051   6.874 -11.234
 1468   HG11  VAL  18          HG11      VAL  18 311.832   5.878 -10.659
 1469   HG12  VAL  18          HG12      VAL  18 311.105   7.230  -9.791
 1470   HG13  VAL  18          HG13      VAL  18 311.350   7.331 -11.534
 1471   HG21  VAL  18          HG21      VAL  18 310.028   5.545 -12.995
 1472   HG22  VAL  18          HG22      VAL  18 308.782   4.601 -12.180
 1473   HG23  VAL  18          HG23      VAL  18 310.485   4.290 -11.843
 1474    H    VAL  19           H        VAL  19 310.755   6.450  -7.980
 1475    HA   VAL  19           HA       VAL  19 309.245   8.767  -7.271
 1476    HB   VAL  19           HB       VAL  19 309.158   8.104  -4.795
 1477   HG11  VAL  19          HG11      VAL  19 307.242   8.237  -6.558
 1478   HG12  VAL  19          HG12      VAL  19 306.942   7.516  -4.977
 1479   HG13  VAL  19          HG13      VAL  19 307.220   6.483  -6.379
 1480   HG21  VAL  19          HG21      VAL  19 310.537   6.037  -5.127
 1481   HG22  VAL  19          HG22      VAL  19 309.145   5.316  -5.935
 1482   HG23  VAL  19          HG23      VAL  19 309.032   5.786  -4.240
 1483    H    VAL  20           H        VAL  20 310.424  10.077  -5.619
 1484    HA   VAL  20           HA       VAL  20 313.174   9.219  -5.143
 1485    HB   VAL  20           HB       VAL  20 312.800  11.971  -6.245
 1486   HG11  VAL  20          HG11      VAL  20 314.929  11.777  -5.421
 1487   HG12  VAL  20          HG12      VAL  20 315.184  11.234  -7.078
 1488   HG13  VAL  20          HG13      VAL  20 315.029  10.053  -5.780
 1489   HG21  VAL  20          HG21      VAL  20 313.022   9.427  -7.840
 1490   HG22  VAL  20          HG22      VAL  20 313.491  11.001  -8.483
 1491   HG23  VAL  20          HG23      VAL  20 311.822  10.711  -7.993
 1492    H    ASP  21           H        ASP  21 314.364  10.622  -3.706
 1493    HA   ASP  21           HA       ASP  21 313.456  12.781  -2.281
 1494    HB2  ASP  21           HB2      ASP  21 312.743  11.660  -0.118
 1495    HB3  ASP  21           HB3      ASP  21 311.578  11.576  -1.435
 1496    H    LEU  22           H        LEU  22 314.548  12.796   0.046
 1497    HA   LEU  22           HA       LEU  22 316.919  11.137   0.176
 1498    HB2  LEU  22           HB2      LEU  22 318.125  13.556   0.538
 1499    HB3  LEU  22           HB3      LEU  22 318.206  12.596  -0.924
 1500    HG   LEU  22           HG       LEU  22 315.882  14.391  -0.802
 1501   HD11  LEU  22          HD11      LEU  22 318.466  15.746  -1.376
 1502   HD12  LEU  22          HD12      LEU  22 317.951  15.581   0.303
 1503   HD13  LEU  22          HD13      LEU  22 316.923  16.424  -0.856
 1504   HD21  LEU  22          HD21      LEU  22 316.614  14.862  -3.105
 1505   HD22  LEU  22          HD22      LEU  22 316.443  13.134  -2.796
 1506   HD23  LEU  22          HD23      LEU  22 318.047  13.868  -2.838
 1507    H    THR  23           H        THR  23 317.575  10.798   2.210
 1508    HA   THR  23           HA       THR  23 315.971  11.523   4.378
 1509    HB   THR  23           HB       THR  23 318.869  10.750   4.652
 1510    HG1  THR  23           HG1      THR  23 318.427   8.762   4.039
 1511   HG21  THR  23          HG21      THR  23 318.122   9.494   6.571
 1512   HG22  THR  23          HG22      THR  23 316.451   9.965   6.260
 1513   HG23  THR  23          HG23      THR  23 317.639  11.183   6.726
 1514    H    HIS  24           H        HIS  24 316.408  12.865   6.196
 1515    HA   HIS  24           HA       HIS  24 318.432  14.944   5.838
 1516    HB2  HIS  24           HB2      HIS  24 316.752  16.703   6.408
 1517    HB3  HIS  24           HB3      HIS  24 316.475  15.942   4.845
 1518    HD1  HIS  24           HD1      HIS  24 314.560  13.998   4.893
 1519    HD2  HIS  24           HD2      HIS  24 314.586  16.706   8.045
 1520    HE1  HIS  24           HE1      HIS  24 312.287  13.816   5.955
 1521    HE2  HIS  24           HE2      HIS  24 312.357  15.400   7.913
 1522    H    ASN  25           H        ASN  25 319.274  13.480   7.574
 1523    HA   ASN  25           HA       ASN  25 318.751  14.669  10.133
 1524    HB2  ASN  25           HB2      ASN  25 317.036  12.710   9.698
 1525    HB3  ASN  25           HB3      ASN  25 318.410  11.697  10.131
 1526   HD21  ASN  25          HD21      ASN  25 319.482  12.228  12.197
 1527   HD22  ASN  25          HD22      ASN  25 318.491  12.744  13.515
 1528    H    ASP  26           H        ASP  26 320.239  11.908   8.462
 1529    HA   ASP  26           HA       ASP  26 322.327  11.013   8.556
 1530    HB2  ASP  26           HB2      ASP  26 322.747  13.628   8.267
 1531    HB3  ASP  26           HB3      ASP  26 323.455  13.439   9.868
  Start of MODEL    6
    1    H1   GLY   1           HT1      GLY   1 293.561 -22.649 -10.687
    2    H2   GLY   1           HT2      GLY   1 294.340 -21.543  -9.671
    3    H3   GLY   1           HT3      GLY   1 294.872 -21.748 -11.263
    4    HA2  GLY   1           HA3      GLY   1 293.375 -20.348 -12.097
    5    HA3  GLY   1           HA2      GLY   1 292.097 -21.051 -11.119
    6    H    THR   2           H        THR   2 291.568 -18.639 -11.152
    7    HA   THR   2           HA       THR   2 291.263 -16.737  -9.939
    8    HB   THR   2           HB       THR   2 292.942 -17.649  -7.668
    9    HG1  THR   2           HG1      THR   2 291.301 -19.144  -7.058
   10   HG21  THR   2          HG21      THR   2 290.973 -17.022  -6.359
   11   HG22  THR   2          HG22      THR   2 290.119 -16.630  -7.851
   12   HG23  THR   2          HG23      THR   2 291.544 -15.703  -7.381
   13    H    GLU   3           H        GLU   3 292.236 -14.791  -9.986
   14    HA   GLU   3           HA       GLU   3 295.068 -14.523  -9.555
   15    HB2  GLU   3           HB2      GLU   3 295.175 -13.233 -11.845
   16    HB3  GLU   3           HB3      GLU   3 295.492 -14.953 -11.737
   17    HG2  GLU   3           HG2      GLU   3 293.087 -15.334 -12.303
   18    HG3  GLU   3           HG3      GLU   3 292.972 -13.611 -12.650
   19    H    ASN   4           H        ASN   4 293.716 -12.106 -11.611
   20    HA   ASN   4           HA       ASN   4 293.944 -10.154  -9.564
   21    HB2  ASN   4           HB2      ASN   4 294.090  -9.968 -12.198
   22    HB3  ASN   4           HB3      ASN   4 292.389  -9.582 -12.020
   23   HD21  ASN   4          HD21      ASN   4 292.316  -8.097  -9.741
   24   HD22  ASN   4          HD22      ASN   4 293.231  -6.647  -9.942
   25    H    ASP   5           H        ASP   5 291.684 -12.438  -9.638
   26    HA   ASP   5           HA       ASP   5 289.359 -10.756  -9.198
   27    HB2  ASP   5           HB2      ASP   5 288.155 -12.829  -8.797
   28    HB3  ASP   5           HB3      ASP   5 289.129 -13.022 -10.249
   29    H    HIS   6           H        HIS   6 288.332 -12.176  -6.843
   30    HA   HIS   6           HA       HIS   6 290.098 -10.908  -4.937
   31    HB2  HIS   6           HB2      HIS   6 287.495 -12.314  -4.396
   32    HB3  HIS   6           HB3      HIS   6 288.452 -11.430  -3.277
   33    HD1  HIS   6           HD1      HIS   6 287.060 -10.407  -6.663
   34    HD2  HIS   6           HD2      HIS   6 287.234  -9.264  -2.676
   35    HE1  HIS   6           HE1      HIS   6 285.772  -8.246  -6.544
   36    HE2  HIS   6           HE2      HIS   6 285.781  -7.627  -4.096
   37    H    ILE   7           H        ILE   7 290.520 -11.931  -2.965
   38    HA   ILE   7           HA       ILE   7 290.509 -14.768  -2.729
   39    HB   ILE   7           HB       ILE   7 292.735 -15.305  -2.785
   40   HG12  ILE   7          HG12      ILE   7 293.541 -12.405  -2.572
   41   HG13  ILE   7          HG13      ILE   7 293.479 -13.531  -1.216
   42   HG21  ILE   7          HG21      ILE   7 292.139 -14.826  -5.019
   43   HG22  ILE   7          HG22      ILE   7 293.797 -14.273  -4.765
   44   HG23  ILE   7          HG23      ILE   7 292.474 -13.107  -4.803
   45   HD11  ILE   7          HD11      ILE   7 295.479 -13.228  -3.306
   46   HD12  ILE   7          HD12      ILE   7 294.982 -14.896  -3.018
   47   HD13  ILE   7          HD13      ILE   7 295.615 -13.920  -1.688
   48    H    ASN   8           H        ASN   8 290.448 -15.268  -0.603
   49    HA   ASN   8           HA       ASN   8 290.207 -12.992   1.150
   50    HB2  ASN   8           HB2      ASN   8 289.276 -15.742   1.105
   51    HB3  ASN   8           HB3      ASN   8 289.946 -15.336   2.682
   52   HD21  ASN   8          HD21      ASN   8 289.242 -13.002   3.353
   53   HD22  ASN   8          HD22      ASN   8 287.543 -12.714   3.246
   54    H    LEU   9           H        LEU   9 291.556 -12.487   2.867
   55    HA   LEU   9           HA       LEU   9 293.965 -14.127   3.112
   56    HB2  LEU   9           HB2      LEU   9 293.668 -11.257   2.684
   57    HB3  LEU   9           HB3      LEU   9 294.709 -11.650   3.969
   58    HG   LEU   9           HG       LEU   9 296.382 -12.204   2.572
   59   HD11  LEU   9          HD11      LEU   9 295.504 -14.397   2.132
   60   HD12  LEU   9          HD12      LEU   9 296.093 -13.707   0.621
   61   HD13  LEU   9          HD13      LEU   9 294.362 -13.749   0.954
   62   HD21  LEU   9          HD21      LEU   9 295.876 -10.272   1.398
   63   HD22  LEU   9          HD22      LEU   9 294.398 -10.965   0.729
   64   HD23  LEU   9          HD23      LEU   9 295.968 -11.506   0.137
   65    H    LYS  10           H        LYS  10 294.535 -14.696   5.064
   66    HA   LYS  10           HA       LYS  10 292.799 -13.891   7.271
   67    HB2  LYS  10           HB2      LYS  10 294.647 -16.112   6.664
   68    HB3  LYS  10           HB3      LYS  10 294.487 -15.704   8.331
   69    HG2  LYS  10           HG2      LYS  10 292.238 -16.331   8.378
   70    HG3  LYS  10           HG3      LYS  10 292.096 -16.219   6.623
   71    HD2  LYS  10           HD2      LYS  10 292.147 -18.530   7.248
   72    HD3  LYS  10           HD3      LYS  10 293.638 -18.114   6.398
   73    HE2  LYS  10           HE2      LYS  10 294.570 -19.224   8.154
   74    HE3  LYS  10           HE3      LYS  10 294.447 -17.630   8.909
   75    HZ1  LYS  10           HZ1      LYS  10 292.352 -18.320   9.909
   76    HZ2  LYS  10           HZ2      LYS  10 293.603 -19.366  10.359
   77    HZ3  LYS  10           HZ3      LYS  10 292.480 -19.846   9.189
   78    H    VAL  11           H        VAL  11 293.567 -12.006   8.244
   79    HA   VAL  11           HA       VAL  11 296.463 -11.700   8.366
   80    HB   VAL  11           HB       VAL  11 295.524  -9.685   7.662
   81   HG11  VAL  11          HG11      VAL  11 293.244 -10.497   9.127
   82   HG12  VAL  11          HG12      VAL  11 293.409  -9.172   7.973
   83   HG13  VAL  11          HG13      VAL  11 293.707  -8.893   9.685
   84   HG21  VAL  11          HG21      VAL  11 295.941  -9.426  10.625
   85   HG22  VAL  11          HG22      VAL  11 295.958  -8.098   9.460
   86   HG23  VAL  11          HG23      VAL  11 297.174  -9.375   9.364
   87    H    ALA  12           H        ALA  12 297.485 -12.407  10.015
   88    HA   ALA  12           HA       ALA  12 296.076 -13.045  12.517
   89    HB1  ALA  12           HB1      ALA  12 298.377 -14.229  12.964
   90    HB2  ALA  12           HB2      ALA  12 298.526 -14.106  11.209
   91    HB3  ALA  12           HB3      ALA  12 297.156 -14.970  11.919
   92    H    GLY  13           H        GLY  13 296.585 -12.056  14.471
   93    HA2  GLY  13           HA2      GLY  13 298.429  -9.785  14.205
   94    HA3  GLY  13           HA3      GLY  13 297.080  -9.860  15.308
   95    H    GLN  14           H        GLN  14 299.998 -11.846  14.708
   96    HA   GLN  14           HA       GLN  14 301.602 -12.612  16.078
   97    HB2  GLN  14           HB2      GLN  14 300.816 -10.050  17.420
   98    HB3  GLN  14           HB3      GLN  14 302.176 -11.026  17.924
   99    HG2  GLN  14           HG2      GLN  14 302.964 -10.808  15.492
  100    HG3  GLN  14           HG3      GLN  14 301.808  -9.477  15.416
  101   HE21  GLN  14          HE21      GLN  14 302.081  -7.712  16.890
  102   HE22  GLN  14          HE22      GLN  14 303.654  -7.314  17.481
  103    H    ASP  15           H        ASP  15 298.811 -11.515  17.966
  104    HA   ASP  15           HA       ASP  15 299.391 -13.294  20.151
  105    HB2  ASP  15           HB2      ASP  15 297.624 -11.072  19.666
  106    HB3  ASP  15           HB3      ASP  15 296.718 -12.413  20.360
  107    H    GLY  16           H        GLY  16 298.140 -13.816  17.138
  108    HA2  GLY  16           HA2      GLY  16 297.498 -16.005  16.459
  109    HA3  GLY  16           HA3      GLY  16 296.816 -16.270  18.058
  110    H    SER  17           H        SER  17 296.003 -13.209  17.105
  111    HA   SER  17           HA       SER  17 293.316 -14.071  16.365
  112    HB2  SER  17           HB2      SER  17 293.599 -12.402  18.196
  113    HB3  SER  17           HB3      SER  17 294.321 -11.291  17.033
  114    HG   SER  17           HG       SER  17 292.045 -10.961  17.392
  115    H    VAL  18           H        VAL  18 293.195 -14.486  14.259
  116    HA   VAL  18           HA       VAL  18 294.422 -12.603  12.355
  117    HB   VAL  18           HB       VAL  18 295.238 -14.554  11.576
  118   HG11  VAL  18          HG11      VAL  18 293.926 -16.769  11.806
  119   HG12  VAL  18          HG12      VAL  18 292.979 -15.883  13.000
  120   HG13  VAL  18          HG13      VAL  18 294.721 -16.072  13.217
  121   HG21  VAL  18          HG21      VAL  18 293.811 -15.623   9.859
  122   HG22  VAL  18          HG22      VAL  18 293.851 -13.864   9.774
  123   HG23  VAL  18          HG23      VAL  18 292.447 -14.680  10.454
  124    H    VAL  19           H        VAL  19 293.091 -12.257  10.304
  125    HA   VAL  19           HA       VAL  19 290.202 -12.388  10.766
  126    HB   VAL  19           HB       VAL  19 291.590  -9.868   9.903
  127   HG11  VAL  19          HG11      VAL  19 289.340  -8.857  10.120
  128   HG12  VAL  19          HG12      VAL  19 288.687 -10.473  10.395
  129   HG13  VAL  19          HG13      VAL  19 289.442 -10.079   8.851
  130   HG21  VAL  19          HG21      VAL  19 292.002 -10.074  12.213
  131   HG22  VAL  19          HG22      VAL  19 290.354 -10.618  12.528
  132   HG23  VAL  19          HG23      VAL  19 290.654  -8.946  12.044
  133    H    GLN  20           H        GLN  20 288.996 -12.532   8.868
  134    HA   GLN  20           HA       GLN  20 290.597 -13.184   6.535
  135    HB2  GLN  20           HB2      GLN  20 287.781 -13.734   7.365
  136    HB3  GLN  20           HB3      GLN  20 288.192 -13.793   5.655
  137    HG2  GLN  20           HG2      GLN  20 289.804 -15.308   7.671
  138    HG3  GLN  20           HG3      GLN  20 288.288 -15.960   7.039
  139   HE21  GLN  20          HE21      GLN  20 291.339 -14.532   5.943
  140   HE22  GLN  20          HE22      GLN  20 291.521 -15.543   4.563
  141    H    PHE  21           H        PHE  21 290.507 -12.189   4.591
  142    HA   PHE  21           HA       PHE  21 288.706  -9.949   4.195
  143    HB2  PHE  21           HB2      PHE  21 291.698  -9.659   4.385
  144    HB3  PHE  21           HB3      PHE  21 290.670  -8.480   3.580
  145    HD1  PHE  21           HD2      PHE  21 288.733  -7.506   4.995
  146    HD2  PHE  21           HD1      PHE  21 292.136  -9.468   6.617
  147    HE1  PHE  21           HE2      PHE  21 288.342  -6.387   7.147
  148    HE2  PHE  21           HE1      PHE  21 291.761  -8.333   8.773
  149    HZ   PHE  21           HZ       PHE  21 289.869  -6.792   9.030
  150    H    LYS  22           H        LYS  22 288.002 -10.157   2.123
  151    HA   LYS  22           HA       LYS  22 289.797 -11.513   0.284
  152    HB2  LYS  22           HB2      LYS  22 287.007 -11.482   0.342
  153    HB3  LYS  22           HB3      LYS  22 287.447 -10.507  -1.045
  154    HG2  LYS  22           HG2      LYS  22 288.949 -12.350  -1.757
  155    HG3  LYS  22           HG3      LYS  22 288.281 -13.300  -0.464
  156    HD2  LYS  22           HD2      LYS  22 286.516 -12.000  -2.419
  157    HD3  LYS  22           HD3      LYS  22 287.278 -13.534  -2.815
  158    HE2  LYS  22           HE2      LYS  22 286.327 -14.190  -0.443
  159    HE3  LYS  22           HE3      LYS  22 285.186 -12.894  -0.801
  160    HZ1  LYS  22           HZ1      LYS  22 284.203 -14.855  -1.595
  161    HZ2  LYS  22           HZ2      LYS  22 285.634 -15.399  -2.315
  162    HZ3  LYS  22           HZ3      LYS  22 284.801 -14.084  -2.978
  163    H    ILE  23           H        ILE  23 290.905 -10.602  -1.216
  164    HA   ILE  23           HA       ILE  23 290.425  -7.826  -1.903
  165    HB   ILE  23           HB       ILE  23 291.868  -7.550  -0.037
  166   HG12  ILE  23          HG12      ILE  23 293.396  -7.362  -2.631
  167   HG13  ILE  23          HG13      ILE  23 292.499  -6.091  -1.816
  168   HG21  ILE  23          HG21      ILE  23 293.124  -9.991  -1.063
  169   HG22  ILE  23          HG22      ILE  23 292.893  -9.431   0.595
  170   HG23  ILE  23          HG23      ILE  23 294.234  -8.810  -0.369
  171   HD11  ILE  23          HD11      ILE  23 294.720  -5.585  -1.385
  172   HD12  ILE  23          HD12      ILE  23 295.141  -7.269  -1.074
  173   HD13  ILE  23          HD13      ILE  23 294.163  -6.373   0.093
  174    H    LYS  24           H        LYS  24 290.876  -7.428  -3.908
  175    HA   LYS  24           HA       LYS  24 291.349  -9.526  -5.726
  176    HB2  LYS  24           HB2      LYS  24 291.414  -6.554  -6.042
  177    HB3  LYS  24           HB3      LYS  24 291.937  -7.583  -7.358
  178    HG2  LYS  24           HG2      LYS  24 289.650  -8.767  -6.833
  179    HG3  LYS  24           HG3      LYS  24 289.259  -7.175  -6.191
  180    HD2  LYS  24           HD2      LYS  24 289.418  -6.156  -8.243
  181    HD3  LYS  24           HD3      LYS  24 290.535  -7.375  -8.869
  182    HE2  LYS  24           HE2      LYS  24 288.846  -8.492  -9.761
  183    HE3  LYS  24           HE3      LYS  24 288.135  -8.650  -8.155
  184    HZ1  LYS  24           HZ1      LYS  24 286.876  -7.441 -10.109
  185    HZ2  LYS  24           HZ2      LYS  24 287.765  -6.113  -9.557
  186    HZ3  LYS  24           HZ3      LYS  24 286.719  -6.925  -8.505
  187    H    ARG  25           H        ARG  25 293.266 -10.330  -6.625
  188    HA   ARG  25           HA       ARG  25 295.544 -10.203  -5.131
  189    HB2  ARG  25           HB2      ARG  25 295.078 -10.973  -7.981
  190    HB3  ARG  25           HB3      ARG  25 296.670 -11.047  -7.277
  191    HG2  ARG  25           HG2      ARG  25 295.701 -12.469  -5.447
  192    HG3  ARG  25           HG3      ARG  25 294.248 -12.578  -6.437
  193    HD2  ARG  25           HD2      ARG  25 295.227 -14.359  -7.371
  194    HD3  ARG  25           HD3      ARG  25 296.227 -13.188  -8.229
  195    HE   ARG  25           HE       ARG  25 297.380 -13.724  -5.724
  196   HH11  ARG  25          HH11      ARG  25 296.810 -15.270  -8.800
  197   HH12  ARG  25          HH12      ARG  25 298.189 -16.309  -8.674
  198   HH21  ARG  25          HH21      ARG  25 299.195 -15.090  -5.556
  199   HH22  ARG  25          HH22      ARG  25 299.543 -16.208  -6.833
  200    H    HIS  26           H        HIS  26 294.807  -8.220  -7.995
  201    HA   HIS  26           HA       HIS  26 297.394  -6.938  -7.750
  202    HB2  HIS  26           HB2      HIS  26 295.113  -6.489  -9.665
  203    HB3  HIS  26           HB3      HIS  26 296.593  -5.534  -9.663
  204    HD1  HIS  26           HD1      HIS  26 298.054  -6.292 -11.497
  205    HD2  HIS  26           HD2      HIS  26 296.065  -9.471  -9.707
  206    HE1  HIS  26           HE1      HIS  26 298.879  -8.352 -12.680
  207    HE2  HIS  26           HE2      HIS  26 297.605 -10.256 -11.631
  208    H    THR  27           H        THR  27 295.514  -6.671  -5.540
  209    HA   THR  27           HA       THR  27 295.094  -3.764  -5.614
  210    HB   THR  27           HB       THR  27 293.760  -5.859  -3.890
  211    HG1  THR  27           HG1      THR  27 293.027  -5.500  -6.101
  212   HG21  THR  27          HG21      THR  27 294.175  -3.758  -2.626
  213   HG22  THR  27          HG22      THR  27 292.463  -4.111  -2.881
  214   HG23  THR  27          HG23      THR  27 293.267  -2.887  -3.864
  215    HA   PRO  28           HA       PRO  28 298.328  -3.543  -2.648
  216    HB2  PRO  28           HB2      PRO  28 297.244  -1.066  -1.595
  217    HB3  PRO  28           HB3      PRO  28 298.678  -1.312  -2.590
  218    HG2  PRO  28           HG2      PRO  28 296.405  -0.066  -3.469
  219    HG3  PRO  28           HG3      PRO  28 297.561  -0.890  -4.530
  220    HD2  PRO  28           HD2      PRO  28 294.911  -1.811  -3.516
  221    HD3  PRO  28           HD3      PRO  28 295.683  -2.088  -5.093
  222    H    LEU  29           H        LEU  29 298.406  -4.684  -0.903
  223    HA   LEU  29           HA       LEU  29 296.297  -5.463   0.686
  224    HB2  LEU  29           HB2      LEU  29 299.248  -5.288   1.266
  225    HB3  LEU  29           HB3      LEU  29 298.104  -6.054   2.359
  226    HG   LEU  29           HG       LEU  29 298.332  -6.871  -0.521
  227   HD11  LEU  29          HD11      LEU  29 300.482  -7.033   1.029
  228   HD12  LEU  29          HD12      LEU  29 300.055  -8.263  -0.162
  229   HD13  LEU  29          HD13      LEU  29 299.658  -8.509   1.540
  230   HD21  LEU  29          HD21      LEU  29 297.478  -9.020   0.495
  231   HD22  LEU  29          HD22      LEU  29 296.357  -7.666   0.419
  232   HD23  LEU  29          HD23      LEU  29 297.138  -8.078   1.953
  233    H    SER  30           H        SER  30 297.866  -2.390   0.663
  234    HA   SER  30           HA       SER  30 297.753  -1.532   3.264
  235    HB2  SER  30           HB2      SER  30 297.382   0.737   2.324
  236    HB3  SER  30           HB3      SER  30 298.650  -0.133   1.465
  237    HG   SER  30           HG       SER  30 296.238   0.780   0.566
  238    H    LYS  31           H        LYS  31 295.136  -2.374   1.147
  239    HA   LYS  31           HA       LYS  31 293.149  -0.931   2.656
  240    HB2  LYS  31           HB2      LYS  31 293.212  -1.691   0.122
  241    HB3  LYS  31           HB3      LYS  31 292.389  -3.098   0.781
  242    HG2  LYS  31           HG2      LYS  31 290.511  -1.930   1.285
  243    HG3  LYS  31           HG3      LYS  31 291.389  -0.425   1.569
  244    HD2  LYS  31           HD2      LYS  31 291.188  -1.599  -1.184
  245    HD3  LYS  31           HD3      LYS  31 289.894  -0.597  -0.523
  246    HE2  LYS  31           HE2      LYS  31 291.991   0.967   0.043
  247    HE3  LYS  31           HE3      LYS  31 292.627   0.139  -1.378
  248    HZ1  LYS  31           HZ1      LYS  31 291.367   2.283  -1.765
  249    HZ2  LYS  31           HZ2      LYS  31 289.962   1.424  -1.381
  250    HZ3  LYS  31           HZ3      LYS  31 290.902   0.956  -2.706
  251    H    LEU  32           H        LEU  32 293.906  -4.368   2.053
  252    HA   LEU  32           HA       LEU  32 292.095  -5.590   3.710
  253    HB2  LEU  32           HB2      LEU  32 293.479  -6.878   2.272
  254    HB3  LEU  32           HB3      LEU  32 294.939  -6.228   2.979
  255    HG   LEU  32           HG       LEU  32 293.185  -7.889   4.731
  256   HD11  LEU  32          HD11      LEU  32 295.139  -9.410   3.202
  257   HD12  LEU  32          HD12      LEU  32 293.755  -8.849   2.263
  258   HD13  LEU  32          HD13      LEU  32 293.502  -9.823   3.710
  259   HD21  LEU  32          HD21      LEU  32 295.426  -6.691   5.301
  260   HD22  LEU  32          HD22      LEU  32 296.151  -8.051   4.436
  261   HD23  LEU  32          HD23      LEU  32 295.139  -8.341   5.864
  262    H    MET  33           H        MET  33 295.253  -4.215   4.561
  263    HA   MET  33           HA       MET  33 295.108  -4.954   7.277
  264    HB2  MET  33           HB2      MET  33 296.789  -2.681   6.382
  265    HB3  MET  33           HB3      MET  33 297.137  -3.941   7.495
  266    HG2  MET  33           HG2      MET  33 298.096  -5.229   5.980
  267    HG3  MET  33           HG3      MET  33 296.801  -4.975   4.824
  268    HE1  MET  33           HE1      MET  33 300.146  -3.400   6.308
  269    HE2  MET  33           HE2      MET  33 300.934  -3.313   4.726
  270    HE3  MET  33           HE3      MET  33 300.285  -4.848   5.312
  271    H    LYS  34           H        LYS  34 294.180  -2.126   5.424
  272    HA   LYS  34           HA       LYS  34 293.759  -0.372   7.577
  273    HB2  LYS  34           HB2      LYS  34 292.642  -0.555   4.799
  274    HB3  LYS  34           HB3      LYS  34 291.948   0.591   5.938
  275    HG2  LYS  34           HG2      LYS  34 294.882   0.502   5.358
  276    HG3  LYS  34           HG3      LYS  34 293.762   1.452   4.390
  277    HD2  LYS  34           HD2      LYS  34 293.011   2.325   6.769
  278    HD3  LYS  34           HD3      LYS  34 294.647   1.825   7.202
  279    HE2  LYS  34           HE2      LYS  34 295.153   3.174   4.928
  280    HE3  LYS  34           HE3      LYS  34 293.726   4.045   5.488
  281    HZ1  LYS  34           HZ1      LYS  34 296.198   4.619   6.272
  282    HZ2  LYS  34           HZ2      LYS  34 295.765   3.530   7.491
  283    HZ3  LYS  34           HZ3      LYS  34 294.833   4.916   7.226
  284    H    ALA  35           H        ALA  35 291.929  -3.014   6.274
  285    HA   ALA  35           HA       ALA  35 289.520  -2.481   7.761
  286    HB1  ALA  35           HB1      ALA  35 290.441  -5.014   6.380
  287    HB2  ALA  35           HB2      ALA  35 289.541  -3.712   5.603
  288    HB3  ALA  35           HB3      ALA  35 288.799  -4.634   6.910
  289    H    TYR  36           H        TYR  36 292.414  -4.458   8.080
  290    HA   TYR  36           HA       TYR  36 291.673  -5.880  10.420
  291    HB2  TYR  36           HB2      TYR  36 293.684  -6.339   8.941
  292    HB3  TYR  36           HB3      TYR  36 294.436  -4.941   9.686
  293    HD1  TYR  36           HD1      TYR  36 292.314  -7.596  11.188
  294    HD2  TYR  36           HD2      TYR  36 296.167  -5.756  11.023
  295    HE1  TYR  36           HE1      TYR  36 293.093  -8.992  13.068
  296    HE2  TYR  36           HE2      TYR  36 296.941  -7.127  12.866
  297    HH   TYR  36           HH       TYR  36 295.845  -8.366  14.831
  298    H    CYS  37           H        CYS  37 293.200  -2.732   9.844
  299    HA   CYS  37           HA       CYS  37 293.775  -2.072  12.505
  300    HB2  CYS  37           HB2      CYS  37 293.602  -0.702   9.942
  301    HB3  CYS  37           HB3      CYS  37 293.014   0.312  11.255
  302    HG   CYS  37           HG       CYS  37 295.501  -0.477  12.329
  303    H    GLU  38           H        GLU  38 290.895  -2.079  10.593
  304    HA   GLU  38           HA       GLU  38 289.197  -0.592  12.305
  305    HB2  GLU  38           HB2      GLU  38 288.890  -1.399   9.831
  306    HB3  GLU  38           HB3      GLU  38 288.253  -2.857  10.575
  307    HG2  GLU  38           HG2      GLU  38 287.011  -0.673  11.840
  308    HG3  GLU  38           HG3      GLU  38 286.994  -0.379  10.108
  309    H    ARG  39           H        ARG  39 289.658  -4.097  11.758
  310    HA   ARG  39           HA       ARG  39 288.092  -5.293  13.491
  311    HB2  ARG  39           HB2      ARG  39 290.968  -5.944  13.039
  312    HB3  ARG  39           HB3      ARG  39 289.711  -7.027  13.365
  313    HG2  ARG  39           HG2      ARG  39 290.023  -5.501  10.851
  314    HG3  ARG  39           HG3      ARG  39 290.513  -7.171  11.109
  315    HD2  ARG  39           HD2      ARG  39 287.783  -6.058  11.243
  316    HD3  ARG  39           HD3      ARG  39 288.450  -7.091   9.993
  317    HE   ARG  39           HE       ARG  39 288.417  -8.224  12.644
  318   HH11  ARG  39          HH11      ARG  39 286.740  -7.867   9.594
  319   HH12  ARG  39          HH12      ARG  39 285.780  -9.290   9.813
  320   HH21  ARG  39          HH21      ARG  39 287.139 -10.103  12.928
  321   HH22  ARG  39          HH22      ARG  39 286.001 -10.554  11.704
  322    H    GLN  40           H        GLN  40 291.462  -4.415  14.174
  323    HA   GLN  40           HA       GLN  40 290.998  -4.955  17.002
  324    HB2  GLN  40           HB2      GLN  40 293.635  -4.556  15.611
  325    HB3  GLN  40           HB3      GLN  40 293.365  -5.226  17.214
  326    HG2  GLN  40           HG2      GLN  40 291.902  -6.948  15.816
  327    HG3  GLN  40           HG3      GLN  40 293.033  -6.471  14.550
  328   HE21  GLN  40          HE21      GLN  40 292.913  -9.053  15.514
  329   HE22  GLN  40          HE22      GLN  40 294.371  -9.410  16.369
  330    H    GLY  41           H        GLY  41 291.565  -2.089  15.001
  331    HA2  GLY  41           HA2      GLY  41 291.300   0.033  15.953
  332    HA3  GLY  41           HA3      GLY  41 291.764  -0.623  17.515
  333    H    LEU  42           H        LEU  42 293.834  -1.746  15.096
  334    HA   LEU  42           HA       LEU  42 296.079  -0.442  16.157
  335    HB2  LEU  42           HB2      LEU  42 295.628  -1.955  13.602
  336    HB3  LEU  42           HB3      LEU  42 297.183  -1.208  13.943
  337    HG   LEU  42           HG       LEU  42 295.959  -3.071  15.943
  338   HD11  LEU  42          HD11      LEU  42 296.570  -3.810  13.281
  339   HD12  LEU  42          HD12      LEU  42 296.167  -4.856  14.643
  340   HD13  LEU  42          HD13      LEU  42 297.851  -4.445  14.314
  341   HD21  LEU  42          HD21      LEU  42 297.961  -2.938  16.929
  342   HD22  LEU  42          HD22      LEU  42 298.214  -1.517  15.912
  343   HD23  LEU  42          HD23      LEU  42 298.826  -3.090  15.399
  344    H    SER  43           H        SER  43 297.644   0.673  14.523
  345    HA   SER  43           HA       SER  43 296.237   3.059  13.548
  346    HB2  SER  43           HB2      SER  43 298.196   3.050  15.305
  347    HB3  SER  43           HB3      SER  43 299.213   2.894  13.875
  348    HG   SER  43           HG       SER  43 298.232   5.099  14.848
  349    H    MET  44           H        MET  44 298.062   0.350  12.543
  350    HA   MET  44           HA       MET  44 298.467  -0.499  10.460
  351    HB2  MET  44           HB2      MET  44 296.590   1.418   9.861
  352    HB3  MET  44           HB3      MET  44 297.960   1.909   8.875
  353    HG2  MET  44           HG2      MET  44 297.974  -0.722   8.393
  354    HG3  MET  44           HG3      MET  44 296.254  -0.481   8.691
  355    HE1  MET  44           HE1      MET  44 297.138  -1.045   5.073
  356    HE2  MET  44           HE2      MET  44 298.180  -1.388   6.455
  357    HE3  MET  44           HE3      MET  44 298.662  -0.182   5.266
  358    H    ARG  45           H        ARG  45 299.817   2.240  11.857
  359    HA   ARG  45           HA       ARG  45 302.114   2.277  10.023
  360    HB2  ARG  45           HB2      ARG  45 300.694   4.398  10.953
  361    HB3  ARG  45           HB3      ARG  45 301.961   4.297  12.163
  362    HG2  ARG  45           HG2      ARG  45 302.873   4.127   9.378
  363    HG3  ARG  45           HG3      ARG  45 302.161   5.671   9.851
  364    HD2  ARG  45           HD2      ARG  45 303.700   5.431  11.932
  365    HD3  ARG  45           HD3      ARG  45 304.587   4.293  10.920
  366    HE   ARG  45           HE       ARG  45 305.382   6.054   9.693
  367   HH11  ARG  45          HH11      ARG  45 302.684   7.147  11.618
  368   HH12  ARG  45          HH12      ARG  45 302.922   8.817  11.229
  369   HH21  ARG  45          HH21      ARG  45 305.696   8.250   9.179
  370   HH22  ARG  45          HH22      ARG  45 304.631   9.444   9.843
  371    H    GLN  46           H        GLN  46 301.067   2.087  13.352
  372    HA   GLN  46           HA       GLN  46 303.665   1.438  14.438
  373    HB2  GLN  46           HB2      GLN  46 301.773   2.636  15.627
  374    HB3  GLN  46           HB3      GLN  46 300.952   1.085  15.716
  375    HG2  GLN  46           HG2      GLN  46 303.742   1.274  16.723
  376    HG3  GLN  46           HG3      GLN  46 302.451   1.985  17.692
  377   HE21  GLN  46          HE21      GLN  46 300.405   0.302  17.428
  378   HE22  GLN  46          HE22      GLN  46 300.808  -1.274  18.006
  379    H    ILE  47           H        ILE  47 301.449  -0.079  12.630
  380    HA   ILE  47           HA       ILE  47 302.047  -2.801  13.585
  381    HB   ILE  47           HB       ILE  47 299.724  -2.075  13.891
  382   HG12  ILE  47          HG12      ILE  47 299.908  -4.422  13.555
  383   HG13  ILE  47          HG13      ILE  47 298.554  -3.797  12.567
  384   HG21  ILE  47          HG21      ILE  47 299.729  -0.504  12.040
  385   HG22  ILE  47          HG22      ILE  47 298.317  -1.563  12.056
  386   HG23  ILE  47          HG23      ILE  47 299.636  -1.859  10.917
  387   HD11  ILE  47          HD11      ILE  47 300.268  -3.800  10.713
  388   HD12  ILE  47          HD12      ILE  47 299.361  -5.247  11.207
  389   HD13  ILE  47          HD13      ILE  47 301.050  -5.019  11.728
  390    H    ARG  48           H        ARG  48 302.949  -4.112  12.137
  391    HA   ARG  48           HA       ARG  48 302.983  -3.323   9.299
  392    HB2  ARG  48           HB2      ARG  48 305.203  -4.300  11.076
  393    HB3  ARG  48           HB3      ARG  48 305.220  -4.640   9.353
  394    HG2  ARG  48           HG2      ARG  48 304.947  -1.870  10.454
  395    HG3  ARG  48           HG3      ARG  48 306.500  -2.614  10.055
  396    HD2  ARG  48           HD2      ARG  48 306.102  -2.578   7.819
  397    HD3  ARG  48           HD3      ARG  48 304.366  -2.731   8.010
  398    HE   ARG  48           HE       ARG  48 305.932  -0.255   8.165
  399   HH11  ARG  48          HH11      ARG  48 302.806  -1.825   8.156
  400   HH12  ARG  48          HH12      ARG  48 301.935  -0.351   7.920
  401   HH21  ARG  48          HH21      ARG  48 304.778   1.674   7.854
  402   HH22  ARG  48          HH22      ARG  48 303.050   1.632   7.747
  403    H    PHE  49           H        PHE  49 301.987  -4.799   8.091
  404    HA   PHE  49           HA       PHE  49 301.271  -7.310   9.313
  405    HB2  PHE  49           HB2      PHE  49 300.596  -6.122   6.616
  406    HB3  PHE  49           HB3      PHE  49 300.056  -7.688   7.116
  407    HD1  PHE  49           HD2      PHE  49 300.239  -4.537   9.115
  408    HD2  PHE  49           HD1      PHE  49 297.824  -7.509   7.259
  409    HE1  PHE  49           HE2      PHE  49 298.292  -3.529  10.084
  410    HE2  PHE  49           HE1      PHE  49 295.837  -6.478   8.302
  411    HZ   PHE  49           HZ       PHE  49 296.122  -4.496   9.740
  412    H    ARG  50           H        ARG  50 302.079  -9.301   8.765
  413    HA   ARG  50           HA       ARG  50 304.146  -9.371   6.739
  414    HB2  ARG  50           HB2      ARG  50 304.328 -10.310   9.267
  415    HB3  ARG  50           HB3      ARG  50 303.703 -11.718   8.486
  416    HG2  ARG  50           HG2      ARG  50 305.721 -10.777   6.853
  417    HG3  ARG  50           HG3      ARG  50 306.355 -10.619   8.466
  418    HD2  ARG  50           HD2      ARG  50 305.039 -13.155   7.584
  419    HD3  ARG  50           HD3      ARG  50 306.708 -12.809   7.157
  420    HE   ARG  50           HE       ARG  50 305.709 -13.568   9.734
  421   HH11  ARG  50          HH11      ARG  50 308.289 -11.946   8.031
  422   HH12  ARG  50          HH12      ARG  50 309.442 -12.181   9.301
  423   HH21  ARG  50          HH21      ARG  50 307.225 -13.878  11.404
  424   HH22  ARG  50          HH22      ARG  50 308.839 -13.278  11.216
  425    H    PHE  51           H        PHE  51 304.011 -11.910   5.994
  426    HA   PHE  51           HA       PHE  51 301.267 -12.508   5.289
  427    HB2  PHE  51           HB2      PHE  51 301.723 -11.508   3.237
  428    HB3  PHE  51           HB3      PHE  51 303.424 -11.880   3.319
  429    HD1  PHE  51           HD2      PHE  51 300.281 -13.880   3.332
  430    HD2  PHE  51           HD1      PHE  51 304.107 -13.256   1.593
  431    HE1  PHE  51           HE2      PHE  51 299.919 -15.809   1.853
  432    HE2  PHE  51           HE1      PHE  51 303.755 -15.179   0.107
  433    HZ   PHE  51           HZ       PHE  51 301.657 -16.461   0.235
  434    H    ASP  52           H        ASP  52 301.178 -14.851   4.697
  435    HA   ASP  52           HA       ASP  52 302.398 -16.461   6.540
  436    HB2  ASP  52           HB2      ASP  52 300.722 -17.164   4.681
  437    HB3  ASP  52           HB3      ASP  52 302.157 -17.479   3.714
  438    H    GLY  53           H        GLY  53 304.400 -15.838   7.027
  439    HA2  GLY  53           HA2      GLY  53 306.661 -15.657   6.970
  440    HA3  GLY  53           HA3      GLY  53 306.615 -16.903   5.744
  441    H    GLN  54           H        GLN  54 305.714 -13.339   5.836
  442    HA   GLN  54           HA       GLN  54 307.808 -12.637   4.100
  443    HB2  GLN  54           HB2      GLN  54 305.840 -13.970   2.722
  444    HB3  GLN  54           HB3      GLN  54 305.345 -12.293   2.545
  445    HG2  GLN  54           HG2      GLN  54 306.687 -12.414   0.741
  446    HG3  GLN  54           HG3      GLN  54 307.924 -12.023   1.937
  447   HE21  GLN  54          HE21      GLN  54 309.682 -13.174   1.643
  448   HE22  GLN  54          HE22      GLN  54 309.753 -14.831   1.158
  449    HA   PRO  55           HA       PRO  55 306.321  -9.092   6.516
  450    HB2  PRO  55           HB2      PRO  55 308.206  -7.460   5.238
  451    HB3  PRO  55           HB3      PRO  55 308.394  -8.245   6.797
  452    HG2  PRO  55           HG2      PRO  55 309.347  -9.132   4.109
  453    HG3  PRO  55           HG3      PRO  55 310.132  -9.298   5.692
  454    HD2  PRO  55           HD2      PRO  55 308.965 -11.376   4.534
  455    HD3  PRO  55           HD3      PRO  55 308.780 -11.118   6.281
  456    H    ILE  56           H        ILE  56 305.084  -7.274   5.989
  457    HA   ILE  56           HA       ILE  56 304.287  -7.182   3.156
  458    HB   ILE  56           HB       ILE  56 302.682  -6.667   5.609
  459   HG12  ILE  56          HG12      ILE  56 303.211  -8.966   3.990
  460   HG13  ILE  56          HG13      ILE  56 302.352  -8.829   5.508
  461   HG21  ILE  56          HG21      ILE  56 301.947  -5.061   4.052
  462   HG22  ILE  56          HG22      ILE  56 300.751  -6.358   4.160
  463   HG23  ILE  56          HG23      ILE  56 301.853  -6.277   2.770
  464   HD11  ILE  56          HD11      ILE  56 300.315  -8.469   4.469
  465   HD12  ILE  56          HD12      ILE  56 301.092  -9.797   3.601
  466   HD13  ILE  56          HD13      ILE  56 301.077  -8.182   2.903
  467    H    ASN  57           H        ASN  57 303.615  -5.436   2.197
  468    HA   ASN  57           HA       ASN  57 304.397  -2.819   3.279
  469    HB2  ASN  57           HB2      ASN  57 304.655  -3.957   0.536
  470    HB3  ASN  57           HB3      ASN  57 304.779  -2.234   0.823
  471   HD21  ASN  57          HD21      ASN  57 306.246  -2.138   3.093
  472   HD22  ASN  57          HD22      ASN  57 307.795  -2.830   2.819
  473    H    GLU  58           H        GLU  58 303.021  -1.075   2.757
  474    HA   GLU  58           HA       GLU  58 300.303  -1.599   2.717
  475    HB2  GLU  58           HB2      GLU  58 302.023   0.748   2.446
  476    HB3  GLU  58           HB3      GLU  58 300.501   0.911   1.581
  477    HG2  GLU  58           HG2      GLU  58 299.276   0.410   3.623
  478    HG3  GLU  58           HG3      GLU  58 300.798   0.219   4.493
  479    H    THR  59           H        THR  59 302.522  -1.043   0.051
  480    HA   THR  59           HA       THR  59 300.386  -1.069  -1.893
  481    HB   THR  59           HB       THR  59 302.292  -0.836  -3.519
  482    HG1  THR  59           HG1      THR  59 303.901  -1.788  -2.190
  483   HG21  THR  59          HG21      THR  59 301.772   1.299  -3.250
  484   HG22  THR  59          HG22      THR  59 303.049   1.383  -2.036
  485   HG23  THR  59          HG23      THR  59 301.384   1.052  -1.545
  486    H    ASP  60           H        ASP  60 302.561  -3.369  -0.514
  487    HA   ASP  60           HA       ASP  60 302.805  -5.222  -2.580
  488    HB2  ASP  60           HB2      ASP  60 302.865  -5.413   0.388
  489    HB3  ASP  60           HB3      ASP  60 302.640  -6.909  -0.507
  490    H    THR  61           H        THR  61 301.478  -6.671  -3.517
  491    HA   THR  61           HA       THR  61 298.772  -6.956  -2.400
  492    HB   THR  61           HB       THR  61 297.788  -6.876  -4.470
  493    HG1  THR  61           HG1      THR  61 298.802  -8.235  -5.760
  494   HG21  THR  61          HG21      THR  61 300.172  -5.079  -4.825
  495   HG22  THR  61          HG22      THR  61 298.649  -4.656  -4.043
  496   HG23  THR  61          HG23      THR  61 298.683  -5.013  -5.774
  497    HA   PRO  62           HA       PRO  62 298.924 -11.325  -2.060
  498    HB2  PRO  62           HB2      PRO  62 296.755 -11.284  -4.128
  499    HB3  PRO  62           HB3      PRO  62 296.809 -12.153  -2.595
  500    HG2  PRO  62           HG2      PRO  62 295.360  -9.935  -2.909
  501    HG3  PRO  62           HG3      PRO  62 296.193 -10.289  -1.381
  502    HD2  PRO  62           HD2      PRO  62 296.817  -8.275  -3.449
  503    HD3  PRO  62           HD3      PRO  62 297.232  -8.291  -1.724
  504    H    ALA  63           H        ALA  63 298.333 -10.149  -5.415
  505    HA   ALA  63           HA       ALA  63 299.477 -12.331  -6.790
  506    HB1  ALA  63           HB1      ALA  63 299.181 -11.043  -8.644
  507    HB2  ALA  63           HB2      ALA  63 299.810  -9.589  -7.844
  508    HB3  ALA  63           HB3      ALA  63 298.156 -10.126  -7.537
  509    H    GLN  64           H        GLN  64 300.645  -9.331  -5.564
  510    HA   GLN  64           HA       GLN  64 303.305  -9.457  -6.545
  511    HB2  GLN  64           HB2      GLN  64 301.506  -7.688  -5.221
  512    HB3  GLN  64           HB3      GLN  64 302.961  -7.764  -4.290
  513    HG2  GLN  64           HG2      GLN  64 302.860  -7.195  -7.224
  514    HG3  GLN  64           HG3      GLN  64 302.893  -5.950  -5.978
  515   HE21  GLN  64          HE21      GLN  64 304.773  -5.776  -4.653
  516   HE22  GLN  64          HE22      GLN  64 306.306  -6.324  -5.229
  517    H    LEU  65           H        LEU  65 301.593 -10.925  -4.089
  518    HA   LEU  65           HA       LEU  65 303.997 -11.626  -2.564
  519    HB2  LEU  65           HB2      LEU  65 301.160 -11.080  -1.769
  520    HB3  LEU  65           HB3      LEU  65 302.259 -11.893  -0.701
  521    HG   LEU  65           HG       LEU  65 302.374  -9.072  -1.730
  522   HD11  LEU  65          HD11      LEU  65 302.128  -8.400   0.456
  523   HD12  LEU  65          HD12      LEU  65 302.698  -9.938   1.108
  524   HD13  LEU  65          HD13      LEU  65 301.094  -9.828   0.386
  525   HD21  LEU  65          HD21      LEU  65 304.542  -8.896  -0.512
  526   HD22  LEU  65          HD22      LEU  65 304.595  -9.888  -1.969
  527   HD23  LEU  65          HD23      LEU  65 304.547 -10.656  -0.380
  528    H    GLU  66           H        GLU  66 302.067 -12.754  -4.821
  529    HA   GLU  66           HA       GLU  66 301.179 -14.737  -5.485
  530    HB2  GLU  66           HB2      GLU  66 303.566 -15.738  -3.904
  531    HB3  GLU  66           HB3      GLU  66 302.656 -16.694  -5.066
  532    HG2  GLU  66           HG2      GLU  66 303.626 -15.711  -6.840
  533    HG3  GLU  66           HG3      GLU  66 303.693 -14.129  -6.065
  534    H    MET  67           H        MET  67 299.712 -13.816  -3.518
  535    HA   MET  67           HA       MET  67 299.438 -15.777  -1.393
  536    HB2  MET  67           HB2      MET  67 298.139 -13.143  -2.005
  537    HB3  MET  67           HB3      MET  67 297.495 -14.191  -0.770
  538    HG2  MET  67           HG2      MET  67 300.117 -14.106  -0.090
  539    HG3  MET  67           HG3      MET  67 299.874 -12.493  -0.749
  540    HE1  MET  67           HE1      MET  67 299.548 -10.656   1.291
  541    HE2  MET  67           HE2      MET  67 297.818 -10.628   1.632
  542    HE3  MET  67           HE3      MET  67 298.388 -10.829  -0.025
  543    H    GLU  68           H        GLU  68 297.110 -16.458  -0.885
  544    HA   GLU  68           HA       GLU  68 295.740 -17.190  -3.395
  545    HB2  GLU  68           HB2      GLU  68 296.799 -18.894  -1.349
  546    HB3  GLU  68           HB3      GLU  68 295.039 -19.041  -1.393
  547    HG2  GLU  68           HG2      GLU  68 295.044 -19.914  -3.519
  548    HG3  GLU  68           HG3      GLU  68 296.586 -19.174  -3.946
  549    H    ASP  69           H        ASP  69 293.614 -18.345  -2.625
  550    HA   ASP  69           HA       ASP  69 292.073 -16.283  -1.316
  551    HB2  ASP  69           HB2      ASP  69 290.220 -17.190  -2.357
  552    HB3  ASP  69           HB3      ASP  69 291.502 -17.540  -3.509
  553    H    GLU  70           H        GLU  70 291.745 -16.341   0.629
  554    HA   GLU  70           HA       GLU  70 291.098 -17.005   2.778
  555    HB2  GLU  70           HB2      GLU  70 291.225 -19.698   1.480
  556    HB3  GLU  70           HB3      GLU  70 291.341 -19.606   3.227
  557    HG2  GLU  70           HG2      GLU  70 289.052 -19.999   2.400
  558    HG3  GLU  70           HG3      GLU  70 289.208 -18.545   3.382
  559    H    ASP  71           H        ASP  71 293.904 -17.185   1.161
  560    HA   ASP  71           HA       ASP  71 295.764 -18.462   2.676
  561    HB2  ASP  71           HB2      ASP  71 295.843 -16.702   0.574
  562    HB3  ASP  71           HB3      ASP  71 296.604 -15.766   1.850
  563    H    THR  72           H        THR  72 297.532 -16.586   3.718
  564    HA   THR  72           HA       THR  72 295.975 -15.326   5.847
  565    HB   THR  72           HB       THR  72 298.388 -17.028   6.372
  566    HG1  THR  72           HG1      THR  72 295.777 -17.536   7.270
  567   HG21  THR  72          HG21      THR  72 296.542 -15.994   8.460
  568   HG22  THR  72          HG22      THR  72 297.855 -14.977   7.868
  569   HG23  THR  72          HG23      THR  72 298.213 -16.539   8.610
  570    H    ILE  73           H        ILE  73 296.545 -13.456   6.360
  571    HA   ILE  73           HA       ILE  73 299.098 -12.361   5.426
  572    HB   ILE  73           HB       ILE  73 296.423 -11.062   6.006
  573   HG12  ILE  73          HG12      ILE  73 297.078 -11.364   3.740
  574   HG13  ILE  73          HG13      ILE  73 297.260  -9.674   4.156
  575   HG21  ILE  73          HG21      ILE  73 299.100 -10.018   6.856
  576   HG22  ILE  73          HG22      ILE  73 297.499  -9.646   7.496
  577   HG23  ILE  73          HG23      ILE  73 298.055  -8.880   6.006
  578   HD11  ILE  73          HD11      ILE  73 299.645 -10.400   4.770
  579   HD12  ILE  73          HD12      ILE  73 299.198  -9.967   3.116
  580   HD13  ILE  73          HD13      ILE  73 299.307 -11.665   3.589
  581    H    ASP  74           H        ASP  74 300.531 -11.957   6.962
  582    HA   ASP  74           HA       ASP  74 299.758 -12.690   9.682
  583    HB2  ASP  74           HB2      ASP  74 302.248 -12.881   8.118
  584    HB3  ASP  74           HB3      ASP  74 302.472 -12.347   9.783
  585    H    VAL  75           H        VAL  75 300.348 -11.331  11.444
  586    HA   VAL  75           HA       VAL  75 300.966  -8.605  10.594
  587    HB   VAL  75           HB       VAL  75 298.558  -9.418  12.129
  588   HG11  VAL  75          HG11      VAL  75 299.661  -8.247  13.909
  589   HG12  VAL  75          HG12      VAL  75 298.529  -7.105  13.186
  590   HG13  VAL  75          HG13      VAL  75 300.244  -6.991  12.810
  591   HG21  VAL  75          HG21      VAL  75 298.703  -8.471   9.769
  592   HG22  VAL  75          HG22      VAL  75 299.128  -6.938  10.521
  593   HG23  VAL  75          HG23      VAL  75 297.573  -7.684  10.867
  594    H    PHE  76           H        PHE  76 302.136  -7.423  11.746
  595    HA   PHE  76           HA       PHE  76 303.041  -8.208  14.397
  596    HB2  PHE  76           HB2      PHE  76 304.903  -7.503  12.133
  597    HB3  PHE  76           HB3      PHE  76 305.382  -7.760  13.794
  598    HD1  PHE  76           HD1      PHE  76 304.646 -10.079  14.792
  599    HD2  PHE  76           HD2      PHE  76 305.187  -9.293  10.633
  600    HE1  PHE  76           HE1      PHE  76 304.978 -12.478  14.385
  601    HE2  PHE  76           HE2      PHE  76 305.512 -11.683  10.241
  602    HZ   PHE  76           HZ       PHE  76 305.412 -13.286  12.102
  603    H    GLN  77           H        GLN  77 303.756  -6.362  15.552
  604    HA   GLN  77           HA       GLN  77 302.811  -3.890  14.305
  605    HB2  GLN  77           HB2      GLN  77 302.485  -5.016  16.901
  606    HB3  GLN  77           HB3      GLN  77 303.283  -3.455  17.059
  607    HG2  GLN  77           HG2      GLN  77 301.469  -2.312  16.333
  608    HG3  GLN  77           HG3      GLN  77 300.959  -3.603  15.237
  609   HE21  GLN  77          HE21      GLN  77 299.744  -5.320  16.052
  610   HE22  GLN  77          HE22      GLN  77 298.901  -5.211  17.555
  611    H    GLN  78           H        GLN  78 304.379  -2.735  13.394
  612    HA   GLN  78           HA       GLN  78 306.359  -1.730  12.982
  613    HB2  GLN  78           HB2      GLN  78 305.624  -1.150  15.646
  614    HB3  GLN  78           HB3      GLN  78 307.359  -1.424  15.648
  615    HG2  GLN  78           HG2      GLN  78 307.786   0.368  14.276
  616    HG3  GLN  78           HG3      GLN  78 306.165   0.357  13.583
  617   HE21  GLN  78          HE21      GLN  78 305.631   2.442  13.979
  618   HE22  GLN  78          HE22      GLN  78 305.459   3.113  15.562
  619    H    GLN  79           H        GLN  79 307.052  -3.868  12.171
  620    HA   GLN  79           HA       GLN  79 309.667  -4.435  12.691
  621    HB2  GLN  79           HB2      GLN  79 309.456  -6.651  13.889
  622    HB3  GLN  79           HB3      GLN  79 309.219  -5.222  14.880
  623    HG2  GLN  79           HG2      GLN  79 306.701  -5.617  14.312
  624    HG3  GLN  79           HG3      GLN  79 307.248  -7.258  13.971
  625   HE21  GLN  79          HE21      GLN  79 305.600  -5.892  16.154
  626   HE22  GLN  79          HE22      GLN  79 306.265  -6.524  17.617
  627    H    THR  80           H        THR  80 309.690  -4.715  10.466
  628    HA   THR  80           HA       THR  80 309.001  -7.358   9.556
  629    HB   THR  80           HB       THR  80 307.663  -6.497   7.604
  630    HG1  THR  80           HG1      THR  80 307.214  -4.452   7.461
  631   HG21  THR  80          HG21      THR  80 305.576  -6.280   8.752
  632   HG22  THR  80          HG22      THR  80 306.401  -5.903  10.267
  633   HG23  THR  80          HG23      THR  80 306.550  -7.513   9.558
  634    H    GLY  81           H        GLY  81 309.025  -5.142   6.977
  635    HA2  GLY  81           HA2      GLY  81 310.914  -4.158   5.877
  636    HA3  GLY  81           HA3      GLY  81 311.950  -5.302   6.716
  637    H    GLY  82           H        GLY  82 309.508  -4.996   4.173
  638    HA2  GLY  82           HA2      GLY  82 310.864  -7.153   2.725
  639    HA3  GLY  82           HA3      GLY  82 309.146  -7.332   3.036
  640    H1   GLY   1           HT1      GLY   1 320.990   7.957  17.460
  641    H2   GLY   1           HT2      GLY   1 320.189   7.471  16.051
  642    H3   GLY   1           HT3      GLY   1 321.793   7.004  16.316
  643    HA2  GLY   1           HA3      GLY   1 321.156   5.182  17.364
  644    HA3  GLY   1           HA2      GLY   1 320.278   6.171  18.520
  645    H    SER   2           H        SER   2 319.773   5.610  15.044
  646    HA   SER   2           HA       SER   2 317.073   4.627  15.702
  647    HB2  SER   2           HB2      SER   2 316.538   5.500  13.317
  648    HB3  SER   2           HB3      SER   2 316.684   6.673  14.626
  649    HG   SER   2           HG       SER   2 318.390   7.485  13.697
  650    H    GLU   3           H        GLU   3 316.188   3.541  13.483
  651    HA   GLU   3           HA       GLU   3 318.013   2.072  11.925
  652    HB2  GLU   3           HB2      GLU   3 317.476   0.987  14.544
  653    HB3  GLU   3           HB3      GLU   3 316.897  -0.112  13.300
  654    HG2  GLU   3           HG2      GLU   3 319.683   1.015  13.460
  655    HG3  GLU   3           HG3      GLU   3 319.198  -0.591  14.000
  656    H    GLU   4           H        GLU   4 316.584   2.708  10.310
  657    HA   GLU   4           HA       GLU   4 313.926   1.435  10.335
  658    HB2  GLU   4           HB2      GLU   4 314.798   3.686   8.523
  659    HB3  GLU   4           HB3      GLU   4 313.163   3.151   8.873
  660    HG2  GLU   4           HG2      GLU   4 313.205   4.987  10.187
  661    HG3  GLU   4           HG3      GLU   4 313.873   3.832  11.338
  662    H    LYS   5           H        LYS   5 313.558   1.859   7.522
  663    HA   LYS   5           HA       LYS   5 313.977   0.995   5.473
  664    HB2  LYS   5           HB2      LYS   5 316.631   0.752   6.733
  665    HB3  LYS   5           HB3      LYS   5 316.333  -0.301   5.363
  666    HG2  LYS   5           HG2      LYS   5 317.388   1.870   4.799
  667    HG3  LYS   5           HG3      LYS   5 315.876   1.543   3.949
  668    HD2  LYS   5           HD2      LYS   5 315.529   3.685   4.590
  669    HD3  LYS   5           HD3      LYS   5 314.834   2.855   5.976
  670    HE2  LYS   5           HE2      LYS   5 317.052   3.067   7.106
  671    HE3  LYS   5           HE3      LYS   5 317.572   4.088   5.770
  672    HZ1  LYS   5           HZ1      LYS   5 315.071   4.892   6.958
  673    HZ2  LYS   5           HZ2      LYS   5 316.426   5.824   6.564
  674    HZ3  LYS   5           HZ3      LYS   5 316.383   4.971   8.023
  675    HA   PRO   6           HA       PRO   6 312.611  -3.153   5.334
  676    HB2  PRO   6           HB2      PRO   6 314.590  -3.676   3.204
  677    HB3  PRO   6           HB3      PRO   6 312.834  -3.815   3.155
  678    HG2  PRO   6           HG2      PRO   6 314.210  -1.820   1.947
  679    HG3  PRO   6           HG3      PRO   6 312.559  -1.621   2.552
  680    HD2  PRO   6           HD2      PRO   6 315.110  -0.560   3.630
  681    HD3  PRO   6           HD3      PRO   6 313.458   0.041   3.828
  682    H    LYS   7           H        LYS   7 315.879  -2.426   6.096
  683    HA   LYS   7           HA       LYS   7 317.589  -3.643   6.972
  684    HB2  LYS   7           HB2      LYS   7 315.760  -4.165   8.634
  685    HB3  LYS   7           HB3      LYS   7 315.431  -5.630   7.718
  686    HG2  LYS   7           HG2      LYS   7 316.818  -6.100   9.647
  687    HG3  LYS   7           HG3      LYS   7 317.691  -6.417   8.149
  688    HD2  LYS   7           HD2      LYS   7 319.260  -4.906   8.635
  689    HD3  LYS   7           HD3      LYS   7 318.056  -3.688   9.060
  690    HE2  LYS   7           HE2      LYS   7 318.450  -5.900  10.984
  691    HE3  LYS   7           HE3      LYS   7 319.769  -4.741  10.831
  692    HZ1  LYS   7           HZ1      LYS   7 317.137  -4.401  11.979
  693    HZ2  LYS   7           HZ2      LYS   7 317.643  -3.121  10.995
  694    HZ3  LYS   7           HZ3      LYS   7 318.582  -3.589  12.321
  695    H    GLU   8           H        GLU   8 317.849  -3.848   4.526
  696    HA   GLU   8           HA       GLU   8 318.550  -5.072   2.739
  697    HB2  GLU   8           HB2      GLU   8 318.765  -7.063   4.967
  698    HB3  GLU   8           HB3      GLU   8 319.011  -7.592   3.308
  699    HG2  GLU   8           HG2      GLU   8 320.634  -5.473   3.326
  700    HG3  GLU   8           HG3      GLU   8 320.695  -5.891   5.038
  701    H    GLY   9           H        GLY   9 316.152  -4.534   2.270
  702    HA2  GLY   9           HA2      GLY   9 314.594  -7.005   2.127
  703    HA3  GLY   9           HA3      GLY   9 313.892  -5.402   2.123
  704    H    VAL  10           H        VAL  10 316.648  -6.281   0.259
  705    HA   VAL  10           HA       VAL  10 315.544  -5.417  -2.186
  706    HB   VAL  10           HB       VAL  10 317.944  -5.432  -1.857
  707   HG11  VAL  10          HG11      VAL  10 319.165  -7.194  -1.162
  708   HG12  VAL  10          HG12      VAL  10 318.241  -8.350  -2.122
  709   HG13  VAL  10          HG13      VAL  10 317.606  -7.780  -0.576
  710   HG21  VAL  10          HG21      VAL  10 318.424  -5.853  -4.018
  711   HG22  VAL  10          HG22      VAL  10 316.694  -6.169  -4.152
  712   HG23  VAL  10          HG23      VAL  10 317.821  -7.508  -3.936
  713    H    LYS  11           H        LYS  11 313.554  -6.508  -2.472
  714    HA   LYS  11           HA       LYS  11 313.775  -9.391  -2.966
  715    HB2  LYS  11           HB2      LYS  11 311.504  -7.710  -2.142
  716    HB3  LYS  11           HB3      LYS  11 311.217  -9.201  -3.011
  717    HG2  LYS  11           HG2      LYS  11 311.288 -10.134  -1.005
  718    HG3  LYS  11           HG3      LYS  11 313.016 -10.049  -1.219
  719    HD2  LYS  11           HD2      LYS  11 312.391  -9.197   0.965
  720    HD3  LYS  11           HD3      LYS  11 313.088  -7.939  -0.054
  721    HE2  LYS  11           HE2      LYS  11 310.401  -7.758  -0.602
  722    HE3  LYS  11           HE3      LYS  11 310.423  -8.141   1.115
  723    HZ1  LYS  11           HZ3      LYS  11 311.812  -6.237   1.523
  724    H    THR  12           H        THR  12 314.801  -8.657  -5.085
  725    HA   THR  12           HA       THR  12 314.519  -8.922  -7.344
  726    HB   THR  12           HB       THR  12 312.467  -9.216  -8.379
  727    HG1  THR  12           HG1      THR  12 310.963  -7.811  -8.100
  728   HG21  THR  12          HG21      THR  12 311.361 -10.787  -7.157
  729   HG22  THR  12          HG22      THR  12 311.444  -9.850  -5.657
  730   HG23  THR  12          HG23      THR  12 312.879 -10.684  -6.264
  731    H    GLU  13           H        GLU  13 312.051  -6.460  -6.682
  732    HA   GLU  13           HA       GLU  13 313.768  -4.233  -7.115
  733    HB2  GLU  13           HB2      GLU  13 311.974  -5.048  -9.411
  734    HB3  GLU  13           HB3      GLU  13 312.619  -3.427  -9.217
  735    HG2  GLU  13           HG2      GLU  13 314.339  -4.076 -10.429
  736    HG3  GLU  13           HG3      GLU  13 314.852  -5.041  -9.052
  737    H    ASN  14           H        ASN  14 312.432  -2.192  -7.435
  738    HA   ASN  14           HA       ASN  14 310.926  -0.769  -6.494
  739    HB2  ASN  14           HB2      ASN  14 309.686  -2.305  -8.335
  740    HB3  ASN  14           HB3      ASN  14 308.674  -2.579  -6.922
  741   HD21  ASN  14          HD21      ASN  14 308.854  -0.809  -9.579
  742   HD22  ASN  14          HD22      ASN  14 308.087   0.648  -9.057
  743    H    ASP  15           H        ASP  15 312.076  -1.663  -4.442
  744    HA   ASP  15           HA       ASP  15 310.052  -1.892  -2.428
  745    HB2  ASP  15           HB2      ASP  15 311.808  -4.234  -3.088
  746    HB3  ASP  15           HB3      ASP  15 311.256  -3.972  -1.437
  747    H    HIS  16           H        HIS  16 311.494   0.160  -2.561
  748    HA   HIS  16           HA       HIS  16 313.496   1.246  -2.047
  749    HB2  HIS  16           HB2      HIS  16 312.171   0.732   0.580
  750    HB3  HIS  16           HB3      HIS  16 313.162   2.091   0.129
  751    HD1  HIS  16           HD1      HIS  16 309.704   1.082   0.304
  752    HD2  HIS  16           HD2      HIS  16 311.959   3.734  -1.970
  753    HE1  HIS  16           HE1      HIS  16 308.045   2.696  -0.684
  754    HE2  HIS  16           HE2      HIS  16 309.441   4.352  -1.972
  755    H    ILE  17           H        ILE  17 315.487   1.164  -1.519
  756    HA   ILE  17           HA       ILE  17 316.465  -0.794   0.422
  757    HB   ILE  17           HB       ILE  17 318.442  -1.306  -0.824
  758   HG12  ILE  17          HG12      ILE  17 317.353   0.470  -2.990
  759   HG13  ILE  17          HG13      ILE  17 318.774   0.781  -2.029
  760   HG21  ILE  17          HG21      ILE  17 317.401  -3.006  -1.797
  761   HG22  ILE  17          HG22      ILE  17 316.804  -1.952  -3.087
  762   HG23  ILE  17          HG23      ILE  17 315.873  -2.143  -1.598
  763   HD11  ILE  17          HD11      ILE  17 318.558  -0.633  -4.484
  764   HD12  ILE  17          HD12      ILE  17 319.158  -1.726  -3.236
  765   HD13  ILE  17          HD13      ILE  17 320.013  -0.207  -3.561
  766    H    ASN  18           H        ASN  18 318.483  -0.117   1.371
  767    HA   ASN  18           HA       ASN  18 318.595   2.776   1.457
  768    HB2  ASN  18           HB2      ASN  18 320.617   1.782   3.160
  769    HB3  ASN  18           HB3      ASN  18 319.058   2.453   3.631
  770   HD21  ASN  18          HD21      ASN  18 317.268   0.597   3.052
  771   HD22  ASN  18          HD22      ASN  18 317.598  -0.890   3.866
  772    H    LEU  19           H        LEU  19 320.209   3.932   0.505
  773    HA   LEU  19           HA       LEU  19 322.347   2.371  -0.744
  774    HB2  LEU  19           HB2      LEU  19 320.503   4.238  -1.877
  775    HB3  LEU  19           HB3      LEU  19 322.134   4.857  -2.069
  776    HG   LEU  19           HG       LEU  19 320.950   2.281  -3.110
  777   HD11  LEU  19          HD11      LEU  19 322.003   3.047  -5.227
  778   HD12  LEU  19          HD12      LEU  19 322.401   4.554  -4.412
  779   HD13  LEU  19          HD13      LEU  19 320.718   4.089  -4.621
  780   HD21  LEU  19          HD21      LEU  19 323.623   2.566  -2.104
  781   HD22  LEU  19          HD22      LEU  19 323.664   2.348  -3.858
  782   HD23  LEU  19          HD23      LEU  19 322.830   1.163  -2.846
  783    H    LYS  20           H        LYS  20 324.286   2.715  -0.095
  784    HA   LYS  20           HA       LYS  20 324.862   4.911   1.703
  785    HB2  LYS  20           HB2      LYS  20 325.831   2.287   1.247
  786    HB3  LYS  20           HB3      LYS  20 327.172   3.373   1.036
  787    HG2  LYS  20           HG2      LYS  20 326.791   4.311   3.165
  788    HG3  LYS  20           HG3      LYS  20 325.340   3.401   3.365
  789    HD2  LYS  20           HD2      LYS  20 328.039   2.692   3.983
  790    HD3  LYS  20           HD3      LYS  20 326.535   1.904   4.462
  791    HE2  LYS  20           HE2      LYS  20 326.685   0.348   2.839
  792    HE3  LYS  20           HE3      LYS  20 327.458   1.447   1.696
  793    HZ1  LYS  20           HZ1      LYS  20 329.532   1.059   2.593
  794    HZ2  LYS  20           HZ2      LYS  20 328.819  -0.471   2.695
  795    HZ3  LYS  20           HZ3      LYS  20 328.921   0.507   4.071
  796    H    VAL  21           H        VAL  21 326.219   6.673   1.216
  797    HA   VAL  21           HA       VAL  21 327.509   6.724  -1.436
  798    HB   VAL  21           HB       VAL  21 326.557   9.272  -0.211
  799   HG11  VAL  21          HG11      VAL  21 326.533   8.364  -3.075
  800   HG12  VAL  21          HG12      VAL  21 327.954   9.055  -2.292
  801   HG13  VAL  21          HG13      VAL  21 326.482  10.013  -2.450
  802   HG21  VAL  21          HG21      VAL  21 324.345   9.092  -1.136
  803   HG22  VAL  21          HG22      VAL  21 324.605   7.710  -0.073
  804   HG23  VAL  21          HG23      VAL  21 324.709   7.508  -1.822
  805    H    ALA  22           H        ALA  22 329.646   7.407  -1.341
  806    HA   ALA  22           HA       ALA  22 330.616   8.276   1.311
  807    HB1  ALA  22           HB1      ALA  22 332.218   6.741   1.138
  808    HB2  ALA  22           HB2      ALA  22 332.734   7.392  -0.421
  809    HB3  ALA  22           HB3      ALA  22 331.458   6.168  -0.350
  810    H    GLY  23           H        GLY  23 331.412  10.364   1.459
  811    HA2  GLY  23           HA2      GLY  23 332.151  11.634  -1.107
  812    HA3  GLY  23           HA3      GLY  23 331.077  12.432   0.010
  813    H    GLN  24           H        GLN  24 334.383  11.207  -0.348
  814    HA   GLN  24           HA       GLN  24 336.379  11.986   0.409
  815    HB2  GLN  24           HB2      GLN  24 335.191  14.652   0.963
  816    HB3  GLN  24           HB3      GLN  24 336.750  14.252   0.272
  817    HG2  GLN  24           HG2      GLN  24 335.209  13.299  -1.659
  818    HG3  GLN  24           HG3      GLN  24 334.115  14.533  -1.028
  819   HE21  GLN  24          HE21      GLN  24 336.646  13.919  -3.108
  820   HE22  GLN  24          HE22      GLN  24 337.152  15.544  -3.403
  821    H    ASP  25           H        ASP  25 333.657  12.312   2.490
  822    HA   ASP  25           HA       ASP  25 334.842  13.381   4.773
  823    HB2  ASP  25           HB2      ASP  25 332.380  12.910   4.361
  824    HB3  ASP  25           HB3      ASP  25 332.722  11.243   4.809
  825    H    GLY  26           H        GLY  26 335.482  10.409   3.245
  826    HA2  GLY  26           HA2      GLY  26 337.173   8.913   3.849
  827    HA3  GLY  26           HA3      GLY  26 337.200   9.627   5.457
  828    H    SER  27           H        SER  27 334.050   9.236   4.864
  829    HA   SER  27           HA       SER  27 333.948   6.446   5.775
  830    HB2  SER  27           HB2      SER  27 333.642   8.244   7.614
  831    HB3  SER  27           HB3      SER  27 332.085   8.557   6.848
  832    HG   SER  27           HG       SER  27 331.476   6.983   8.120
  833    H    VAL  28           H        VAL  28 330.925   7.147   6.035
  834    HA   VAL  28           HA       VAL  28 330.232   7.376   3.239
  835    HB   VAL  28           HB       VAL  28 330.765   5.085   3.271
  836   HG11  VAL  28          HG11      VAL  28 329.861   3.500   4.914
  837   HG12  VAL  28          HG12      VAL  28 329.094   4.838   5.770
  838   HG13  VAL  28          HG13      VAL  28 330.854   4.749   5.668
  839   HG21  VAL  28          HG21      VAL  28 328.684   4.026   2.686
  840   HG22  VAL  28          HG22      VAL  28 328.586   5.720   2.205
  841   HG23  VAL  28          HG23      VAL  28 327.765   5.169   3.671
  842    H    VAL  29           H        VAL  29 327.916   7.357   2.884
  843    HA   VAL  29           HA       VAL  29 326.355   8.095   5.266
  844    HB   VAL  29           HB       VAL  29 324.866   9.317   3.479
  845   HG11  VAL  29          HG11      VAL  29 325.830  11.412   4.084
  846   HG12  VAL  29          HG12      VAL  29 327.364  10.637   4.496
  847   HG13  VAL  29          HG13      VAL  29 325.921  10.308   5.461
  848   HG21  VAL  29          HG21      VAL  29 327.557   9.768   2.251
  849   HG22  VAL  29          HG22      VAL  29 325.980  10.289   1.664
  850   HG23  VAL  29          HG23      VAL  29 326.404   8.583   1.642
  851    H    GLN  30           H        GLN  30 324.181   7.418   5.181
  852    HA   GLN  30           HA       GLN  30 323.779   5.213   3.266
  853    HB2  GLN  30           HB2      GLN  30 323.627   5.353   6.121
  854    HB3  GLN  30           HB3      GLN  30 322.157   4.676   5.446
  855    HG2  GLN  30           HG2      GLN  30 323.615   3.081   4.189
  856    HG3  GLN  30           HG3      GLN  30 324.988   3.720   5.103
  857   HE21  GLN  30          HE21      GLN  30 325.135   3.291   7.310
  858   HE22  GLN  30          HE22      GLN  30 324.233   2.023   8.060
  859    H    PHE  31           H        PHE  31 322.227   5.466   1.921
  860    HA   PHE  31           HA       PHE  31 320.085   7.388   2.412
  861    HB2  PHE  31           HB2      PHE  31 321.308   6.247  -0.111
  862    HB3  PHE  31           HB3      PHE  31 319.822   7.123  -0.142
  863    HD1  PHE  31           HD1      PHE  31 322.949   7.672   1.776
  864    HD2  PHE  31           HD2      PHE  31 320.205   9.206  -1.087
  865    HE1  PHE  31           HE1      PHE  31 324.174   9.788   1.741
  866    HE2  PHE  31           HE2      PHE  31 321.452  11.323  -1.131
  867    HZ   PHE  31           HZ       PHE  31 323.431  11.612   0.288
  868    H    LYS  32           H        LYS  32 318.029   6.797   1.251
  869    HA   LYS  32           HA       LYS  32 317.510   3.932   1.239
  870    HB2  LYS  32           HB2      LYS  32 316.600   4.575   3.364
  871    HB3  LYS  32           HB3      LYS  32 315.831   5.974   2.660
  872    HG2  LYS  32           HG2      LYS  32 314.711   3.994   1.192
  873    HG3  LYS  32           HG3      LYS  32 314.947   3.181   2.741
  874    HD2  LYS  32           HD2      LYS  32 313.513   5.811   2.327
  875    HD3  LYS  32           HD3      LYS  32 312.736   4.249   2.571
  876    HE2  LYS  32           HE2      LYS  32 313.611   4.084   4.799
  877    HE3  LYS  32           HE3      LYS  32 314.630   5.503   4.551
  878    HZ1  LYS  32           HZ1      LYS  32 312.783   6.914   4.574
  879    HZ2  LYS  32           HZ2      LYS  32 312.497   5.832   5.842
  880    HZ3  LYS  32           HZ3      LYS  32 311.681   5.646   4.373
  881    H    ILE  33           H        ILE  33 317.142   3.583  -0.708
  882    HA   ILE  33           HA       ILE  33 315.307   5.271  -2.239
  883    HB   ILE  33           HB       ILE  33 317.617   6.094  -2.683
  884   HG12  ILE  33          HG12      ILE  33 316.941   4.672  -5.204
  885   HG13  ILE  33          HG13      ILE  33 315.639   5.614  -4.492
  886   HG21  ILE  33          HG21      ILE  33 319.306   4.752  -3.556
  887   HG22  ILE  33          HG22      ILE  33 318.201   3.438  -3.952
  888   HG23  ILE  33          HG23      ILE  33 318.603   3.778  -2.268
  889   HD11  ILE  33          HD11      ILE  33 318.252   6.531  -5.593
  890   HD12  ILE  33          HD12      ILE  33 317.393   7.509  -4.402
  891   HD13  ILE  33          HD13      ILE  33 316.620   7.105  -5.936
  892    H    LYS  34           H        LYS  34 314.008   4.156  -3.551
  893    HA   LYS  34           HA       LYS  34 314.020   1.327  -3.435
  894    HB2  LYS  34           HB2      LYS  34 311.983   2.712  -3.695
  895    HB3  LYS  34           HB3      LYS  34 312.497   3.103  -5.318
  896    HG2  LYS  34           HG2      LYS  34 312.238   0.861  -6.044
  897    HG3  LYS  34           HG3      LYS  34 312.014   0.286  -4.395
  898    HD2  LYS  34           HD2      LYS  34 310.090   1.499  -6.257
  899    HD3  LYS  34           HD3      LYS  34 309.825   0.378  -4.925
  900    HE2  LYS  34           HE2      LYS  34 310.140   2.287  -3.360
  901    HE3  LYS  34           HE3      LYS  34 310.194   3.370  -4.751
  902    HZ1  LYS  34           HZ1      LYS  34 307.944   2.320  -3.404
  903    HZ2  LYS  34           HZ2      LYS  34 307.913   1.788  -5.009
  904    HZ3  LYS  34           HZ3      LYS  34 307.989   3.443  -4.669
  905    H    ARG  35           H        ARG  35 313.977  -0.031  -5.393
  906    HA   ARG  35           HA       ARG  35 316.456   0.063  -6.632
  907    HB2  ARG  35           HB2      ARG  35 313.935  -1.443  -7.212
  908    HB3  ARG  35           HB3      ARG  35 315.367  -1.662  -8.183
  909    HG2  ARG  35           HG2      ARG  35 315.772  -1.856  -5.287
  910    HG3  ARG  35           HG3      ARG  35 314.791  -3.115  -6.018
  911    HD2  ARG  35           HD2      ARG  35 317.610  -2.363  -6.727
  912    HD3  ARG  35           HD3      ARG  35 317.046  -3.863  -5.994
  913    HE   ARG  35           HE       ARG  35 315.802  -3.474  -8.497
  914   HH11  ARG  35          HH11      ARG  35 318.856  -4.367  -7.067
  915   HH12  ARG  35          HH12      ARG  35 319.357  -5.320  -8.424
  916   HH21  ARG  35          HH21      ARG  35 316.464  -4.724 -10.289
  917   HH22  ARG  35          HH22      ARG  35 317.999  -5.522 -10.251
  918    H    HIS  36           H        HIS  36 313.415   0.167  -8.469
  919    HA   HIS  36           HA       HIS  36 314.615   1.308 -10.733
  920    HB2  HIS  36           HB2      HIS  36 312.601  -0.024 -10.887
  921    HB3  HIS  36           HB3      HIS  36 311.701   1.161  -9.952
  922    HD1  HIS  36           HD1      HIS  36 310.050   1.960 -11.660
  923    HD2  HIS  36           HD2      HIS  36 313.952   1.992 -13.087
  924    HE1  HIS  36           HE1      HIS  36 309.938   3.102 -13.897
  925    HE2  HIS  36           HE2      HIS  36 312.294   3.022 -14.784
  926    H    THR  37           H        THR  37 314.222   2.890  -7.887
  927    HA   THR  37           HA       THR  37 313.169   5.375  -8.904
  928    HB   THR  37           HB       THR  37 314.499   4.723  -6.275
  929    HG1  THR  37           HG1      THR  37 311.817   5.387  -6.852
  930   HG21  THR  37          HG21      THR  37 314.120   7.279  -7.447
  931   HG22  THR  37          HG22      THR  37 314.638   6.875  -5.802
  932   HG23  THR  37          HG23      THR  37 312.922   7.075  -6.155
  933    HA   PRO  38           HA       PRO  38 316.822   6.814 -11.027
  934    HB2  PRO  38           HB2      PRO  38 315.694   9.356 -10.062
  935    HB3  PRO  38           HB3      PRO  38 316.083   8.854 -11.717
  936    HG2  PRO  38           HG2      PRO  38 313.528   8.900 -10.484
  937    HG3  PRO  38           HG3      PRO  38 313.941   8.237 -12.069
  938    HD2  PRO  38           HD2      PRO  38 313.081   6.840  -9.812
  939    HD3  PRO  38           HD3      PRO  38 313.767   6.146 -11.288
  940    H    LEU  39           H        LEU  39 318.804   7.553 -10.327
  941    HA   LEU  39           HA       LEU  39 319.179   7.580  -7.494
  942    HB2  LEU  39           HB2      LEU  39 320.993   7.683  -9.850
  943    HB3  LEU  39           HB3      LEU  39 321.609   8.144  -8.267
  944    HG   LEU  39           HG       LEU  39 320.192   5.523  -8.757
  945   HD11  LEU  39          HD11      LEU  39 322.318   5.855 -10.157
  946   HD12  LEU  39          HD12      LEU  39 322.272   4.451  -9.088
  947   HD13  LEU  39          HD13      LEU  39 323.189   5.881  -8.622
  948   HD21  LEU  39          HD21      LEU  39 322.211   5.781  -6.641
  949   HD22  LEU  39          HD22      LEU  39 320.591   5.088  -6.591
  950   HD23  LEU  39          HD23      LEU  39 320.809   6.833  -6.424
  951    H    SER  40           H        SER  40 318.591  10.119  -9.827
  952    HA   SER  40           HA       SER  40 320.009  12.208  -8.769
  953    HB2  SER  40           HB2      SER  40 317.677  11.839 -10.455
  954    HB3  SER  40           HB3      SER  40 317.504  13.266  -9.433
  955    HG   SER  40           HG       SER  40 319.058  12.910 -11.604
  956    H    LYS  41           H        LYS  41 317.418  10.449  -7.270
  957    HA   LYS  41           HA       LYS  41 316.619  12.538  -5.489
  958    HB2  LYS  41           HB2      LYS  41 316.073   9.672  -5.950
  959    HB3  LYS  41           HB3      LYS  41 315.659  10.337  -4.405
  960    HG2  LYS  41           HG2      LYS  41 313.862  11.405  -5.207
  961    HG3  LYS  41           HG3      LYS  41 314.708  11.905  -6.675
  962    HD2  LYS  41           HD2      LYS  41 314.328   9.051  -6.601
  963    HD3  LYS  41           HD3      LYS  41 312.785   9.889  -6.450
  964    HE2  LYS  41           HE2      LYS  41 314.345  11.160  -8.471
  965    HE3  LYS  41           HE3      LYS  41 314.334   9.421  -8.762
  966    HZ1  LYS  41           HZ1      LYS  41 312.485  10.547  -9.858
  967    HZ2  LYS  41           HZ2      LYS  41 311.918  11.101  -8.364
  968    HZ3  LYS  41           HZ3      LYS  41 311.932   9.444  -8.700
  969    H    LEU  42           H        LEU  42 318.998  10.159  -5.807
  970    HA   LEU  42           HA       LEU  42 319.746   9.984  -3.024
  971    HB2  LEU  42           HB2      LEU  42 319.697   8.090  -4.745
  972    HB3  LEU  42           HB3      LEU  42 321.171   8.799  -5.379
  973    HG   LEU  42           HG       LEU  42 321.109   8.229  -2.483
  974   HD11  LEU  42          HD11      LEU  42 320.439   6.137  -2.758
  975   HD12  LEU  42          HD12      LEU  42 322.023   5.888  -3.485
  976   HD13  LEU  42          HD13      LEU  42 320.627   6.208  -4.510
  977   HD21  LEU  42          HD21      LEU  42 323.146   9.060  -3.110
  978   HD22  LEU  42          HD22      LEU  42 323.047   8.357  -4.728
  979   HD23  LEU  42          HD23      LEU  42 323.437   7.335  -3.341
  980    H    MET  43           H        MET  43 320.997  11.245  -6.070
  981    HA   MET  43           HA       MET  43 323.542  11.944  -5.189
  982    HB2  MET  43           HB2      MET  43 321.931  13.208  -7.396
  983    HB3  MET  43           HB3      MET  43 323.668  13.374  -7.176
  984    HG2  MET  43           HG2      MET  43 322.867  10.600  -7.219
  985    HG3  MET  43           HG3      MET  43 322.344  11.448  -8.668
  986    HE1  MET  43           HE1      MET  43 325.638   9.400  -9.614
  987    HE2  MET  43           HE2      MET  43 323.900   9.582  -9.912
  988    HE3  MET  43           HE3      MET  43 324.467   8.971  -8.358
  989    H    LYS  44           H        LYS  44 320.598  13.889  -5.142
  990    HA   LYS  44           HA       LYS  44 321.975  16.278  -4.270
  991    HB2  LYS  44           HB2      LYS  44 319.842  16.440  -5.428
  992    HB3  LYS  44           HB3      LYS  44 319.033  15.683  -4.067
  993    HG2  LYS  44           HG2      LYS  44 319.178  18.332  -4.396
  994    HG3  LYS  44           HG3      LYS  44 319.073  17.569  -2.822
  995    HD2  LYS  44           HD2      LYS  44 320.969  18.574  -2.271
  996    HD3  LYS  44           HD3      LYS  44 321.801  17.702  -3.522
  997    HE2  LYS  44           HE2      LYS  44 322.227  19.935  -3.988
  998    HE3  LYS  44           HE3      LYS  44 320.981  19.449  -5.131
  999    HZ1  LYS  44           HZ1      LYS  44 320.230  20.694  -2.568
 1000    HZ2  LYS  44           HZ2      LYS  44 319.374  20.659  -4.026
 1001    HZ3  LYS  44           HZ3      LYS  44 320.726  21.662  -3.864
 1002    H    ALA  45           H        ALA  45 319.901  13.924  -2.538
 1003    HA   ALA  45           HA       ALA  45 319.808  14.959  -0.054
 1004    HB1  ALA  45           HB1      ALA  45 320.536  12.378   0.611
 1005    HB2  ALA  45           HB2      ALA  45 319.905  12.221  -1.040
 1006    HB3  ALA  45           HB3      ALA  45 318.899  12.934   0.217
 1007    H    TYR  46           H        TYR  46 322.627  13.141  -1.282
 1008    HA   TYR  46           HA       TYR  46 324.193  13.416   0.997
 1009    HB2  TYR  46           HB2      TYR  46 324.637  12.041  -1.178
 1010    HB3  TYR  46           HB3      TYR  46 325.466  13.501  -1.709
 1011    HD1  TYR  46           HD1      TYR  46 325.487  12.868   1.833
 1012    HD2  TYR  46           HD2      TYR  46 327.551  12.097  -1.806
 1013    HE1  TYR  46           HE1      TYR  46 327.432  12.184   3.107
 1014    HE2  TYR  46           HE2      TYR  46 329.524  11.382  -0.532
 1015    HH   TYR  46           HH       TYR  46 329.514  10.564   2.595
 1016    H    CYS  47           H        CYS  47 323.366  15.698  -1.410
 1017    HA   CYS  47           HA       CYS  47 325.521  17.523  -0.861
 1018    HB2  CYS  47           HB2      CYS  47 323.025  18.213  -2.344
 1019    HB3  CYS  47           HB3      CYS  47 324.665  18.669  -2.692
 1020    HG   CYS  47           HG       CYS  47 323.642  15.831  -3.310
 1021    H    GLU  48           H        GLU  48 322.256  16.862   0.091
 1022    HA   GLU  48           HA       GLU  48 321.928  19.400   1.453
 1023    HB2  GLU  48           HB2      GLU  48 320.092  17.022   1.686
 1024    HB3  GLU  48           HB3      GLU  48 319.703  18.725   1.877
 1025    HG2  GLU  48           HG2      GLU  48 319.884  19.089  -0.506
 1026    HG3  GLU  48           HG3      GLU  48 320.464  17.447  -0.749
 1027    H    ARG  49           H        ARG  49 323.206  16.316   1.888
 1028    HA   ARG  49           HA       ARG  49 322.952  16.048   4.729
 1029    HB2  ARG  49           HB2      ARG  49 323.819  14.539   2.421
 1030    HB3  ARG  49           HB3      ARG  49 324.949  14.376   3.735
 1031    HG2  ARG  49           HG2      ARG  49 323.529  13.119   4.963
 1032    HG3  ARG  49           HG3      ARG  49 322.117  14.031   4.421
 1033    HD2  ARG  49           HD2      ARG  49 323.375  12.556   2.265
 1034    HD3  ARG  49           HD3      ARG  49 322.843  11.513   3.561
 1035    HE   ARG  49           HE       ARG  49 321.082  13.339   2.101
 1036   HH11  ARG  49          HH11      ARG  49 321.581  10.497   4.074
 1037   HH12  ARG  49          HH12      ARG  49 319.918  10.034   4.043
 1038   HH21  ARG  49          HH21      ARG  49 318.884  12.732   2.082
 1039   HH22  ARG  49          HH22      ARG  49 318.388  11.294   2.906
 1040    H    GLN  50           H        GLN  50 325.524  16.633   2.374
 1041    HA   GLN  50           HA       GLN  50 327.396  17.417   4.467
 1042    HB2  GLN  50           HB2      GLN  50 327.952  17.138   1.564
 1043    HB3  GLN  50           HB3      GLN  50 329.113  17.142   2.852
 1044    HG2  GLN  50           HG2      GLN  50 328.112  14.988   3.628
 1045    HG3  GLN  50           HG3      GLN  50 327.153  14.986   2.151
 1046   HE21  GLN  50          HE21      GLN  50 328.089  14.479   0.241
 1047   HE22  GLN  50          HE22      GLN  50 329.721  13.953   0.074
 1048    H    GLY  51           H        GLY  51 325.624  18.663   1.754
 1049    HA2  GLY  51           HA2      GLY  51 325.110  20.981   1.480
 1050    HA3  GLY  51           HA3      GLY  51 326.565  21.375   2.399
 1051    H    LEU  52           H        LEU  52 325.614  19.612  -0.547
 1052    HA   LEU  52           HA       LEU  52 327.993  20.700  -1.891
 1053    HB2  LEU  52           HB2      LEU  52 326.689  18.047  -2.490
 1054    HB3  LEU  52           HB3      LEU  52 328.247  18.642  -3.037
 1055    HG   LEU  52           HG       LEU  52 327.951  18.461  -0.117
 1056   HD11  LEU  52          HD11      LEU  52 328.608  15.869  -1.265
 1057   HD12  LEU  52          HD12      LEU  52 326.919  16.335  -1.465
 1058   HD13  LEU  52          HD13      LEU  52 327.636  16.280   0.150
 1059   HD21  LEU  52          HD21      LEU  52 330.110  17.232  -1.721
 1060   HD22  LEU  52          HD22      LEU  52 330.184  18.110  -0.189
 1061   HD23  LEU  52          HD23      LEU  52 329.949  18.998  -1.709
 1062    H    SER  53           H        SER  53 327.713  21.398  -4.005
 1063    HA   SER  53           HA       SER  53 325.209  22.386  -4.723
 1064    HB2  SER  53           HB2      SER  53 326.946  21.917  -7.030
 1065    HB3  SER  53           HB3      SER  53 326.311  23.425  -6.381
 1066    HG   SER  53           HG       SER  53 328.625  22.013  -5.575
 1067    H    MET  54           H        MET  54 326.094  19.175  -4.766
 1068    HA   MET  54           HA       MET  54 325.058  17.302  -5.532
 1069    HB2  MET  54           HB2      MET  54 322.919  18.342  -5.095
 1070    HB3  MET  54           HB3      MET  54 322.992  19.249  -6.574
 1071    HG2  MET  54           HG2      MET  54 323.170  16.900  -7.670
 1072    HG3  MET  54           HG3      MET  54 322.452  16.373  -6.158
 1073    HE1  MET  54           HE1      MET  54 320.527  19.171  -9.256
 1074    HE2  MET  54           HE2      MET  54 321.722  17.944  -9.677
 1075    HE3  MET  54           HE3      MET  54 322.180  19.307  -8.656
 1076    H    ARG  55           H        ARG  55 324.417  19.634  -8.047
 1077    HA   ARG  55           HA       ARG  55 325.043  17.935 -10.183
 1078    HB2  ARG  55           HB2      ARG  55 325.591  20.410 -11.191
 1079    HB3  ARG  55           HB3      ARG  55 323.972  19.735 -11.054
 1080    HG2  ARG  55           HG2      ARG  55 323.520  20.939  -9.074
 1081    HG3  ARG  55           HG3      ARG  55 325.222  21.366  -8.862
 1082    HD2  ARG  55           HD2      ARG  55 323.276  22.411 -10.905
 1083    HD3  ARG  55           HD3      ARG  55 324.159  23.313  -9.678
 1084    HE   ARG  55           HE       ARG  55 326.149  23.038 -10.969
 1085   HH11  ARG  55          HH11      ARG  55 323.237  21.995 -12.605
 1086   HH12  ARG  55          HH12      ARG  55 323.945  22.100 -14.180
 1087   HH21  ARG  55          HH21      ARG  55 327.068  23.168 -13.041
 1088   HH22  ARG  55          HH22      ARG  55 326.114  22.761 -14.429
 1089    H    GLN  56           H        GLN  56 326.985  19.942  -8.087
 1090    HA   GLN  56           HA       GLN  56 329.327  19.956  -9.658
 1091    HB2  GLN  56           HB2      GLN  56 328.470  20.838  -6.988
 1092    HB3  GLN  56           HB3      GLN  56 330.197  20.560  -7.184
 1093    HG2  GLN  56           HG2      GLN  56 329.871  22.017  -9.337
 1094    HG3  GLN  56           HG3      GLN  56 328.442  22.586  -8.475
 1095   HE21  GLN  56          HE21      GLN  56 328.736  24.303  -7.262
 1096   HE22  GLN  56          HE22      GLN  56 330.225  24.809  -6.548
 1097    H    ILE  57           H        ILE  57 328.223  17.680  -7.122
 1098    HA   ILE  57           HA       ILE  57 330.847  16.630  -6.759
 1099    HB   ILE  57           HB       ILE  57 329.626  14.620  -5.759
 1100   HG12  ILE  57          HG12      ILE  57 327.389  16.383  -6.471
 1101   HG13  ILE  57          HG13      ILE  57 327.427  14.641  -6.247
 1102   HG21  ILE  57          HG21      ILE  57 330.773  16.464  -4.524
 1103   HG22  ILE  57          HG22      ILE  57 329.485  15.622  -3.652
 1104   HG23  ILE  57          HG23      ILE  57 329.186  17.220  -4.353
 1105   HD11  ILE  57          HD11      ILE  57 327.535  15.040  -3.803
 1106   HD12  ILE  57          HD12      ILE  57 326.046  15.582  -4.573
 1107   HD13  ILE  57          HD13      ILE  57 327.294  16.759  -4.136
 1108    H    ARG  58           H        ARG  58 331.156  14.231  -7.011
 1109    HA   ARG  58           HA       ARG  58 330.163  13.359  -9.625
 1110    HB2  ARG  58           HB2      ARG  58 332.841  12.414  -8.978
 1111    HB3  ARG  58           HB3      ARG  58 332.226  13.134 -10.462
 1112    HG2  ARG  58           HG2      ARG  58 332.905  14.760  -8.033
 1113    HG3  ARG  58           HG3      ARG  58 334.083  14.371  -9.278
 1114    HD2  ARG  58           HD2      ARG  58 332.757  15.508 -10.925
 1115    HD3  ARG  58           HD3      ARG  58 331.477  15.792  -9.762
 1116    HE   ARG  58           HE       ARG  58 333.772  16.926  -8.725
 1117   HH11  ARG  58          HH11      ARG  58 331.796  17.338 -11.569
 1118   HH12  ARG  58          HH12      ARG  58 332.194  19.013 -11.756
 1119   HH21  ARG  58          HH21      ARG  58 334.298  19.129  -8.968
 1120   HH22  ARG  58          HH22      ARG  58 333.615  20.030 -10.279
 1121    H    PHE  59           H        PHE  59 329.056  11.515  -9.313
 1122    HA   PHE  59           HA       PHE  59 329.734   9.898  -6.966
 1123    HB2  PHE  59           HB2      PHE  59 327.244  10.026  -8.644
 1124    HB3  PHE  59           HB3      PHE  59 327.561   8.710  -7.558
 1125    HD1  PHE  59           HD2      PHE  59 328.481  12.187  -6.729
 1126    HD2  PHE  59           HD1      PHE  59 325.650   9.041  -6.255
 1127    HE1  PHE  59           HE2      PHE  59 327.426  13.398  -4.873
 1128    HE2  PHE  59           HE1      PHE  59 324.591  10.263  -4.416
 1129    HZ   PHE  59           HZ       PHE  59 325.483  12.454  -3.718
 1130    H    ARG  60           H        ARG  60 329.726   7.640  -7.104
 1131    HA   ARG  60           HA       ARG  60 329.823   6.336  -9.648
 1132    HB2  ARG  60           HB2      ARG  60 332.270   7.254  -8.826
 1133    HB3  ARG  60           HB3      ARG  60 332.228   5.677  -8.067
 1134    HG2  ARG  60           HG2      ARG  60 331.436   4.963 -10.489
 1135    HG3  ARG  60           HG3      ARG  60 332.336   6.408 -10.927
 1136    HD2  ARG  60           HD2      ARG  60 334.242   5.479  -9.562
 1137    HD3  ARG  60           HD3      ARG  60 333.320   3.982  -9.467
 1138    HE   ARG  60           HE       ARG  60 333.574   4.794 -12.159
 1139   HH11  ARG  60          HH11      ARG  60 335.434   3.420  -9.545
 1140   HH12  ARG  60          HH12      ARG  60 336.533   2.593 -10.596
 1141   HH21  ARG  60          HH21      ARG  60 335.019   3.708 -13.542
 1142   HH22  ARG  60          HH22      ARG  60 336.299   2.757 -12.866
 1143    H    PHE  61           H        PHE  61 329.036   4.323  -9.389
 1144    HA   PHE  61           HA       PHE  61 328.630   3.425  -6.643
 1145    HB2  PHE  61           HB2      PHE  61 326.571   3.269  -7.755
 1146    HB3  PHE  61           HB3      PHE  61 327.300   2.765  -9.272
 1147    HD1  PHE  61           HD1      PHE  61 326.994   1.621  -5.753
 1148    HD2  PHE  61           HD2      PHE  61 327.074   0.551  -9.865
 1149    HE1  PHE  61           HE1      PHE  61 326.549  -0.729  -5.148
 1150    HE2  PHE  61           HE2      PHE  61 326.621  -1.796  -9.275
 1151    HZ   PHE  61           HZ       PHE  61 326.358  -2.438  -6.911
 1152    H    ASP  62           H        ASP  62 329.284   1.186  -6.128
 1153    HA   ASP  62           HA       ASP  62 331.846   0.612  -6.627
 1154    HB2  ASP  62           HB2      ASP  62 330.301  -0.539  -5.047
 1155    HB3  ASP  62           HB3      ASP  62 329.817  -1.525  -6.404
 1156    H    GLY  63           H        GLY  63 332.216   1.219  -8.876
 1157    HA2  GLY  63           HA2      GLY  63 333.213   0.061 -10.709
 1158    HA3  GLY  63           HA3      GLY  63 331.905  -1.113 -10.642
 1159    H    GLN  64           H        GLN  64 330.153   1.516 -10.261
 1160    HA   GLN  64           HA       GLN  64 330.056   2.127 -13.136
 1161    HB2  GLN  64           HB2      GLN  64 328.144   0.762 -12.306
 1162    HB3  GLN  64           HB3      GLN  64 327.710   2.118 -11.281
 1163    HG2  GLN  64           HG2      GLN  64 326.938   3.365 -13.004
 1164    HG3  GLN  64           HG3      GLN  64 328.065   2.676 -14.153
 1165   HE21  GLN  64          HE21      GLN  64 325.922   0.887 -12.033
 1166   HE22  GLN  64          HE22      GLN  64 324.948   0.208 -13.285
 1167    HA   PRO  65           HA       PRO  65 330.595   6.384 -11.904
 1168    HB2  PRO  65           HB2      PRO  65 329.737   7.051 -14.615
 1169    HB3  PRO  65           HB3      PRO  65 331.331   7.204 -13.896
 1170    HG2  PRO  65           HG2      PRO  65 330.844   5.427 -15.819
 1171    HG3  PRO  65           HG3      PRO  65 331.906   5.015 -14.453
 1172    HD2  PRO  65           HD2      PRO  65 328.967   4.429 -14.772
 1173    HD3  PRO  65           HD3      PRO  65 330.281   3.308 -14.411
 1174    H    ILE  66           H        ILE  66 327.736   5.187 -13.321
 1175    HA   ILE  66           HA       ILE  66 325.594   5.822 -13.509
 1176    HB   ILE  66           HB       ILE  66 324.585   6.451 -11.410
 1177   HG12  ILE  66          HG12      ILE  66 327.390   6.768 -10.362
 1178   HG13  ILE  66          HG13      ILE  66 326.350   8.084 -10.764
 1179   HG21  ILE  66          HG21      ILE  66 326.845   4.598 -10.745
 1180   HG22  ILE  66          HG22      ILE  66 325.645   4.152 -11.954
 1181   HG23  ILE  66          HG23      ILE  66 325.143   4.485 -10.294
 1182   HD11  ILE  66          HD11      ILE  66 326.039   6.044  -8.596
 1183   HD12  ILE  66          HD12      ILE  66 324.707   7.090  -9.102
 1184   HD13  ILE  66          HD13      ILE  66 326.177   7.797  -8.431
 1185    H    ASN  67           H        ASN  67 324.011   7.776 -13.257
 1186    HA   ASN  67           HA       ASN  67 325.343  10.338 -13.648
 1187    HB2  ASN  67           HB2      ASN  67 323.436   9.518 -15.782
 1188    HB3  ASN  67           HB3      ASN  67 324.716  10.721 -15.848
 1189   HD21  ASN  67          HD21      ASN  67 323.803   7.701 -16.825
 1190   HD22  ASN  67          HD22      ASN  67 325.354   7.054 -17.228
 1191    H    GLU  68           H        GLU  68 324.041  10.135 -11.622
 1192    HA   GLU  68           HA       GLU  68 322.195  10.510 -10.338
 1193    HB2  GLU  68           HB2      GLU  68 321.376  12.918 -11.648
 1194    HB3  GLU  68           HB3      GLU  68 322.213  12.689 -10.118
 1195    HG2  GLU  68           HG2      GLU  68 324.303  12.834 -11.088
 1196    HG3  GLU  68           HG3      GLU  68 323.675  12.514 -12.699
 1197    H    THR  69           H        THR  69 321.450   9.424 -13.344
 1198    HA   THR  69           HA       THR  69 318.586   9.730 -12.821
 1199    HB   THR  69           HB       THR  69 318.132   9.856 -15.166
 1200    HG1  THR  69           HG1      THR  69 319.664   8.617 -16.117
 1201   HG21  THR  69          HG21      THR  69 318.961  11.927 -13.931
 1202   HG22  THR  69          HG22      THR  69 318.931  11.968 -15.696
 1203   HG23  THR  69          HG23      THR  69 320.456  11.710 -14.842
 1204    H    ASP  70           H        ASP  70 321.135   7.704 -12.886
 1205    HA   ASP  70           HA       ASP  70 319.851   5.372 -14.023
 1206    HB2  ASP  70           HB2      ASP  70 322.454   5.866 -12.607
 1207    HB3  ASP  70           HB3      ASP  70 321.893   4.254 -12.968
 1208    H    THR  71           H        THR  71 318.586   4.068 -12.838
 1209    HA   THR  71           HA       THR  71 318.288   4.745 -10.034
 1210    HB   THR  71           HB       THR  71 316.243   3.809 -10.054
 1211    HG1  THR  71           HG1      THR  71 316.947   2.061 -12.170
 1212   HG21  THR  71          HG21      THR  71 316.692   4.327 -12.982
 1213   HG22  THR  71          HG22      THR  71 316.051   5.453 -11.782
 1214   HG23  THR  71          HG23      THR  71 315.112   4.038 -12.258
 1215    HA   PRO  72           HA       PRO  72 320.809   1.663  -8.404
 1216    HB2  PRO  72           HB2      PRO  72 318.630   0.722  -6.630
 1217    HB3  PRO  72           HB3      PRO  72 320.242   1.342  -6.240
 1218    HG2  PRO  72           HG2      PRO  72 317.923   2.778  -5.938
 1219    HG3  PRO  72           HG3      PRO  72 319.537   3.482  -6.113
 1220    HD2  PRO  72           HD2      PRO  72 317.305   3.434  -8.009
 1221    HD3  PRO  72           HD3      PRO  72 318.747   4.465  -7.987
 1222    H    ALA  73           H        ALA  73 317.485   0.588  -9.092
 1223    HA   ALA  73           HA       ALA  73 317.999  -2.148  -9.352
 1224    HB1  ALA  73           HB1      ALA  73 315.804  -0.518  -9.755
 1225    HB2  ALA  73           HB2      ALA  73 315.852  -2.266  -9.968
 1226    HB3  ALA  73           HB3      ALA  73 316.113  -1.197 -11.350
 1227    H    GLN  74           H        GLN  74 317.772   0.232 -12.029
 1228    HA   GLN  74           HA       GLN  74 318.564  -1.324 -14.084
 1229    HB2  GLN  74           HB2      GLN  74 318.393   1.435 -13.487
 1230    HB3  GLN  74           HB3      GLN  74 319.760   1.156 -14.521
 1231    HG2  GLN  74           HG2      GLN  74 316.894   0.451 -15.043
 1232    HG3  GLN  74           HG3      GLN  74 317.879   1.649 -15.882
 1233   HE21  GLN  74          HE21      GLN  74 317.019  -1.661 -15.623
 1234   HE22  GLN  74          HE22      GLN  74 317.957  -2.241 -16.952
 1235    H    LEU  75           H        LEU  75 320.579   0.152 -11.638
 1236    HA   LEU  75           HA       LEU  75 323.024  -0.656 -12.964
 1237    HB2  LEU  75           HB2      LEU  75 322.693   0.669 -10.277
 1238    HB3  LEU  75           HB3      LEU  75 324.121   0.674 -11.298
 1239    HG   LEU  75           HG       LEU  75 321.583   2.262 -11.598
 1240   HD11  LEU  75          HD11      LEU  75 323.743   3.771 -12.346
 1241   HD12  LEU  75          HD12      LEU  75 324.394   2.750 -11.063
 1242   HD13  LEU  75          HD13      LEU  75 322.983   3.760 -10.756
 1243   HD21  LEU  75          HD21      LEU  75 321.538   1.723 -13.777
 1244   HD22  LEU  75          HD22      LEU  75 323.199   1.121 -13.774
 1245   HD23  LEU  75          HD23      LEU  75 322.890   2.853 -13.886
 1246    H    GLU  76           H        GLU  76 320.794  -1.844 -10.769
 1247    HA   GLU  76           HA       GLU  76 320.580  -3.800  -9.750
 1248    HB2  GLU  76           HB2      GLU  76 323.352  -4.377 -10.780
 1249    HB3  GLU  76           HB3      GLU  76 322.314  -5.551  -9.980
 1250    HG2  GLU  76           HG2      GLU  76 320.623  -4.718 -11.862
 1251    HG3  GLU  76           HG3      GLU  76 322.147  -4.410 -12.698
 1252    H    MET  77           H        MET  77 321.660  -1.449  -8.419
 1253    HA   MET  77           HA       MET  77 323.639  -1.978  -6.538
 1254    HB2  MET  77           HB2      MET  77 321.115  -0.523  -5.792
 1255    HB3  MET  77           HB3      MET  77 322.748  -0.215  -5.228
 1256    HG2  MET  77           HG2      MET  77 321.879   0.204  -8.065
 1257    HG3  MET  77           HG3      MET  77 321.781   1.446  -6.829
 1258    HE1  MET  77           HE1      MET  77 322.834   3.062  -7.197
 1259    HE2  MET  77           HE2      MET  77 323.794   3.052  -8.688
 1260    HE3  MET  77           HE3      MET  77 324.591   3.300  -7.130
 1261    H    GLU  78           H        GLU  78 322.678  -1.929  -3.962
 1262    HA   GLU  78           HA       GLU  78 320.632  -3.876  -3.593
 1263    HB2  GLU  78           HB2      GLU  78 323.516  -4.561  -3.264
 1264    HB3  GLU  78           HB3      GLU  78 322.379  -5.173  -2.081
 1265    HG2  GLU  78           HG2      GLU  78 321.621  -6.735  -3.459
 1266    HG3  GLU  78           HG3      GLU  78 321.466  -5.602  -4.797
 1267    H    ASP  79           H        ASP  79 320.466  -4.289  -1.185
 1268    HA   ASP  79           HA       ASP  79 320.234  -1.823   0.127
 1269    HB2  ASP  79           HB2      ASP  79 319.542  -4.537   0.653
 1270    HB3  ASP  79           HB3      ASP  79 320.316  -3.872   2.091
 1271    H    GLU  80           H        GLU  80 321.668  -0.584   1.095
 1272    HA   GLU  80           HA       GLU  80 323.403   0.067   2.456
 1273    HB2  GLU  80           HB2      GLU  80 324.404  -2.772   2.481
 1274    HB3  GLU  80           HB3      GLU  80 324.837  -1.465   3.570
 1275    HG2  GLU  80           HG2      GLU  80 322.452  -1.405   4.318
 1276    HG3  GLU  80           HG3      GLU  80 322.194  -2.875   3.381
 1277    H    ASP  81           H        ASP  81 323.643  -1.216  -0.641
 1278    HA   ASP  81           HA       ASP  81 326.373  -1.270  -1.107
 1279    HB2  ASP  81           HB2      ASP  81 324.117  -0.364  -2.890
 1280    HB3  ASP  81           HB3      ASP  81 325.777  -0.483  -3.442
 1281    H    THR  82           H        THR  82 327.734   0.372  -2.000
 1282    HA   THR  82           HA       THR  82 327.053   3.043  -0.942
 1283    HB   THR  82           HB       THR  82 329.873   2.140  -1.462
 1284    HG1  THR  82           HG1      THR  82 329.072   0.655  -0.006
 1285   HG21  THR  82          HG21      THR  82 329.052   3.958   0.735
 1286   HG22  THR  82          HG22      THR  82 329.059   4.588  -0.919
 1287   HG23  THR  82          HG23      THR  82 330.541   3.934  -0.221
 1288    H    ILE  83           H        ILE  83 327.698   4.892  -2.102
 1289    HA   ILE  83           HA       ILE  83 328.510   4.505  -4.904
 1290    HB   ILE  83           HB       ILE  83 326.296   6.259  -3.846
 1291   HG12  ILE  83          HG12      ILE  83 326.246   4.314  -6.147
 1292   HG13  ILE  83          HG13      ILE  83 325.906   3.826  -4.487
 1293   HG21  ILE  83          HG21      ILE  83 326.928   7.788  -5.381
 1294   HG22  ILE  83          HG22      ILE  83 326.374   6.638  -6.600
 1295   HG23  ILE  83          HG23      ILE  83 328.073   6.680  -6.132
 1296   HD11  ILE  83          HD11      ILE  83 324.125   5.523  -4.417
 1297   HD12  ILE  83          HD12      ILE  83 323.854   4.240  -5.600
 1298   HD13  ILE  83          HD13      ILE  83 324.406   5.829  -6.131
 1299    H    ASP  84           H        ASP  84 330.596   5.239  -4.630
 1300    HA   ASP  84           HA       ASP  84 331.322   7.217  -2.848
 1301    HB2  ASP  84           HB2      ASP  84 332.607   5.471  -4.618
 1302    HB3  ASP  84           HB3      ASP  84 333.221   7.084  -4.951
 1303    H    VAL  85           H        VAL  85 331.676   9.217  -2.850
 1304    HA   VAL  85           HA       VAL  85 331.056  10.930  -5.183
 1305    HB   VAL  85           HB       VAL  85 330.653  11.412  -2.221
 1306   HG11  VAL  85          HG11      VAL  85 330.440  13.393  -4.486
 1307   HG12  VAL  85          HG12      VAL  85 331.514  13.479  -3.091
 1308   HG13  VAL  85          HG13      VAL  85 329.770  13.660  -2.874
 1309   HG21  VAL  85          HG21      VAL  85 328.355  12.064  -3.536
 1310   HG22  VAL  85          HG22      VAL  85 328.675  10.540  -2.704
 1311   HG23  VAL  85          HG23      VAL  85 328.940  10.670  -4.443
 1312    H    PHE  86           H        PHE  86 332.746  12.143  -5.901
 1313    HA   PHE  86           HA       PHE  86 334.865  12.845  -4.016
 1314    HB2  PHE  86           HB2      PHE  86 335.179  11.235  -6.518
 1315    HB3  PHE  86           HB3      PHE  86 336.431  12.398  -6.098
 1316    HD1  PHE  86           HD2      PHE  86 337.440  12.216  -3.735
 1317    HD2  PHE  86           HD1      PHE  86 335.205   9.112  -5.599
 1318    HE1  PHE  86           HE2      PHE  86 338.445  10.576  -2.200
 1319    HE2  PHE  86           HE1      PHE  86 336.205   7.466  -4.068
 1320    HZ   PHE  86           HZ       PHE  86 337.828   8.198  -2.366
 1321    H    GLN  87           H        GLN  87 334.621  14.933  -4.043
 1322    HA   GLN  87           HA       GLN  87 334.842  16.333  -6.597
 1323    HB2  GLN  87           HB2      GLN  87 332.405  15.907  -5.875
 1324    HB3  GLN  87           HB3      GLN  87 332.667  17.187  -4.710
 1325    HG2  GLN  87           HG2      GLN  87 333.576  18.031  -7.297
 1326    HG3  GLN  87           HG3      GLN  87 331.950  17.399  -7.407
 1327   HE21  GLN  87          HE21      GLN  87 330.465  18.179  -5.497
 1328   HE22  GLN  87          HE22      GLN  87 330.557  19.878  -5.184
 1329    H    GLN  88           H        GLN  88 336.168  17.954  -6.532
 1330    HA   GLN  88           HA       GLN  88 337.730  18.681  -4.396
 1331    HB2  GLN  88           HB2      GLN  88 336.931  20.403  -6.737
 1332    HB3  GLN  88           HB3      GLN  88 338.282  20.735  -5.665
 1333    HG2  GLN  88           HG2      GLN  88 338.606  18.094  -6.582
 1334    HG3  GLN  88           HG3      GLN  88 338.170  19.070  -7.984
 1335   HE21  GLN  88          HE21      GLN  88 340.586  17.984  -8.023
 1336   HE22  GLN  88          HE22      GLN  88 341.817  19.159  -7.729
 1337    H    GLN  89           H        GLN  89 337.247  19.571  -2.518
 1338    HA   GLN  89           HA       GLN  89 334.800  20.848  -1.946
 1339    HB2  GLN  89           HB2      GLN  89 337.367  21.042  -0.362
 1340    HB3  GLN  89           HB3      GLN  89 335.735  21.305   0.237
 1341    HG2  GLN  89           HG2      GLN  89 335.195  18.982  -0.065
 1342    HG3  GLN  89           HG3      GLN  89 336.757  18.681  -0.823
 1343   HE21  GLN  89          HE21      GLN  89 338.376  18.044   0.425
 1344   HE22  GLN  89          HE22      GLN  89 338.398  18.099   2.151
 1345    H    THR  90           H        THR  90 334.368  23.032  -1.429
 1346    HA   THR  90           HA       THR  90 336.353  25.043  -2.081
 1347    HB   THR  90           HB       THR  90 334.780  26.175  -3.691
 1348    HG1  THR  90           HG1      THR  90 332.887  25.327  -3.870
 1349   HG21  THR  90          HG21      THR  90 335.827  23.468  -4.484
 1350   HG22  THR  90          HG22      THR  90 336.651  25.021  -4.635
 1351   HG23  THR  90          HG23      THR  90 335.222  24.683  -5.612
 1352    H1   THR   2           HT1      THR   2 288.589  -7.385  15.097
 1353    H2   THR   2           HT2      THR   2 287.179  -7.560  16.059
 1354    H3   THR   2           HT3      THR   2 287.086  -7.745  14.356
 1355    HA   THR   2           HA       THR   2 288.297  -9.706  14.394
 1356    HB   THR   2           HB       THR   2 289.035 -10.528  16.746
 1357    HG1  THR   2           HG1      THR   2 288.496  -9.141  18.225
 1358   HG21  THR   2          HG21      THR   2 290.905 -10.180  15.555
 1359   HG22  THR   2          HG22      THR   2 291.046  -8.766  16.599
 1360   HG23  THR   2          HG23      THR   2 290.375  -8.601  14.977
 1361    H    VAL   3           H        VAL   3 285.611  -9.120  14.395
 1362    HA   VAL   3           HA       VAL   3 284.543 -11.346  15.981
 1363    HB   VAL   3           HB       VAL   3 283.954  -9.279  17.167
 1364   HG11  VAL   3          HG11      VAL   3 283.928  -7.921  14.988
 1365   HG12  VAL   3          HG12      VAL   3 282.742  -7.520  16.231
 1366   HG13  VAL   3          HG13      VAL   3 282.261  -8.473  14.828
 1367   HG21  VAL   3          HG21      VAL   3 282.381 -11.347  16.814
 1368   HG22  VAL   3          HG22      VAL   3 281.397 -10.183  15.927
 1369   HG23  VAL   3          HG23      VAL   3 281.788  -9.896  17.623
 1370    H    GLY   4           H        GLY   4 283.917  -9.056  13.329
 1371    HA2  GLY   4           HA2      GLY   4 283.349 -10.991  11.414
 1372    HA3  GLY   4           HA3      GLY   4 281.818 -10.561  12.160
 1373    H    ASP   5           H        ASP   5 283.936  -9.845   9.701
 1374    HA   ASP   5           HA       ASP   5 282.417  -7.880   8.517
 1375    HB2  ASP   5           HB2      ASP   5 283.838  -6.798  10.714
 1376    HB3  ASP   5           HB3      ASP   5 284.637  -6.207   9.260
 1377    H    GLU   6           H        GLU   6 284.199  -6.302   7.182
 1378    HA   GLU   6           HA       GLU   6 286.588  -7.442   6.343
 1379    HB2  GLU   6           HB2      GLU   6 284.518  -9.040   5.498
 1380    HB3  GLU   6           HB3      GLU   6 284.784  -8.012   4.098
 1381    HG2  GLU   6           HG2      GLU   6 286.501  -9.266   3.509
 1382    HG3  GLU   6           HG3      GLU   6 287.317  -8.847   5.015
 1383    H    ILE   7           H        ILE   7 283.897  -6.328   4.289
 1384    HA   ILE   7           HA       ILE   7 283.624  -4.490   2.992
 1385    HB   ILE   7           HB       ILE   7 285.527  -3.150   4.918
 1386   HG12  ILE   7          HG12      ILE   7 282.812  -2.456   5.398
 1387   HG13  ILE   7          HG13      ILE   7 282.902  -4.213   5.326
 1388   HG21  ILE   7          HG21      ILE   7 283.734  -1.266   4.094
 1389   HG22  ILE   7          HG22      ILE   7 283.962  -2.218   2.627
 1390   HG23  ILE   7          HG23      ILE   7 285.352  -1.484   3.427
 1391   HD11  ILE   7          HD11      ILE   7 285.043  -3.051   6.903
 1392   HD12  ILE   7          HD12      ILE   7 283.903  -4.336   7.304
 1393   HD13  ILE   7          HD13      ILE   7 283.439  -2.647   7.514
 1394    H    VAL   8           H        VAL   8 286.653  -2.971   3.531
 1395    HA   VAL   8           HA       VAL   8 288.374  -2.486   2.148
 1396    HB   VAL   8           HB       VAL   8 289.693  -4.333   1.344
 1397   HG11  VAL   8          HG11      VAL   8 288.424  -4.571   4.032
 1398   HG12  VAL   8          HG12      VAL   8 290.068  -4.102   3.600
 1399   HG13  VAL   8          HG13      VAL   8 289.580  -5.794   3.504
 1400   HG21  VAL   8          HG21      VAL   8 287.529  -6.268   2.105
 1401   HG22  VAL   8          HG22      VAL   8 288.975  -6.548   1.136
 1402   HG23  VAL   8          HG23      VAL   8 287.639  -5.608   0.474
 1403    H    ASP   9           H        ASP   9 289.270  -2.551  -0.076
 1404    HA   ASP   9           HA       ASP   9 287.174  -2.882  -2.116
 1405    HB2  ASP   9           HB2      ASP   9 287.989  -0.438  -1.297
 1406    HB3  ASP   9           HB3      ASP   9 289.186  -0.748  -2.551
 1407    H    LEU  10           H        LEU  10 288.708  -2.253  -4.370
 1408    HA   LEU  10           HA       LEU  10 291.219  -3.580  -4.347
 1409    HB2  LEU  10           HB2      LEU  10 289.983  -5.348  -6.060
 1410    HB3  LEU  10           HB3      LEU  10 290.573  -5.691  -4.448
 1411    HG   LEU  10           HG       LEU  10 288.059  -4.700  -3.940
 1412   HD11  LEU  10          HD11      LEU  10 288.123  -5.706  -6.679
 1413   HD12  LEU  10          HD12      LEU  10 286.939  -4.684  -5.866
 1414   HD13  LEU  10          HD13      LEU  10 286.882  -6.433  -5.661
 1415   HD21  LEU  10          HD21      LEU  10 288.643  -7.597  -4.455
 1416   HD22  LEU  10          HD22      LEU  10 287.538  -6.893  -3.274
 1417   HD23  LEU  10          HD23      LEU  10 289.278  -6.727  -3.059
 1418    H    THR  11           H        THR  11 291.775  -4.343  -6.715
 1419    HA   THR  11           HA       THR  11 290.708  -3.339  -9.007
 1420    HB   THR  11           HB       THR  11 292.517  -1.268  -9.046
 1421    HG1  THR  11           HG1      THR  11 292.670  -1.634  -6.687
 1422   HG21  THR  11          HG21      THR  11 290.045  -0.247  -8.048
 1423   HG22  THR  11          HG22      THR  11 289.738  -1.537  -9.211
 1424   HG23  THR  11          HG23      THR  11 290.724  -0.150  -9.673
 1425    H    CYS  12           H        CYS  12 292.925  -2.346 -10.405
 1426    HA   CYS  12           HA       CYS  12 294.704  -4.678 -10.320
 1427    HB2  CYS  12           HB2      CYS  12 294.041  -2.714 -12.515
 1428    HB3  CYS  12           HB3      CYS  12 295.356  -3.877 -12.642
 1429    HG   CYS  12           HG       CYS  12 293.383  -5.033 -13.742
 1430    H    GLU  13           H        GLU  13 294.752  -1.145 -10.665
 1431    HA   GLU  13           HA       GLU  13 296.375   0.411 -10.307
 1432    HB2  GLU  13           HB2      GLU  13 296.176  -1.241  -8.038
 1433    HB3  GLU  13           HB3      GLU  13 297.896  -0.977  -8.287
 1434    HG2  GLU  13           HG2      GLU  13 297.371   0.791  -6.942
 1435    HG3  GLU  13           HG3      GLU  13 297.182   1.520  -8.536
 1436    H    SER  14           H        SER  14 299.038   0.184  -9.449
 1437    HA   SER  14           HA       SER  14 301.158  -0.326 -10.123
 1438    HB2  SER  14           HB2      SER  14 300.071  -2.386 -12.036
 1439    HB3  SER  14           HB3      SER  14 301.653  -2.337 -11.258
 1440    HG   SER  14           HG       SER  14 299.166  -3.089 -10.203
 1441    H    LEU  15           H        LEU  15 301.869   1.400 -11.193
 1442    HA   LEU  15           HA       LEU  15 301.352   1.538 -14.078
 1443    HB2  LEU  15           HB2      LEU  15 301.047   3.767 -12.079
 1444    HB3  LEU  15           HB3      LEU  15 301.297   4.076 -13.787
 1445    HG   LEU  15           HG       LEU  15 298.960   4.242 -13.374
 1446   HD11  LEU  15          HD11      LEU  15 298.061   2.602 -14.863
 1447   HD12  LEU  15          HD12      LEU  15 299.414   1.512 -14.561
 1448   HD13  LEU  15          HD13      LEU  15 299.678   3.027 -15.425
 1449   HD21  LEU  15          HD21      LEU  15 297.798   3.014 -11.906
 1450   HD22  LEU  15          HD22      LEU  15 299.378   2.503 -11.312
 1451   HD23  LEU  15          HD23      LEU  15 298.503   1.498 -12.467
 1452    H    GLU  16           H        GLU  16 303.080   3.662 -11.808
 1453    HA   GLU  16           HA       GLU  16 305.668   2.716 -12.411
 1454    HB2  GLU  16           HB2      GLU  16 306.470   4.598 -13.796
 1455    HB3  GLU  16           HB3      GLU  16 305.259   3.629 -14.624
 1456    HG2  GLU  16           HG2      GLU  16 303.594   5.399 -13.721
 1457    HG3  GLU  16           HG3      GLU  16 305.037   6.391 -13.517
 1458    HA   PRO  17           HA       PRO  17 305.303   5.784  -8.968
 1459    HB2  PRO  17           HB2      PRO  17 305.355   4.099  -6.860
 1460    HB3  PRO  17           HB3      PRO  17 303.869   4.504  -7.721
 1461    HG2  PRO  17           HG2      PRO  17 305.450   2.010  -7.767
 1462    HG3  PRO  17           HG3      PRO  17 303.728   2.258  -8.085
 1463    HD2  PRO  17           HD2      PRO  17 305.816   1.940  -9.992
 1464    HD3  PRO  17           HD3      PRO  17 304.113   2.316 -10.309
 1465    H    VAL  18           H        VAL  18 306.979   3.116  -7.441
 1466    HA   VAL  18           HA       VAL  18 309.015   3.161  -6.396
 1467    HB   VAL  18           HB       VAL  18 309.482   1.908  -8.391
 1468   HG11  VAL  18          HG11      VAL  18 310.702   3.367 -10.257
 1469   HG12  VAL  18          HG12      VAL  18 309.574   4.579  -9.657
 1470   HG13  VAL  18          HG13      VAL  18 308.969   3.046 -10.278
 1471   HG21  VAL  18          HG21      VAL  18 311.360   2.904  -6.805
 1472   HG22  VAL  18          HG22      VAL  18 311.870   3.663  -8.307
 1473   HG23  VAL  18          HG23      VAL  18 311.761   1.906  -8.202
 1474    H    VAL  19           H        VAL  19 309.149   4.986  -5.123
 1475    HA   VAL  19           HA       VAL  19 311.101   6.926  -5.902
 1476    HB   VAL  19           HB       VAL  19 309.472   8.875  -5.353
 1477   HG11  VAL  19          HG11      VAL  19 308.837   7.850  -8.039
 1478   HG12  VAL  19          HG12      VAL  19 310.553   7.945  -7.642
 1479   HG13  VAL  19          HG13      VAL  19 309.544   9.389  -7.545
 1480   HG21  VAL  19          HG21      VAL  19 307.664   6.878  -5.048
 1481   HG22  VAL  19          HG22      VAL  19 307.366   7.347  -6.722
 1482   HG23  VAL  19          HG23      VAL  19 307.246   8.548  -5.435
 1483    H    VAL  20           H        VAL  20 312.105   7.804  -4.147
 1484    HA   VAL  20           HA       VAL  20 310.955   8.385  -1.680
 1485    HB   VAL  20           HB       VAL  20 310.953   5.711  -1.836
 1486   HG11  VAL  20          HG11      VAL  20 312.833   4.758  -0.609
 1487   HG12  VAL  20          HG12      VAL  20 313.619   6.331  -0.562
 1488   HG13  VAL  20          HG13      VAL  20 313.377   5.514  -2.105
 1489   HG21  VAL  20          HG21      VAL  20 310.260   5.822   0.296
 1490   HG22  VAL  20          HG22      VAL  20 310.443   7.562   0.077
 1491   HG23  VAL  20          HG23      VAL  20 311.731   6.629   0.840
 1492    H    ASP  21           H        ASP  21 312.775   8.306   0.147
 1493    HA   ASP  21           HA       ASP  21 315.477   8.520  -0.628
 1494    HB2  ASP  21           HB2      ASP  21 314.384  10.633  -1.655
 1495    HB3  ASP  21           HB3      ASP  21 314.302  11.217   0.005
 1496    H    LEU  22           H        LEU  22 316.754   8.403   1.138
 1497    HA   LEU  22           HA       LEU  22 315.880   7.701   3.618
 1498    HB2  LEU  22           HB2      LEU  22 318.283   7.893   2.554
 1499    HB3  LEU  22           HB3      LEU  22 318.324   9.400   3.434
 1500    HG   LEU  22           HG       LEU  22 319.407   7.686   4.730
 1501   HD11  LEU  22          HD11      LEU  22 317.843   9.428   5.774
 1502   HD12  LEU  22          HD12      LEU  22 318.378   8.073   6.768
 1503   HD13  LEU  22          HD13      LEU  22 316.763   8.066   6.063
 1504   HD21  LEU  22          HD21      LEU  22 318.145   5.741   5.571
 1505   HD22  LEU  22          HD22      LEU  22 318.375   5.693   3.828
 1506   HD23  LEU  22          HD23      LEU  22 316.815   6.167   4.500
 1507    H    THR  23           H        THR  23 315.024   8.679   5.371
 1508    HA   THR  23           HA       THR  23 313.879  11.176   5.287
 1509    HB   THR  23           HB       THR  23 313.122   9.666   6.945
 1510    HG1  THR  23           HG1      THR  23 314.524  11.675   8.363
 1511   HG21  THR  23          HG21      THR  23 315.693   9.813   8.466
 1512   HG22  THR  23          HG22      THR  23 315.395   8.552   7.271
 1513   HG23  THR  23          HG23      THR  23 314.339   8.704   8.673
 1514    H    HIS  24           H        HIS  24 316.897  10.393   7.058
 1515    HA   HIS  24           HA       HIS  24 317.872  13.069   6.437
 1516    HB2  HIS  24           HB2      HIS  24 316.985  12.206   9.084
 1517    HB3  HIS  24           HB3      HIS  24 318.637  12.814   9.082
 1518    HD1  HIS  24           HD1      HIS  24 318.795  15.255   7.685
 1519    HD2  HIS  24           HD2      HIS  24 315.187  14.181   9.445
 1520    HE1  HIS  24           HE1      HIS  24 317.495  17.395   7.914
 1521    HE2  HIS  24           HE2      HIS  24 315.280  16.707   8.897
 1522    H    ASN  25           H        ASN  25 319.041  10.776   8.873
 1523    HA   ASN  25           HA       ASN  25 320.976   9.597   9.056
 1524    HB2  ASN  25           HB2      ASN  25 320.069   9.121   6.449
 1525    HB3  ASN  25           HB3      ASN  25 321.779   9.500   6.271
 1526   HD21  ASN  25          HD21      ASN  25 323.314   8.184   7.286
 1527   HD22  ASN  25          HD22      ASN  25 322.931   6.581   7.802
 1528    H    ASP  26           H        ASP  26 322.461  10.847  10.013
 1529    HA   ASP  26           HA       ASP  26 324.407  12.198   8.356
 1530    HB2  ASP  26           HB2      ASP  26 324.218  14.346   9.594
 1531    HB3  ASP  26           HB3      ASP  26 322.794  13.986   8.623
  Start of MODEL    7
    1    H1   GLY   1           HT1      GLY   1 287.235 -11.255 -16.001
    2    H2   GLY   1           HT2      GLY   1 287.587 -11.002 -17.635
    3    H3   GLY   1           HT3      GLY   1 288.838 -11.306 -16.538
    4    HA2  GLY   1           HA3      GLY   1 286.724 -13.203 -17.395
    5    HA3  GLY   1           HA2      GLY   1 288.431 -13.286 -17.804
    6    H    THR   2           H        THR   2 286.711 -12.704 -14.742
    7    HA   THR   2           HA       THR   2 286.841 -13.714 -12.711
    8    HB   THR   2           HB       THR   2 287.909 -16.235 -13.890
    9    HG1  THR   2           HG1      THR   2 285.249 -15.363 -14.320
   10   HG21  THR   2          HG21      THR   2 285.454 -16.536 -12.502
   11   HG22  THR   2          HG22      THR   2 286.522 -15.514 -11.541
   12   HG23  THR   2          HG23      THR   2 287.059 -17.113 -12.055
   13    H    GLU   3           H        GLU   3 288.352 -14.771 -11.152
   14    HA   GLU   3           HA       GLU   3 290.422 -15.171 -10.238
   15    HB2  GLU   3           HB2      GLU   3 291.051 -15.481 -12.840
   16    HB3  GLU   3           HB3      GLU   3 292.027 -14.072 -12.443
   17    HG2  GLU   3           HG2      GLU   3 293.549 -15.536 -11.750
   18    HG3  GLU   3           HG3      GLU   3 292.518 -15.741 -10.335
   19    H    ASN   4           H        ASN   4 289.926 -12.197 -12.078
   20    HA   ASN   4           HA       ASN   4 291.647 -10.714 -10.275
   21    HB2  ASN   4           HB2      ASN   4 291.349  -8.851 -11.727
   22    HB3  ASN   4           HB3      ASN   4 291.511 -10.262 -12.767
   23   HD21  ASN   4          HD21      ASN   4 289.605  -7.607 -11.908
   24   HD22  ASN   4          HD22      ASN   4 288.234  -7.959 -12.899
   25    H    ASP   5           H        ASP   5 289.181 -11.994  -9.266
   26    HA   ASP   5           HA       ASP   5 287.526  -9.699  -8.529
   27    HB2  ASP   5           HB2      ASP   5 286.878 -12.337  -9.037
   28    HB3  ASP   5           HB3      ASP   5 286.932 -12.298  -7.278
   29    H    HIS   6           H        HIS   6 286.934 -10.911  -5.840
   30    HA   HIS   6           HA       HIS   6 289.583 -10.477  -4.662
   31    HB2  HIS   6           HB2      HIS   6 288.485  -9.553  -2.607
   32    HB3  HIS   6           HB3      HIS   6 288.469  -8.513  -4.004
   33    HD1  HIS   6           HD1      HIS   6 285.842  -9.693  -5.324
   34    HD2  HIS   6           HD2      HIS   6 286.385  -8.561  -1.367
   35    HE1  HIS   6           HE1      HIS   6 283.533  -9.199  -4.456
   36    HE2  HIS   6           HE2      HIS   6 283.890  -8.421  -2.083
   37    H    ILE   7           H        ILE   7 290.280 -11.674  -3.112
   38    HA   ILE   7           HA       ILE   7 288.634 -13.974  -2.324
   39    HB   ILE   7           HB       ILE   7 290.559 -15.310  -2.234
   40   HG12  ILE   7          HG12      ILE   7 292.131 -12.738  -2.239
   41   HG13  ILE   7          HG13      ILE   7 292.074 -13.959  -0.970
   42   HG21  ILE   7          HG21      ILE   7 290.969 -15.449  -4.417
   43   HG22  ILE   7          HG22      ILE   7 291.694 -13.839  -4.473
   44   HG23  ILE   7          HG23      ILE   7 289.940 -14.027  -4.577
   45   HD11  ILE   7          HD11      ILE   7 293.710 -13.822  -3.381
   46   HD12  ILE   7          HD12      ILE   7 292.962 -15.396  -3.097
   47   HD13  ILE   7          HD13      ILE   7 293.989 -14.669  -1.857
   48    H    ASN   8           H        ASN   8 288.949 -14.619  -0.005
   49    HA   ASN   8           HA       ASN   8 289.207 -12.208   1.572
   50    HB2  ASN   8           HB2      ASN   8 287.979 -14.840   1.867
   51    HB3  ASN   8           HB3      ASN   8 288.814 -14.331   3.331
   52   HD21  ASN   8          HD21      ASN   8 285.989 -14.142   1.578
   53   HD22  ASN   8          HD22      ASN   8 285.254 -12.810   2.396
   54    H    LEU   9           H        LEU   9 290.987 -11.767   2.972
   55    HA   LEU   9           HA       LEU   9 293.057 -13.831   3.079
   56    HB2  LEU   9           HB2      LEU   9 293.258 -10.913   2.646
   57    HB3  LEU   9           HB3      LEU   9 294.458 -11.635   3.598
   58    HG   LEU   9           HG       LEU   9 295.571 -12.285   1.786
   59   HD11  LEU   9          HD11      LEU   9 294.600 -13.847   0.132
   60   HD12  LEU   9          HD12      LEU   9 293.025 -13.635   0.896
   61   HD13  LEU   9          HD13      LEU   9 294.347 -14.375   1.798
   62   HD21  LEU   9          HD21      LEU   9 293.368 -10.717   0.623
   63   HD22  LEU   9          HD22      LEU   9 294.330 -11.694  -0.487
   64   HD23  LEU   9          HD23      LEU   9 295.114 -10.476   0.527
   65    H    LYS  10           H        LYS  10 293.990 -14.252   4.963
   66    HA   LYS  10           HA       LYS  10 292.741 -13.062   7.331
   67    HB2  LYS  10           HB2      LYS  10 294.160 -15.612   6.777
   68    HB3  LYS  10           HB3      LYS  10 293.848 -15.103   8.391
   69    HG2  LYS  10           HG2      LYS  10 291.504 -15.184   8.042
   70    HG3  LYS  10           HG3      LYS  10 291.722 -15.370   6.300
   71    HD2  LYS  10           HD2      LYS  10 292.951 -17.327   8.134
   72    HD3  LYS  10           HD3      LYS  10 291.219 -17.434   7.799
   73    HE2  LYS  10           HE2      LYS  10 291.984 -17.301   5.333
   74    HE3  LYS  10           HE3      LYS  10 293.547 -17.805   5.982
   75    HZ1  LYS  10           HZ1      LYS  10 292.414 -19.759   5.366
   76    HZ2  LYS  10           HZ2      LYS  10 290.973 -19.268   6.102
   77    HZ3  LYS  10           HZ3      LYS  10 292.306 -19.689   7.053
   78    H    VAL  11           H        VAL  11 293.991 -11.356   8.047
   79    HA   VAL  11           HA       VAL  11 296.868 -11.642   7.724
   80    HB   VAL  11           HB       VAL  11 296.226  -9.514   6.990
   81   HG11  VAL  11          HG11      VAL  11 294.674  -8.121   7.854
   82   HG12  VAL  11          HG12      VAL  11 294.941  -8.648   9.518
   83   HG13  VAL  11          HG13      VAL  11 294.013  -9.658   8.410
   84   HG21  VAL  11          HG21      VAL  11 297.981  -8.662   7.942
   85   HG22  VAL  11          HG22      VAL  11 297.842  -9.771   9.304
   86   HG23  VAL  11          HG23      VAL  11 297.005  -8.217   9.344
   87    H    ALA  12           H        ALA  12 297.934 -12.544   9.213
   88    HA   ALA  12           HA       ALA  12 296.899 -12.823  11.937
   89    HB1  ALA  12           HB1      ALA  12 299.314 -14.227  11.745
   90    HB2  ALA  12           HB2      ALA  12 298.457 -14.497  10.227
   91    HB3  ALA  12           HB3      ALA  12 297.674 -14.883  11.763
   92    H    GLY  13           H        GLY  13 298.081 -12.282  13.810
   93    HA2  GLY  13           HA2      GLY  13 300.013 -10.134  13.296
   94    HA3  GLY  13           HA3      GLY  13 299.054 -10.320  14.754
   95    H    GLN  14           H        GLN  14 301.744  -9.852  14.850
   96    HA   GLN  14           HA       GLN  14 303.352 -12.147  15.037
   97    HB2  GLN  14           HB2      GLN  14 303.557  -9.426  16.312
   98    HB3  GLN  14           HB3      GLN  14 304.813 -10.653  16.446
   99    HG2  GLN  14           HG2      GLN  14 304.893 -10.687  13.939
  100    HG3  GLN  14           HG3      GLN  14 303.832  -9.279  13.961
  101   HE21  GLN  14          HE21      GLN  14 306.956 -10.491  15.051
  102   HE22  GLN  14          HE22      GLN  14 307.745  -8.955  15.089
  103    H    ASP  15           H        ASP  15 300.867 -10.978  17.067
  104    HA   ASP  15           HA       ASP  15 301.842 -12.497  19.373
  105    HB2  ASP  15           HB2      ASP  15 299.735 -10.389  19.012
  106    HB3  ASP  15           HB3      ASP  15 299.702 -11.445  20.421
  107    H    GLY  16           H        GLY  16 299.954 -12.984  16.669
  108    HA2  GLY  16           HA2      GLY  16 299.023 -15.166  16.281
  109    HA3  GLY  16           HA3      GLY  16 298.595 -15.240  17.983
  110    H    SER  17           H        SER  17 297.957 -12.231  16.502
  111    HA   SER  17           HA       SER  17 295.097 -12.873  16.471
  112    HB2  SER  17           HB2      SER  17 296.631 -10.331  16.932
  113    HB3  SER  17           HB3      SER  17 294.939 -10.273  16.436
  114    HG   SER  17           HG       SER  17 294.432 -11.523  18.274
  115    H    VAL  18           H        VAL  18 294.426 -13.424  14.520
  116    HA   VAL  18           HA       VAL  18 295.491 -12.016  12.169
  117    HB   VAL  18           HB       VAL  18 295.733 -14.171  11.520
  118   HG11  VAL  18          HG11      VAL  18 295.292 -15.409  13.383
  119   HG12  VAL  18          HG12      VAL  18 294.045 -15.993  12.280
  120   HG13  VAL  18          HG13      VAL  18 293.635 -14.817  13.528
  121   HG21  VAL  18          HG21      VAL  18 292.789 -13.852  10.979
  122   HG22  VAL  18          HG22      VAL  18 293.859 -15.018  10.204
  123   HG23  VAL  18          HG23      VAL  18 294.117 -13.290   9.966
  124    H    VAL  19           H        VAL  19 293.894 -11.504  10.407
  125    HA   VAL  19           HA       VAL  19 291.171 -11.020  11.365
  126    HB   VAL  19           HB       VAL  19 292.705  -8.863   9.987
  127   HG11  VAL  19          HG11      VAL  19 289.964  -9.245  10.777
  128   HG12  VAL  19          HG12      VAL  19 290.674  -7.980   9.776
  129   HG13  VAL  19          HG13      VAL  19 290.640  -7.801  11.529
  130   HG21  VAL  19          HG21      VAL  19 292.131  -8.937  12.920
  131   HG22  VAL  19          HG22      VAL  19 293.108  -7.769  12.027
  132   HG23  VAL  19          HG23      VAL  19 293.676  -9.428  12.227
  133    H    GLN  20           H        GLN  20 289.639 -10.826   9.658
  134    HA   GLN  20           HA       GLN  20 290.614 -11.947   7.157
  135    HB2  GLN  20           HB2      GLN  20 287.776 -11.473   8.077
  136    HB3  GLN  20           HB3      GLN  20 288.262 -12.354   6.632
  137    HG2  GLN  20           HG2      GLN  20 289.604 -13.389   8.945
  138    HG3  GLN  20           HG3      GLN  20 287.856 -13.381   9.195
  139   HE21  GLN  20          HE21      GLN  20 289.758 -15.591   8.825
  140   HE22  GLN  20          HE22      GLN  20 289.168 -16.502   7.483
  141    H    PHE  21           H        PHE  21 290.596 -10.992   5.249
  142    HA   PHE  21           HA       PHE  21 289.271  -8.446   4.829
  143    HB2  PHE  21           HB2      PHE  21 292.270  -8.743   4.602
  144    HB3  PHE  21           HB3      PHE  21 291.344  -7.400   3.942
  145    HD1  PHE  21           HD2      PHE  21 290.041  -5.950   5.519
  146    HD2  PHE  21           HD1      PHE  21 292.959  -8.746   6.831
  147    HE1  PHE  21           HE2      PHE  21 290.197  -4.770   7.674
  148    HE2  PHE  21           HE1      PHE  21 293.126  -7.553   8.978
  149    HZ   PHE  21           HZ       PHE  21 291.751  -5.584   9.396
  150    H    LYS  22           H        LYS  22 288.274  -8.765   2.963
  151    HA   LYS  22           HA       LYS  22 289.545 -10.517   1.017
  152    HB2  LYS  22           HB2      LYS  22 286.965 -10.464   1.709
  153    HB3  LYS  22           HB3      LYS  22 286.926  -9.307   0.385
  154    HG2  LYS  22           HG2      LYS  22 288.211 -11.083  -0.931
  155    HG3  LYS  22           HG3      LYS  22 287.653 -12.193   0.324
  156    HD2  LYS  22           HD2      LYS  22 285.513 -10.579  -0.445
  157    HD3  LYS  22           HD3      LYS  22 286.249 -11.195  -1.924
  158    HE2  LYS  22           HE2      LYS  22 286.202 -13.436  -0.465
  159    HE3  LYS  22           HE3      LYS  22 284.843 -12.588   0.271
  160    HZ1  LYS  22           HZ1      LYS  22 285.156 -13.261  -2.603
  161    HZ2  LYS  22           HZ2      LYS  22 283.895 -12.328  -1.972
  162    HZ3  LYS  22           HZ3      LYS  22 284.053 -13.950  -1.519
  163    H    ILE  23           H        ILE  23 290.369  -9.860  -0.803
  164    HA   ILE  23           HA       ILE  23 289.833  -7.180  -1.736
  165    HB   ILE  23           HB       ILE  23 291.639  -6.581  -0.394
  166   HG12  ILE  23          HG12      ILE  23 292.674  -7.280  -3.130
  167   HG13  ILE  23          HG13      ILE  23 292.118  -5.722  -2.555
  168   HG21  ILE  23          HG21      ILE  23 292.734  -8.238   0.609
  169   HG22  ILE  23          HG22      ILE  23 293.789  -8.280  -0.806
  170   HG23  ILE  23          HG23      ILE  23 292.400  -9.358  -0.713
  171   HD11  ILE  23          HD11      ILE  23 294.379  -5.407  -2.567
  172   HD12  ILE  23          HD12      ILE  23 294.726  -7.076  -2.115
  173   HD13  ILE  23          HD13      ILE  23 294.129  -5.941  -0.905
  174    H    LYS  24           H        LYS  24 290.406  -6.834  -3.858
  175    HA   LYS  24           HA       LYS  24 290.113  -9.108  -5.492
  176    HB2  LYS  24           HB2      LYS  24 290.721  -6.266  -6.153
  177    HB3  LYS  24           HB3      LYS  24 290.439  -7.511  -7.369
  178    HG2  LYS  24           HG2      LYS  24 288.317  -7.819  -5.626
  179    HG3  LYS  24           HG3      LYS  24 288.526  -6.074  -5.714
  180    HD2  LYS  24           HD2      LYS  24 288.277  -7.898  -8.101
  181    HD3  LYS  24           HD3      LYS  24 286.945  -6.971  -7.398
  182    HE2  LYS  24           HE2      LYS  24 287.719  -5.004  -8.191
  183    HE3  LYS  24           HE3      LYS  24 289.400  -5.494  -7.988
  184    HZ1  LYS  24           HZ1      LYS  24 287.575  -6.086 -10.235
  185    HZ2  LYS  24           HZ2      LYS  24 288.958  -7.021  -9.963
  186    HZ3  LYS  24           HZ3      LYS  24 289.106  -5.366 -10.283
  187    H    ARG  25           H        ARG  25 291.563 -10.430  -6.430
  188    HA   ARG  25           HA       ARG  25 294.039 -10.813  -5.539
  189    HB2  ARG  25           HB2      ARG  25 293.081 -11.281  -8.346
  190    HB3  ARG  25           HB3      ARG  25 294.517 -11.972  -7.665
  191    HG2  ARG  25           HG2      ARG  25 292.795 -12.779  -5.813
  192    HG3  ARG  25           HG3      ARG  25 291.702 -12.668  -7.192
  193    HD2  ARG  25           HD2      ARG  25 293.013 -14.193  -8.461
  194    HD3  ARG  25           HD3      ARG  25 294.327 -14.133  -7.289
  195    HE   ARG  25           HE       ARG  25 293.210 -15.664  -5.994
  196   HH11  ARG  25          HH11      ARG  25 291.041 -14.431  -8.435
  197   HH12  ARG  25          HH12      ARG  25 289.814 -15.611  -8.119
  198   HH21  ARG  25          HH21      ARG  25 291.597 -17.219  -5.580
  199   HH22  ARG  25          HH22      ARG  25 290.129 -17.193  -6.498
  200    H    HIS  26           H        HIS  26 293.481  -9.052  -8.601
  201    HA   HIS  26           HA       HIS  26 296.228  -8.247  -8.682
  202    HB2  HIS  26           HB2      HIS  26 293.866  -7.359 -10.348
  203    HB3  HIS  26           HB3      HIS  26 295.541  -6.910 -10.655
  204    HD1  HIS  26           HD1      HIS  26 296.647  -8.324 -12.343
  205    HD2  HIS  26           HD2      HIS  26 293.620 -10.374 -10.368
  206    HE1  HIS  26           HE1      HIS  26 296.556 -10.592 -13.424
  207    HE2  HIS  26           HE2      HIS  26 294.657 -11.783 -12.273
  208    H    THR  27           H        THR  27 294.887  -7.443  -6.274
  209    HA   THR  27           HA       THR  27 294.934  -4.525  -6.603
  210    HB   THR  27           HB       THR  27 293.615  -6.093  -4.390
  211    HG1  THR  27           HG1      THR  27 291.694  -5.433  -5.381
  212   HG21  THR  27          HG21      THR  27 294.393  -3.722  -3.917
  213   HG22  THR  27          HG22      THR  27 292.691  -4.094  -3.623
  214   HG23  THR  27          HG23      THR  27 293.162  -3.221  -5.081
  215    HA   PRO  28           HA       PRO  28 298.562  -4.725  -4.089
  216    HB2  PRO  28           HB2      PRO  28 298.000  -2.023  -3.139
  217    HB3  PRO  28           HB3      PRO  28 299.312  -2.583  -4.170
  218    HG2  PRO  28           HG2      PRO  28 297.271  -1.022  -5.064
  219    HG3  PRO  28           HG3      PRO  28 298.161  -2.155  -6.095
  220    HD2  PRO  28           HD2      PRO  28 295.461  -2.420  -4.862
  221    HD3  PRO  28           HD3      PRO  28 296.054  -3.002  -6.432
  222    H    LEU  29           H        LEU  29 298.560  -5.828  -2.290
  223    HA   LEU  29           HA       LEU  29 296.534  -6.074  -0.466
  224    HB2  LEU  29           HB2      LEU  29 299.498  -6.443  -0.100
  225    HB3  LEU  29           HB3      LEU  29 298.311  -6.917   1.104
  226    HG   LEU  29           HG       LEU  29 298.038  -7.932  -1.686
  227   HD11  LEU  29          HD11      LEU  29 299.531  -9.658   0.150
  228   HD12  LEU  29          HD12      LEU  29 300.417  -8.254  -0.451
  229   HD13  LEU  29          HD13      LEU  29 299.712  -9.406  -1.586
  230   HD21  LEU  29          HD21      LEU  29 296.256  -8.738  -0.604
  231   HD22  LEU  29          HD22      LEU  29 296.996  -8.549   0.996
  232   HD23  LEU  29          HD23      LEU  29 297.400  -9.944  -0.013
  233    H    SER  30           H        SER  30 298.614  -3.373  -0.816
  234    HA   SER  30           HA       SER  30 298.847  -2.419   1.770
  235    HB2  SER  30           HB2      SER  30 300.044  -1.140   0.279
  236    HB3  SER  30           HB3      SER  30 298.771  -1.178  -0.941
  237    HG   SER  30           HG       SER  30 299.282   0.816   0.553
  238    H    LYS  31           H        LYS  31 296.000  -2.876  -0.094
  239    HA   LYS  31           HA       LYS  31 294.462  -0.873   1.330
  240    HB2  LYS  31           HB2      LYS  31 294.139  -1.697  -1.117
  241    HB3  LYS  31           HB3      LYS  31 293.276  -3.035  -0.373
  242    HG2  LYS  31           HG2      LYS  31 291.539  -1.723   0.296
  243    HG3  LYS  31           HG3      LYS  31 292.541  -0.275   0.428
  244    HD2  LYS  31           HD2      LYS  31 292.036  -1.514  -2.250
  245    HD3  LYS  31           HD3      LYS  31 290.825  -0.463  -1.513
  246    HE2  LYS  31           HE2      LYS  31 293.268   0.868  -1.220
  247    HE3  LYS  31           HE3      LYS  31 293.270   0.226  -2.862
  248    HZ1  LYS  31           HZ1      LYS  31 292.176   2.536  -2.256
  249    HZ2  LYS  31           HZ2      LYS  31 290.836   1.553  -1.945
  250    HZ3  LYS  31           HZ3      LYS  31 291.551   1.545  -3.477
  251    H    LEU  32           H        LEU  32 294.942  -4.343   1.217
  252    HA   LEU  32           HA       LEU  32 292.950  -5.155   3.030
  253    HB2  LEU  32           HB2      LEU  32 294.044  -6.716   1.564
  254    HB3  LEU  32           HB3      LEU  32 295.619  -6.257   2.159
  255    HG   LEU  32           HG       LEU  32 293.760  -7.571   4.090
  256   HD11  LEU  32          HD11      LEU  32 294.853  -9.734   3.126
  257   HD12  LEU  32          HD12      LEU  32 294.877  -8.797   1.632
  258   HD13  LEU  32          HD13      LEU  32 293.349  -9.101   2.457
  259   HD21  LEU  32          HD21      LEU  32 296.595  -8.296   3.622
  260   HD22  LEU  32          HD22      LEU  32 295.691  -8.169   5.146
  261   HD23  LEU  32          HD23      LEU  32 296.260  -6.708   4.328
  262    H    MET  33           H        MET  33 296.276  -4.036   3.426
  263    HA   MET  33           HA       MET  33 296.314  -4.459   6.220
  264    HB2  MET  33           HB2      MET  33 298.215  -2.493   5.275
  265    HB3  MET  33           HB3      MET  33 298.482  -3.972   6.122
  266    HG2  MET  33           HG2      MET  33 298.597  -5.225   4.149
  267    HG3  MET  33           HG3      MET  33 297.939  -3.898   3.212
  268    HE1  MET  33           HE1      MET  33 300.527  -5.805   2.973
  269    HE2  MET  33           HE2      MET  33 301.356  -5.490   4.497
  270    HE3  MET  33           HE3      MET  33 302.057  -4.917   2.976
  271    H    LYS  34           H        LYS  34 295.583  -1.802   4.085
  272    HA   LYS  34           HA       LYS  34 295.605   0.271   5.985
  273    HB2  LYS  34           HB2      LYS  34 294.267  -0.100   3.332
  274    HB3  LYS  34           HB3      LYS  34 293.845   1.286   4.333
  275    HG2  LYS  34           HG2      LYS  34 296.698   0.650   3.693
  276    HG3  LYS  34           HG3      LYS  34 295.692   1.574   2.581
  277    HD2  LYS  34           HD2      LYS  34 295.166   2.921   4.817
  278    HD3  LYS  34           HD3      LYS  34 296.764   2.307   5.241
  279    HE2  LYS  34           HE2      LYS  34 297.368   3.181   2.833
  280    HE3  LYS  34           HE3      LYS  34 295.963   4.212   3.099
  281    HZ1  LYS  34           HZ1      LYS  34 298.346   4.962   3.828
  282    HZ2  LYS  34           HZ2      LYS  34 297.990   4.051   5.208
  283    HZ3  LYS  34           HZ3      LYS  34 296.993   5.345   4.769
  284    H    ALA  35           H        ALA  35 293.283  -2.209   5.238
  285    HA   ALA  35           HA       ALA  35 291.132  -1.068   6.787
  286    HB1  ALA  35           HB1      ALA  35 290.480  -2.502   5.013
  287    HB2  ALA  35           HB2      ALA  35 290.213  -3.444   6.478
  288    HB3  ALA  35           HB3      ALA  35 291.638  -3.752   5.477
  289    H    TYR  36           H        TYR  36 293.791  -3.283   7.182
  290    HA   TYR  36           HA       TYR  36 293.216  -4.349   9.775
  291    HB2  TYR  36           HB2      TYR  36 294.833  -5.248   8.078
  292    HB3  TYR  36           HB3      TYR  36 295.864  -3.865   8.395
  293    HD1  TYR  36           HD1      TYR  36 294.071  -6.459  10.365
  294    HD2  TYR  36           HD2      TYR  36 297.639  -4.238   9.753
  295    HE1  TYR  36           HE1      TYR  36 295.151  -7.705  12.158
  296    HE2  TYR  36           HE2      TYR  36 298.756  -5.468  11.531
  297    HH   TYR  36           HH       TYR  36 298.175  -8.077  12.614
  298    H    CYS  37           H        CYS  37 294.898  -1.517   8.519
  299    HA   CYS  37           HA       CYS  37 295.875  -0.590  11.044
  300    HB2  CYS  37           HB2      CYS  37 296.330   0.060   8.391
  301    HB3  CYS  37           HB3      CYS  37 295.404   1.435   8.978
  302    HG   CYS  37           HG       CYS  37 297.902   0.661  10.596
  303    H    GLU  38           H        GLU  38 293.076  -0.195   9.055
  304    HA   GLU  38           HA       GLU  38 291.805   1.940  10.409
  305    HB2  GLU  38           HB2      GLU  38 291.182   1.319   8.160
  306    HB3  GLU  38           HB3      GLU  38 290.781  -0.310   8.676
  307    HG2  GLU  38           HG2      GLU  38 289.225   1.376  10.255
  308    HG3  GLU  38           HG3      GLU  38 289.187   2.037   8.631
  309    H    ARG  39           H        ARG  39 291.691  -1.569  10.612
  310    HA   ARG  39           HA       ARG  39 289.667  -2.075  12.322
  311    HB2  ARG  39           HB2      ARG  39 292.263  -3.291  11.634
  312    HB3  ARG  39           HB3      ARG  39 291.281  -3.996  12.812
  313    HG2  ARG  39           HG2      ARG  39 289.764  -3.472  10.495
  314    HG3  ARG  39           HG3      ARG  39 291.262  -4.312  10.085
  315    HD2  ARG  39           HD2      ARG  39 288.933  -5.244  11.402
  316    HD3  ARG  39           HD3      ARG  39 290.187  -6.167  10.607
  317    HE   ARG  39           HE       ARG  39 289.747  -6.051  13.333
  318   HH11  ARG  39          HH11      ARG  39 292.469  -5.431  11.230
  319   HH12  ARG  39          HH12      ARG  39 293.633  -5.906  12.416
  320   HH21  ARG  39          HH21      ARG  39 291.288  -6.698  14.859
  321   HH22  ARG  39          HH22      ARG  39 292.971  -6.643  14.459
  322    H    GLN  40           H        GLN  40 293.078  -1.354  13.090
  323    HA   GLN  40           HA       GLN  40 292.313  -1.304  15.938
  324    HB2  GLN  40           HB2      GLN  40 294.915  -2.275  14.784
  325    HB3  GLN  40           HB3      GLN  40 294.480  -2.243  16.483
  326    HG2  GLN  40           HG2      GLN  40 292.434  -3.684  15.547
  327    HG3  GLN  40           HG3      GLN  40 293.654  -4.097  14.342
  328   HE21  GLN  40          HE21      GLN  40 295.826  -4.686  15.318
  329   HE22  GLN  40          HE22      GLN  40 295.790  -5.731  16.693
  330    H    GLY  41           H        GLY  41 293.469   0.781  13.556
  331    HA2  GLY  41           HA2      GLY  41 294.117   2.962  13.943
  332    HA3  GLY  41           HA3      GLY  41 294.384   2.565  15.631
  333    H    LEU  42           H        LEU  42 295.928   0.308  13.651
  334    HA   LEU  42           HA       LEU  42 298.496   0.916  14.507
  335    HB2  LEU  42           HB2      LEU  42 297.475  -0.603  12.124
  336    HB3  LEU  42           HB3      LEU  42 299.204  -0.401  12.374
  337    HG   LEU  42           HG       LEU  42 297.577  -1.475  14.630
  338   HD11  LEU  42          HD11      LEU  42 296.757  -2.726  12.697
  339   HD12  LEU  42          HD12      LEU  42 297.748  -3.739  13.749
  340   HD13  LEU  42          HD13      LEU  42 298.419  -3.113  12.242
  341   HD21  LEU  42          HD21      LEU  42 300.178  -2.576  13.739
  342   HD22  LEU  42          HD22      LEU  42 299.570  -2.274  15.367
  343   HD23  LEU  42          HD23      LEU  42 300.171  -0.935  14.387
  344    H    SER  43           H        SER  43 300.216   1.104  12.420
  345    HA   SER  43           HA       SER  43 299.585   3.738  11.266
  346    HB2  SER  43           HB2      SER  43 301.453   3.628  12.986
  347    HB3  SER  43           HB3      SER  43 302.355   2.665  11.817
  348    HG   SER  43           HG       SER  43 301.922   4.514  10.342
  349    H    MET  44           H        MET  44 300.263   0.487  10.583
  350    HA   MET  44           HA       MET  44 300.479  -0.718   8.669
  351    HB2  MET  44           HB2      MET  44 298.845   1.147   7.845
  352    HB3  MET  44           HB3      MET  44 300.252   1.826   7.044
  353    HG2  MET  44           HG2      MET  44 300.438  -0.712   6.216
  354    HG3  MET  44           HG3      MET  44 298.691  -0.591   6.427
  355    HE1  MET  44           HE1      MET  44 298.838  -1.288   3.812
  356    HE2  MET  44           HE2      MET  44 300.561  -0.978   3.599
  357    HE3  MET  44           HE3      MET  44 299.387  -0.194   2.542
  358    H    ARG  45           H        ARG  45 302.243   2.386   8.738
  359    HA   ARG  45           HA       ARG  45 304.396   1.437   7.096
  360    HB2  ARG  45           HB2      ARG  45 303.523   3.910   7.786
  361    HB3  ARG  45           HB3      ARG  45 304.883   3.726   8.875
  362    HG2  ARG  45           HG2      ARG  45 305.391   2.980   6.080
  363    HG3  ARG  45           HG3      ARG  45 305.066   4.690   6.372
  364    HD2  ARG  45           HD2      ARG  45 306.794   3.928   8.412
  365    HD3  ARG  45           HD3      ARG  45 307.420   3.129   6.970
  366    HE   ARG  45           HE       ARG  45 307.618   5.872   7.579
  367   HH11  ARG  45          HH11      ARG  45 306.979   3.743   4.889
  368   HH12  ARG  45          HH12      ARG  45 307.570   4.859   3.704
  369   HH21  ARG  45          HH21      ARG  45 308.395   7.341   6.022
  370   HH22  ARG  45          HH22      ARG  45 308.375   6.901   4.347
  371    H    GLN  46           H        GLN  46 303.694   1.791  10.512
  372    HA   GLN  46           HA       GLN  46 306.298   0.965  11.430
  373    HB2  GLN  46           HB2      GLN  46 304.717   2.479  12.665
  374    HB3  GLN  46           HB3      GLN  46 303.687   1.081  12.952
  375    HG2  GLN  46           HG2      GLN  46 306.485   0.698  13.712
  376    HG3  GLN  46           HG3      GLN  46 305.651   1.956  14.622
  377   HE21  GLN  46          HE21      GLN  46 306.616  -0.866  15.195
  378   HE22  GLN  46          HE22      GLN  46 305.258  -1.616  15.950
  379    H    ILE  47           H        ILE  47 303.670  -0.532  10.129
  380    HA   ILE  47           HA       ILE  47 304.276  -3.148  11.311
  381    HB   ILE  47           HB       ILE  47 302.170  -2.771  12.077
  382   HG12  ILE  47          HG12      ILE  47 302.224  -4.788  10.633
  383   HG13  ILE  47          HG13      ILE  47 300.612  -4.071  10.872
  384   HG21  ILE  47          HG21      ILE  47 301.305  -0.843  11.519
  385   HG22  ILE  47          HG22      ILE  47 300.454  -1.758  10.272
  386   HG23  ILE  47          HG23      ILE  47 301.958  -0.928   9.890
  387   HD11  ILE  47          HD11      ILE  47 301.825  -4.663   8.469
  388   HD12  ILE  47          HD12      ILE  47 301.740  -2.904   8.602
  389   HD13  ILE  47          HD13      ILE  47 300.283  -3.870   8.789
  390    H    ARG  48           H        ARG  48 304.506  -4.857   9.936
  391    HA   ARG  48           HA       ARG  48 304.291  -4.395   7.033
  392    HB2  ARG  48           HB2      ARG  48 306.606  -5.613   8.547
  393    HB3  ARG  48           HB3      ARG  48 306.403  -5.715   6.801
  394    HG2  ARG  48           HG2      ARG  48 306.472  -3.092   8.249
  395    HG3  ARG  48           HG3      ARG  48 307.937  -3.890   7.671
  396    HD2  ARG  48           HD2      ARG  48 307.371  -3.614   5.463
  397    HD3  ARG  48           HD3      ARG  48 305.653  -3.543   5.802
  398    HE   ARG  48           HE       ARG  48 306.588  -1.288   6.957
  399   HH11  ARG  48          HH11      ARG  48 306.952  -2.647   3.764
  400   HH12  ARG  48          HH12      ARG  48 307.104  -1.106   2.989
  401   HH21  ARG  48          HH21      ARG  48 306.785   0.740   5.940
  402   HH22  ARG  48          HH22      ARG  48 307.009   0.817   4.224
  403    H    PHE  49           H        PHE  49 303.013  -5.923   6.135
  404    HA   PHE  49           HA       PHE  49 302.287  -8.280   7.666
  405    HB2  PHE  49           HB2      PHE  49 301.430  -7.289   4.955
  406    HB3  PHE  49           HB3      PHE  49 300.856  -8.767   5.658
  407    HD1  PHE  49           HD2      PHE  49 301.194  -6.523   8.320
  408    HD2  PHE  49           HD1      PHE  49 298.790  -7.401   4.911
  409    HE1  PHE  49           HE2      PHE  49 299.344  -5.256   9.283
  410    HE2  PHE  49           HE1      PHE  49 296.974  -6.083   5.875
  411    HZ   PHE  49           HZ       PHE  49 297.268  -5.021   8.067
  412    H    ARG  50           H        ARG  50 302.689 -10.358   7.131
  413    HA   ARG  50           HA       ARG  50 304.440 -10.878   4.884
  414    HB2  ARG  50           HB2      ARG  50 304.677 -11.690   7.502
  415    HB3  ARG  50           HB3      ARG  50 303.868 -13.043   6.777
  416    HG2  ARG  50           HG2      ARG  50 305.899 -12.371   5.033
  417    HG3  ARG  50           HG3      ARG  50 306.615 -12.268   6.630
  418    HD2  ARG  50           HD2      ARG  50 304.887 -14.603   5.957
  419    HD3  ARG  50           HD3      ARG  50 306.509 -14.541   5.321
  420    HE   ARG  50           HE       ARG  50 305.765 -14.786   8.125
  421   HH11  ARG  50          HH11      ARG  50 308.295 -14.565   5.722
  422   HH12  ARG  50          HH12      ARG  50 309.524 -15.157   6.788
  423   HH21  ARG  50          HH21      ARG  50 307.386 -15.559   9.520
  424   HH22  ARG  50          HH22      ARG  50 309.010 -15.719   8.940
  425    H    PHE  51           H        PHE  51 303.822 -13.344   4.317
  426    HA   PHE  51           HA       PHE  51 300.959 -13.625   4.024
  427    HB2  PHE  51           HB2      PHE  51 301.082 -12.804   1.896
  428    HB3  PHE  51           HB3      PHE  51 302.789 -13.122   1.748
  429    HD1  PHE  51           HD2      PHE  51 299.606 -15.033   2.057
  430    HD2  PHE  51           HD1      PHE  51 303.378 -14.677   0.135
  431    HE1  PHE  51           HE2      PHE  51 299.083 -16.996   0.668
  432    HE2  PHE  51           HE1      PHE  51 302.865 -16.632  -1.260
  433    HZ   PHE  51           HZ       PHE  51 300.713 -17.796  -0.994
  434    H    ASP  52           H        ASP  52 300.529 -15.960   3.486
  435    HA   ASP  52           HA       ASP  52 301.795 -17.664   5.190
  436    HB2  ASP  52           HB2      ASP  52 299.831 -18.189   3.571
  437    HB3  ASP  52           HB3      ASP  52 301.091 -18.695   2.452
  438    H    GLY  53           H        GLY  53 303.871 -17.034   5.333
  439    HA2  GLY  53           HA2      GLY  53 306.114 -17.257   5.096
  440    HA3  GLY  53           HA3      GLY  53 305.806 -18.442   3.854
  441    H    GLN  54           H        GLN  54 305.282 -14.773   4.018
  442    HA   GLN  54           HA       GLN  54 307.329 -14.382   2.065
  443    HB2  GLN  54           HB2      GLN  54 305.048 -15.253   0.915
  444    HB3  GLN  54           HB3      GLN  54 304.710 -13.528   0.976
  445    HG2  GLN  54           HG2      GLN  54 305.671 -13.902  -1.123
  446    HG3  GLN  54           HG3      GLN  54 306.955 -13.191  -0.144
  447   HE21  GLN  54          HE21      GLN  54 308.801 -14.054  -0.775
  448   HE22  GLN  54          HE22      GLN  54 309.103 -15.737  -1.018
  449    HA   PRO  55           HA       PRO  55 307.028 -10.802   4.890
  450    HB2  PRO  55           HB2      PRO  55 309.094  -9.575   3.491
  451    HB3  PRO  55           HB3      PRO  55 309.250 -10.519   4.972
  452    HG2  PRO  55           HG2      PRO  55 309.671 -11.344   2.132
  453    HG3  PRO  55           HG3      PRO  55 310.532 -11.868   3.592
  454    HD2  PRO  55           HD2      PRO  55 308.770 -13.451   2.415
  455    HD3  PRO  55           HD3      PRO  55 308.826 -13.344   4.188
  456    H    ILE  56           H        ILE  56 305.035 -10.628   3.129
  457    HA   ILE  56           HA       ILE  56 304.594  -9.275   1.101
  458    HB   ILE  56           HB       ILE  56 303.381  -8.644   3.728
  459   HG12  ILE  56          HG12      ILE  56 303.158 -10.748   1.802
  460   HG13  ILE  56          HG13      ILE  56 302.654 -10.686   3.465
  461   HG21  ILE  56          HG21      ILE  56 302.887  -6.738   2.377
  462   HG22  ILE  56          HG22      ILE  56 301.441  -7.717   2.633
  463   HG23  ILE  56          HG23      ILE  56 302.295  -7.785   1.081
  464   HD11  ILE  56          HD11      ILE  56 301.082  -9.403   1.297
  465   HD12  ILE  56          HD12      ILE  56 300.593  -9.798   2.943
  466   HD13  ILE  56          HD13      ILE  56 300.873 -11.080   1.772
  467    H    ASN  57           H        ASN  57 304.028  -7.437   0.351
  468    HA   ASN  57           HA       ASN  57 305.435  -4.998   1.214
  469    HB2  ASN  57           HB2      ASN  57 305.282  -6.317  -1.418
  470    HB3  ASN  57           HB3      ASN  57 305.173  -4.564  -1.425
  471   HD21  ASN  57          HD21      ASN  57 307.102  -7.141   0.072
  472   HD22  ASN  57          HD22      ASN  57 308.625  -6.348  -0.121
  473    H    GLU  58           H        GLU  58 304.376  -3.031  -0.038
  474    HA   GLU  58           HA       GLU  58 301.620  -3.037   0.773
  475    HB2  GLU  58           HB2      GLU  58 303.621  -1.033  -0.044
  476    HB3  GLU  58           HB3      GLU  58 301.959  -0.645  -0.465
  477    HG2  GLU  58           HG2      GLU  58 301.276  -0.788   1.818
  478    HG3  GLU  58           HG3      GLU  58 302.853  -1.407   2.302
  479    H    THR  59           H        THR  59 303.412  -2.954  -2.246
  480    HA   THR  59           HA       THR  59 301.047  -2.662  -3.857
  481    HB   THR  59           HB       THR  59 302.613  -2.979  -5.750
  482    HG1  THR  59           HG1      THR  59 304.311  -4.112  -5.294
  483   HG21  THR  59          HG21      THR  59 304.341  -1.145  -4.641
  484   HG22  THR  59          HG22      THR  59 302.842  -0.915  -3.740
  485   HG23  THR  59          HG23      THR  59 302.841  -0.789  -5.500
  486    H    ASP  60           H        ASP  60 303.006  -5.268  -2.683
  487    HA   ASP  60           HA       ASP  60 302.472  -7.328  -4.413
  488    HB2  ASP  60           HB2      ASP  60 302.892  -7.239  -1.458
  489    HB3  ASP  60           HB3      ASP  60 302.360  -8.749  -2.185
  490    H    THR  61           H        THR  61 300.756  -8.477  -5.026
  491    HA   THR  61           HA       THR  61 298.241  -8.124  -3.539
  492    HB   THR  61           HB       THR  61 297.018  -7.969  -5.461
  493    HG1  THR  61           HG1      THR  61 297.759  -8.743  -7.484
  494   HG21  THR  61          HG21      THR  61 298.124  -6.542  -7.117
  495   HG22  THR  61          HG22      THR  61 299.674  -6.871  -6.338
  496   HG23  THR  61          HG23      THR  61 298.412  -6.005  -5.461
  497    HA   PRO  62           HA       PRO  62 297.690 -12.434  -2.739
  498    HB2  PRO  62           HB2      PRO  62 295.232 -12.050  -4.448
  499    HB3  PRO  62           HB3      PRO  62 295.386 -12.905  -2.909
  500    HG2  PRO  62           HG2      PRO  62 294.343 -10.492  -2.962
  501    HG3  PRO  62           HG3      PRO  62 295.511 -10.914  -1.693
  502    HD2  PRO  62           HD2      PRO  62 295.881  -9.209  -4.109
  503    HD3  PRO  62           HD3      PRO  62 296.632  -9.076  -2.506
  504    H    ALA  63           H        ALA  63 296.720 -11.442  -6.093
  505    HA   ALA  63           HA       ALA  63 297.276 -13.892  -7.373
  506    HB1  ALA  63           HB1      ALA  63 296.210 -11.555  -8.132
  507    HB2  ALA  63           HB2      ALA  63 296.851 -12.732  -9.280
  508    HB3  ALA  63           HB3      ALA  63 297.844 -11.352  -8.765
  509    H    GLN  64           H        GLN  64 299.075 -11.016  -6.733
  510    HA   GLN  64           HA       GLN  64 301.465 -11.663  -8.106
  511    HB2  GLN  64           HB2      GLN  64 300.239  -9.528  -6.675
  512    HB3  GLN  64           HB3      GLN  64 301.811  -9.791  -5.999
  513    HG2  GLN  64           HG2      GLN  64 301.303  -9.457  -8.924
  514    HG3  GLN  64           HG3      GLN  64 301.662  -8.110  -7.847
  515   HE21  GLN  64          HE21      GLN  64 303.733  -7.939  -6.941
  516   HE22  GLN  64          HE22      GLN  64 305.089  -8.777  -7.609
  517    H    LEU  65           H        LEU  65 300.035 -12.707  -5.293
  518    HA   LEU  65           HA       LEU  65 302.552 -13.630  -4.116
  519    HB2  LEU  65           HB2      LEU  65 299.983 -12.613  -2.964
  520    HB3  LEU  65           HB3      LEU  65 301.095 -13.528  -1.993
  521    HG   LEU  65           HG       LEU  65 301.450 -10.824  -3.241
  522   HD11  LEU  65          HD11      LEU  65 302.075 -11.640  -0.432
  523   HD12  LEU  65          HD12      LEU  65 300.437 -11.216  -0.929
  524   HD13  LEU  65          HD13      LEU  65 301.739 -10.035  -1.081
  525   HD21  LEU  65          HD21      LEU  65 303.465 -11.925  -3.788
  526   HD22  LEU  65          HD22      LEU  65 303.575 -12.668  -2.193
  527   HD23  LEU  65          HD23      LEU  65 303.800 -10.928  -2.372
  528    H    GLU  66           H        GLU  66 300.091 -14.621  -5.916
  529    HA   GLU  66           HA       GLU  66 298.880 -16.509  -6.240
  530    HB2  GLU  66           HB2      GLU  66 301.425 -17.598  -5.017
  531    HB3  GLU  66           HB3      GLU  66 300.159 -18.643  -5.645
  532    HG2  GLU  66           HG2      GLU  66 300.407 -17.378  -7.831
  533    HG3  GLU  66           HG3      GLU  66 301.884 -16.702  -7.145
  534    H    MET  67           H        MET  67 297.836 -15.232  -4.262
  535    HA   MET  67           HA       MET  67 297.633 -16.918  -1.895
  536    HB2  MET  67           HB2      MET  67 296.561 -14.176  -2.542
  537    HB3  MET  67           HB3      MET  67 296.267 -15.001  -1.025
  538    HG2  MET  67           HG2      MET  67 298.800 -15.157  -0.821
  539    HG3  MET  67           HG3      MET  67 298.868 -13.969  -2.108
  540    HE1  MET  67           HE1      MET  67 297.889 -14.783   1.507
  541    HE2  MET  67           HE2      MET  67 296.318 -14.363   0.845
  542    HE3  MET  67           HE3      MET  67 297.066 -13.327   2.056
  543    H    GLU  68           H        GLU  68 295.222 -16.957  -1.009
  544    HA   GLU  68           HA       GLU  68 293.439 -17.686  -3.246
  545    HB2  GLU  68           HB2      GLU  68 294.550 -19.441  -1.292
  546    HB3  GLU  68           HB3      GLU  68 292.810 -19.290  -1.005
  547    HG2  GLU  68           HG2      GLU  68 292.285 -20.165  -3.101
  548    HG3  GLU  68           HG3      GLU  68 293.897 -19.864  -3.749
  549    H    ASP  69           H        ASP  69 291.316 -18.500  -2.097
  550    HA   ASP  69           HA       ASP  69 290.289 -16.188  -0.706
  551    HB2  ASP  69           HB2      ASP  69 288.210 -16.844  -1.395
  552    HB3  ASP  69           HB3      ASP  69 289.194 -17.538  -2.674
  553    H    GLU  70           H        GLU  70 290.026 -16.147   1.269
  554    HA   GLU  70           HA       GLU  70 290.047 -16.667   3.576
  555    HB2  GLU  70           HB2      GLU  70 289.133 -19.229   2.307
  556    HB3  GLU  70           HB3      GLU  70 289.739 -19.303   3.950
  557    HG2  GLU  70           HG2      GLU  70 287.153 -18.697   3.099
  558    HG3  GLU  70           HG3      GLU  70 287.792 -18.632   4.737
  559    H    ASP  71           H        ASP  71 292.285 -16.205   2.340
  560    HA   ASP  71           HA       ASP  71 294.151 -18.354   3.011
  561    HB2  ASP  71           HB2      ASP  71 294.121 -16.671   0.817
  562    HB3  ASP  71           HB3      ASP  71 295.311 -15.916   1.862
  563    H    THR  72           H        THR  72 296.369 -16.939   3.729
  564    HA   THR  72           HA       THR  72 295.367 -15.178   5.844
  565    HB   THR  72           HB       THR  72 297.342 -17.380   6.322
  566    HG1  THR  72           HG1      THR  72 294.980 -17.064   7.751
  567   HG21  THR  72          HG21      THR  72 297.474 -16.666   8.584
  568   HG22  THR  72          HG22      THR  72 296.262 -15.417   8.305
  569   HG23  THR  72          HG23      THR  72 297.858 -15.274   7.566
  570    H    ILE  73           H        ILE  73 296.349 -13.408   5.965
  571    HA   ILE  73           HA       ILE  73 298.931 -12.970   4.658
  572    HB   ILE  73           HB       ILE  73 296.590 -11.191   5.376
  573   HG12  ILE  73          HG12      ILE  73 296.757 -11.670   3.107
  574   HG13  ILE  73          HG13      ILE  73 297.488 -10.087   3.292
  575   HG21  ILE  73          HG21      ILE  73 298.124  -9.195   5.235
  576   HG22  ILE  73          HG22      ILE  73 299.494 -10.298   5.388
  577   HG23  ILE  73          HG23      ILE  73 298.327 -10.149   6.704
  578   HD11  ILE  73          HD11      ILE  73 298.978 -11.091   1.941
  579   HD12  ILE  73          HD12      ILE  73 298.771 -12.662   2.719
  580   HD13  ILE  73          HD13      ILE  73 299.660 -11.380   3.541
  581    H    ASP  74           H        ASP  74 300.636 -12.434   6.017
  582    HA   ASP  74           HA       ASP  74 300.095 -12.877   8.851
  583    HB2  ASP  74           HB2      ASP  74 302.249 -13.649   7.086
  584    HB3  ASP  74           HB3      ASP  74 302.872 -12.728   8.455
  585    H    VAL  75           H        VAL  75 301.172 -11.531  10.435
  586    HA   VAL  75           HA       VAL  75 301.751  -8.860   9.360
  587    HB   VAL  75           HB       VAL  75 299.871  -9.487  11.565
  588   HG11  VAL  75          HG11      VAL  75 300.286  -7.193  12.531
  589   HG12  VAL  75          HG12      VAL  75 301.795  -7.146  11.611
  590   HG13  VAL  75          HG13      VAL  75 301.558  -8.369  12.872
  591   HG21  VAL  75          HG21      VAL  75 299.602  -8.377   9.142
  592   HG22  VAL  75          HG22      VAL  75 299.871  -6.934  10.123
  593   HG23  VAL  75          HG23      VAL  75 298.538  -8.023  10.506
  594    H    PHE  76           H        PHE  76 303.351  -7.855  10.010
  595    HA   PHE  76           HA       PHE  76 304.828  -8.576  12.409
  596    HB2  PHE  76           HB2      PHE  76 306.031  -8.312   9.662
  597    HB3  PHE  76           HB3      PHE  76 306.970  -8.322  11.133
  598    HD1  PHE  76           HD1      PHE  76 306.421 -10.383  12.722
  599    HD2  PHE  76           HD2      PHE  76 305.904 -10.339   8.489
  600    HE1  PHE  76           HE1      PHE  76 306.562 -12.837  12.682
  601    HE2  PHE  76           HE2      PHE  76 306.043 -12.789   8.457
  602    HZ   PHE  76           HZ       PHE  76 306.372 -14.044  10.545
  603    H    GLN  77           H        GLN  77 305.929  -6.727  13.171
  604    HA   GLN  77           HA       GLN  77 305.097  -4.302  11.761
  605    HB2  GLN  77           HB2      GLN  77 304.577  -5.210  14.417
  606    HB3  GLN  77           HB3      GLN  77 305.400  -3.656  14.463
  607    HG2  GLN  77           HG2      GLN  77 303.698  -2.666  13.113
  608    HG3  GLN  77           HG3      GLN  77 302.973  -4.246  12.788
  609   HE21  GLN  77          HE21      GLN  77 302.774  -1.501  14.635
  610   HE22  GLN  77          HE22      GLN  77 301.784  -2.098  15.919
  611    H    GLN  78           H        GLN  78 306.762  -3.456  10.835
  612    HA   GLN  78           HA       GLN  78 308.780  -2.556  10.413
  613    HB2  GLN  78           HB2      GLN  78 308.132  -1.838  13.069
  614    HB3  GLN  78           HB3      GLN  78 309.848  -2.229  13.051
  615    HG2  GLN  78           HG2      GLN  78 310.378  -0.471  11.729
  616    HG3  GLN  78           HG3      GLN  78 308.843  -0.521  10.861
  617   HE21  GLN  78          HE21      GLN  78 308.544   1.694  11.059
  618   HE22  GLN  78          HE22      GLN  78 308.113   2.438  12.558
  619    H    GLN  79           H        GLN  79 311.282  -2.768  11.358
  620    HA   GLN  79           HA       GLN  79 313.057  -4.200  11.114
  621    HB2  GLN  79           HB2      GLN  79 313.276  -5.859  12.831
  622    HB3  GLN  79           HB3      GLN  79 312.434  -4.487  13.534
  623    HG2  GLN  79           HG2      GLN  79 310.453  -5.625  13.728
  624    HG3  GLN  79           HG3      GLN  79 310.839  -6.742  12.420
  625   HE21  GLN  79          HE21      GLN  79 311.124  -8.728  13.100
  626   HE22  GLN  79          HE22      GLN  79 311.828  -9.206  14.603
  627    H    THR  80           H        THR  80 310.891  -4.441   9.291
  628    HA   THR  80           HA       THR  80 311.132  -7.254   8.465
  629    HB   THR  80           HB       THR  80 308.754  -5.434   8.590
  630    HG1  THR  80           HG1      THR  80 309.170  -8.153   9.274
  631   HG21  THR  80          HG21      THR  80 308.223  -6.084   6.514
  632   HG22  THR  80          HG22      THR  80 307.689  -7.536   7.371
  633   HG23  THR  80          HG23      THR  80 309.268  -7.509   6.578
  634    H    GLY  81           H        GLY  81 311.399  -7.645   6.289
  635    HA2  GLY  81           HA2      GLY  81 311.103  -5.734   4.236
  636    HA3  GLY  81           HA3      GLY  81 312.781  -5.758   4.759
  637    H    GLY  82           H        GLY  82 310.225  -7.547   3.206
  638    HA2  GLY  82           HA2      GLY  82 311.631  -9.984   2.864
  639    HA3  GLY  82           HA3      GLY  82 310.223  -9.469   1.955
  640    H1   GLY   1           HT1      GLY   1 325.330   3.281  14.054
  641    H2   GLY   1           HT2      GLY   1 324.311   3.713  15.332
  642    H3   GLY   1           HT3      GLY   1 324.148   4.470  13.828
  643    HA2  GLY   1           HA3      GLY   1 323.931   1.613  13.664
  644    HA3  GLY   1           HA2      GLY   1 322.706   2.335  14.697
  645    H    SER   2           H        SER   2 321.267   1.472  12.993
  646    HA   SER   2           HA       SER   2 320.842   3.525  10.951
  647    HB2  SER   2           HB2      SER   2 321.995   1.834   9.709
  648    HB3  SER   2           HB3      SER   2 321.015   0.555  10.425
  649    HG   SER   2           HG       SER   2 320.023   0.875   8.545
  650    H    GLU   3           H        GLU   3 319.597   2.411  13.551
  651    HA   GLU   3           HA       GLU   3 317.541   1.773  14.373
  652    HB2  GLU   3           HB2      GLU   3 317.246   4.212  12.699
  653    HB3  GLU   3           HB3      GLU   3 315.777   3.474  13.324
  654    HG2  GLU   3           HG2      GLU   3 316.339   5.063  14.920
  655    HG3  GLU   3           HG3      GLU   3 316.926   3.547  15.603
  656    H    GLU   4           H        GLU   4 316.093   2.808  11.338
  657    HA   GLU   4           HA       GLU   4 314.682   0.299  11.112
  658    HB2  GLU   4           HB2      GLU   4 314.566   2.451   9.034
  659    HB3  GLU   4           HB3      GLU   4 313.298   1.366   9.586
  660    HG2  GLU   4           HG2      GLU   4 314.400   3.747  11.059
  661    HG3  GLU   4           HG3      GLU   4 312.813   3.601  10.306
  662    H    LYS   5           H        LYS   5 314.567   0.532   8.182
  663    HA   LYS   5           HA       LYS   5 315.598  -0.215   6.295
  664    HB2  LYS   5           HB2      LYS   5 318.154   0.098   7.858
  665    HB3  LYS   5           HB3      LYS   5 318.061  -0.267   6.156
  666    HG2  LYS   5           HG2      LYS   5 318.545   2.149   6.927
  667    HG3  LYS   5           HG3      LYS   5 317.445   1.867   5.582
  668    HD2  LYS   5           HD2      LYS   5 315.541   2.127   7.109
  669    HD3  LYS   5           HD3      LYS   5 316.653   2.384   8.452
  670    HE2  LYS   5           HE2      LYS   5 317.565   4.272   6.827
  671    HE3  LYS   5           HE3      LYS   5 315.911   4.193   6.231
  672    HZ1  LYS   5           HZ1      LYS   5 315.507   4.261   8.865
  673    HZ2  LYS   5           HZ2      LYS   5 315.546   5.641   7.888
  674    HZ3  LYS   5           HZ3      LYS   5 316.922   5.182   8.757
  675    HA   PRO   6           HA       PRO   6 315.655  -4.585   7.204
  676    HB2  PRO   6           HB2      PRO   6 316.788  -4.811   4.468
  677    HB3  PRO   6           HB3      PRO   6 315.324  -5.554   5.124
  678    HG2  PRO   6           HG2      PRO   6 315.141  -3.530   3.419
  679    HG3  PRO   6           HG3      PRO   6 314.073  -3.582   4.836
  680    HD2  PRO   6           HD2      PRO   6 316.600  -1.992   4.439
  681    HD3  PRO   6           HD3      PRO   6 315.043  -1.454   5.094
  682    H    LYS   7           H        LYS   7 317.213  -5.627   8.338
  683    HA   LYS   7           HA       LYS   7 319.990  -4.997   8.037
  684    HB2  LYS   7           HB2      LYS   7 318.415  -7.006   9.614
  685    HB3  LYS   7           HB3      LYS   7 320.144  -7.258   9.420
  686    HG2  LYS   7           HG2      LYS   7 319.834  -6.125  11.472
  687    HG3  LYS   7           HG3      LYS   7 320.485  -4.946  10.332
  688    HD2  LYS   7           HD2      LYS   7 318.174  -4.143   9.919
  689    HD3  LYS   7           HD3      LYS   7 317.602  -5.253  11.166
  690    HE2  LYS   7           HE2      LYS   7 319.043  -4.119  12.807
  691    HE3  LYS   7           HE3      LYS   7 319.556  -2.989  11.555
  692    HZ1  LYS   7           HZ1      LYS   7 317.741  -2.187  13.056
  693    HZ2  LYS   7           HZ2      LYS   7 316.722  -3.337  12.349
  694    HZ3  LYS   7           HZ3      LYS   7 317.387  -2.103  11.403
  695    H    GLU   8           H        GLU   8 319.830  -5.299   5.669
  696    HA   GLU   8           HA       GLU   8 320.434  -6.426   3.782
  697    HB2  GLU   8           HB2      GLU   8 321.498  -8.109   5.922
  698    HB3  GLU   8           HB3      GLU   8 321.006  -9.053   4.524
  699    HG2  GLU   8           HG2      GLU   8 322.748  -6.637   4.233
  700    HG3  GLU   8           HG3      GLU   8 323.419  -8.214   4.646
  701    H    GLY   9           H        GLY   9 318.019  -6.125   3.576
  702    HA2  GLY   9           HA2      GLY   9 316.730  -8.753   3.465
  703    HA3  GLY   9           HA3      GLY   9 315.865  -7.356   4.058
  704    H    VAL  10           H        VAL  10 318.043  -7.643   1.343
  705    HA   VAL  10           HA       VAL  10 315.976  -6.604  -0.460
  706    HB   VAL  10           HB       VAL  10 317.986  -5.338  -0.521
  707   HG11  VAL  10          HG11      VAL  10 319.922  -7.267  -1.401
  708   HG12  VAL  10          HG12      VAL  10 319.221  -7.773   0.139
  709   HG13  VAL  10          HG13      VAL  10 319.974  -6.184  -0.010
  710   HG21  VAL  10          HG21      VAL  10 316.901  -6.234  -2.729
  711   HG22  VAL  10          HG22      VAL  10 318.446  -7.068  -2.905
  712   HG23  VAL  10          HG23      VAL  10 318.403  -5.309  -2.781
  713    H    LYS  11           H        LYS  11 314.845  -8.023  -1.563
  714    HA   LYS  11           HA       LYS  11 316.163 -10.474  -2.499
  715    HB2  LYS  11           HB2      LYS  11 313.506 -10.004  -1.378
  716    HB3  LYS  11           HB3      LYS  11 313.583 -11.073  -2.768
  717    HG2  LYS  11           HG2      LYS  11 314.036 -12.567  -1.201
  718    HG3  LYS  11           HG3      LYS  11 315.654 -12.004  -1.483
  719    HD2  LYS  11           HD2      LYS  11 314.118 -11.954   0.924
  720    HD3  LYS  11           HD3      LYS  11 315.824 -11.652   0.660
  721    HE2  LYS  11           HE2      LYS  11 315.583  -9.445   0.892
  722    HE3  LYS  11           HE3      LYS  11 314.109  -9.377  -0.050
  723    HZ1  LYS  11           HZ3      LYS  11 313.027 -10.436   1.977
  724    H    THR  12           H        THR  12 313.243  -8.699  -3.337
  725    HA   THR  12           HA       THR  12 314.055  -8.737  -6.173
  726    HB   THR  12           HB       THR  12 311.646  -8.766  -6.729
  727    HG1  THR  12           HG1      THR  12 310.138  -8.882  -5.175
  728   HG21  THR  12          HG21      THR  12 311.212 -11.018  -6.295
  729   HG22  THR  12          HG22      THR  12 312.157 -11.004  -4.806
  730   HG23  THR  12          HG23      THR  12 312.970 -10.902  -6.367
  731    H    GLU  13           H        GLU  13 315.144  -6.684  -5.608
  732    HA   GLU  13           HA       GLU  13 315.286  -4.411  -5.484
  733    HB2  GLU  13           HB2      GLU  13 312.887  -4.486  -7.313
  734    HB3  GLU  13           HB3      GLU  13 314.143  -3.257  -7.240
  735    HG2  GLU  13           HG2      GLU  13 315.775  -4.908  -8.035
  736    HG3  GLU  13           HG3      GLU  13 314.488  -6.106  -8.145
  737    H    ASN  14           H        ASN  14 311.825  -4.105  -6.024
  738    HA   ASN  14           HA       ASN  14 311.303  -2.263  -4.129
  739    HB2  ASN  14           HB2      ASN  14 309.792  -3.335  -5.931
  740    HB3  ASN  14           HB3      ASN  14 309.284  -4.366  -4.601
  741   HD21  ASN  14          HD21      ASN  14 308.823  -1.445  -6.159
  742   HD22  ASN  14          HD22      ASN  14 307.819  -0.677  -4.981
  743    H    ASP  15           H        ASP  15 312.362  -2.525  -2.215
  744    HA   ASP  15           HA       ASP  15 310.991  -3.709  -0.097
  745    HB2  ASP  15           HB2      ASP  15 312.803  -5.424   0.502
  746    HB3  ASP  15           HB3      ASP  15 311.643  -5.872  -0.741
  747    H    HIS  16           H        HIS  16 312.290  -1.312  -0.827
  748    HA   HIS  16           HA       HIS  16 314.065   0.071  -0.374
  749    HB2  HIS  16           HB2      HIS  16 312.682  -0.193   2.262
  750    HB3  HIS  16           HB3      HIS  16 313.542   1.184   1.632
  751    HD1  HIS  16           HD1      HIS  16 310.303  -0.639   1.234
  752    HD2  HIS  16           HD2      HIS  16 312.220   2.772  -0.171
  753    HE1  HIS  16           HE1      HIS  16 308.523   0.685   0.046
  754    HE2  HIS  16           HE2      HIS  16 309.677   2.801  -0.690
  755    H    ILE  17           H        ILE  17 316.002   0.409   0.287
  756    HA   ILE  17           HA       ILE  17 317.154  -1.188   2.446
  757    HB   ILE  17           HB       ILE  17 319.165  -1.676   1.278
  758   HG12  ILE  17          HG12      ILE  17 318.044  -0.133  -1.058
  759   HG13  ILE  17          HG13      ILE  17 319.396   0.358  -0.061
  760   HG21  ILE  17          HG21      ILE  17 318.361  -3.472   0.229
  761   HG22  ILE  17          HG22      ILE  17 317.487  -2.498  -0.959
  762   HG23  ILE  17          HG23      ILE  17 316.765  -2.827   0.618
  763   HD11  ILE  17          HD11      ILE  17 319.924  -2.224  -1.130
  764   HD12  ILE  17          HD12      ILE  17 320.800  -0.706  -1.369
  765   HD13  ILE  17          HD13      ILE  17 319.449  -1.128  -2.429
  766    H    ASN  18           H        ASN  18 319.152  -0.232   3.258
  767    HA   ASN  18           HA       ASN  18 318.919   2.655   3.249
  768    HB2  ASN  18           HB2      ASN  18 319.390   1.098   5.318
  769    HB3  ASN  18           HB3      ASN  18 321.032   1.128   4.740
  770   HD21  ASN  18          HD21      ASN  18 318.461   3.504   5.121
  771   HD22  ASN  18          HD22      ASN  18 319.441   4.656   5.939
  772    H    LEU  19           H        LEU  19 320.345   3.977   2.186
  773    HA   LEU  19           HA       LEU  19 322.614   2.673   0.896
  774    HB2  LEU  19           HB2      LEU  19 320.509   4.230  -0.315
  775    HB3  LEU  19           HB3      LEU  19 322.067   4.971  -0.616
  776    HG   LEU  19           HG       LEU  19 321.132   2.199  -1.375
  777   HD11  LEU  19          HD11      LEU  19 322.032   2.832  -3.578
  778   HD12  LEU  19          HD12      LEU  19 322.366   4.437  -2.942
  779   HD13  LEU  19          HD13      LEU  19 320.710   3.858  -3.040
  780   HD21  LEU  19          HD21      LEU  19 323.131   1.343  -0.956
  781   HD22  LEU  19          HD22      LEU  19 323.807   2.928  -0.527
  782   HD23  LEU  19          HD23      LEU  19 323.779   2.398  -2.212
  783    H    LYS  20           H        LYS  20 324.501   3.406   1.272
  784    HA   LYS  20           HA       LYS  20 324.774   5.817   2.918
  785    HB2  LYS  20           HB2      LYS  20 326.089   3.303   2.775
  786    HB3  LYS  20           HB3      LYS  20 327.260   4.520   2.442
  787    HG2  LYS  20           HG2      LYS  20 326.930   5.539   4.451
  788    HG3  LYS  20           HG3      LYS  20 325.416   4.754   4.725
  789    HD2  LYS  20           HD2      LYS  20 328.075   3.946   5.463
  790    HD3  LYS  20           HD3      LYS  20 326.522   3.342   6.041
  791    HE2  LYS  20           HE2      LYS  20 326.424   1.704   4.386
  792    HE3  LYS  20           HE3      LYS  20 327.670   2.488   3.408
  793    HZ1  LYS  20           HZ1      LYS  20 328.167   0.410   4.951
  794    HZ2  LYS  20           HZ2      LYS  20 328.440   1.635   6.084
  795    HZ3  LYS  20           HZ3      LYS  20 329.324   1.606   4.643
  796    H    VAL  21           H        VAL  21 325.852   7.674   2.096
  797    HA   VAL  21           HA       VAL  21 327.081   7.394  -0.551
  798    HB   VAL  21           HB       VAL  21 326.020  10.037   0.365
  799   HG11  VAL  21          HG11      VAL  21 327.415   9.601  -1.712
  800   HG12  VAL  21          HG12      VAL  21 325.923  10.514  -1.932
  801   HG13  VAL  21          HG13      VAL  21 325.987   8.808  -2.375
  802   HG21  VAL  21          HG21      VAL  21 323.827   9.612  -0.557
  803   HG22  VAL  21          HG22      VAL  21 324.154   8.432   0.715
  804   HG23  VAL  21          HG23      VAL  21 324.284   7.961  -0.979
  805    H    ALA  22           H        ALA  22 329.209   7.997  -0.605
  806    HA   ALA  22           HA       ALA  22 330.297   9.122   1.870
  807    HB1  ALA  22           HB1      ALA  22 332.282   8.283  -0.053
  808    HB2  ALA  22           HB2      ALA  22 331.104   7.010   0.279
  809    HB3  ALA  22           HB3      ALA  22 332.006   7.746   1.606
  810    H    GLY  23           H        GLY  23 330.152  11.286   1.778
  811    HA2  GLY  23           HA2      GLY  23 330.921  12.712  -0.644
  812    HA3  GLY  23           HA3      GLY  23 330.219  13.419   0.785
  813    H    GLN  24           H        GLN  24 332.284  14.648  -0.466
  814    HA   GLN  24           HA       GLN  24 334.879  14.026   0.233
  815    HB2  GLN  24           HB2      GLN  24 333.860  16.837   0.227
  816    HB3  GLN  24           HB3      GLN  24 335.453  16.264  -0.226
  817    HG2  GLN  24           HG2      GLN  24 334.252  15.017  -2.111
  818    HG3  GLN  24           HG3      GLN  24 332.886  16.074  -1.750
  819   HE21  GLN  24          HE21      GLN  24 335.218  15.728  -3.870
  820   HE22  GLN  24          HE22      GLN  24 335.615  17.373  -4.217
  821    H    ASP  25           H        ASP  25 332.337  14.960   2.291
  822    HA   ASP  25           HA       ASP  25 333.550  16.379   4.304
  823    HB2  ASP  25           HB2      ASP  25 331.106  15.733   4.079
  824    HB3  ASP  25           HB3      ASP  25 331.540  14.202   4.829
  825    H    GLY  26           H        GLY  26 334.581  13.364   3.300
  826    HA2  GLY  26           HA2      GLY  26 336.139  11.928   4.187
  827    HA3  GLY  26           HA3      GLY  26 336.384  13.102   5.479
  828    H    SER  27           H        SER  27 333.477  11.374   4.465
  829    HA   SER  27           HA       SER  27 333.474   9.527   6.626
  830    HB2  SER  27           HB2      SER  27 331.411  11.725   6.836
  831    HB3  SER  27           HB3      SER  27 331.745  10.441   7.997
  832    HG   SER  27           HG       SER  27 332.620  12.594   8.485
  833    H    VAL  28           H        VAL  28 330.493   9.630   6.725
  834    HA   VAL  28           HA       VAL  28 329.756   9.029   3.982
  835    HB   VAL  28           HB       VAL  28 330.680   6.930   4.634
  836   HG11  VAL  28          HG11      VAL  28 328.947   7.019   7.095
  837   HG12  VAL  28          HG12      VAL  28 330.683   7.352   7.054
  838   HG13  VAL  28          HG13      VAL  28 330.080   5.743   6.645
  839   HG21  VAL  28          HG21      VAL  28 328.828   5.457   4.310
  840   HG22  VAL  28          HG22      VAL  28 328.425   6.954   3.475
  841   HG23  VAL  28          HG23      VAL  28 327.703   6.604   5.047
  842    H    VAL  29           H        VAL  29 327.470   8.597   3.774
  843    HA   VAL  29           HA       VAL  29 325.848   9.530   6.033
  844    HB   VAL  29           HB       VAL  29 324.241  10.307   4.088
  845   HG11  VAL  29          HG11      VAL  29 324.910  12.564   4.457
  846   HG12  VAL  29          HG12      VAL  29 326.523  12.052   4.964
  847   HG13  VAL  29          HG13      VAL  29 325.117  11.654   5.957
  848   HG21  VAL  29          HG21      VAL  29 325.907   9.573   2.373
  849   HG22  VAL  29          HG22      VAL  29 326.905  10.938   2.864
  850   HG23  VAL  29          HG23      VAL  29 325.296  11.209   2.192
  851    H    GLN  30           H        GLN  30 323.761   8.594   6.080
  852    HA   GLN  30           HA       GLN  30 323.627   6.119   4.495
  853    HB2  GLN  30           HB2      GLN  30 323.554   6.607   7.304
  854    HB3  GLN  30           HB3      GLN  30 322.158   5.670   6.809
  855    HG2  GLN  30           HG2      GLN  30 323.812   4.149   5.645
  856    HG3  GLN  30           HG3      GLN  30 325.076   5.038   6.504
  857   HE21  GLN  30          HE21      GLN  30 323.831   2.214   6.598
  858   HE22  GLN  30          HE22      GLN  30 323.621   1.936   8.290
  859    H    PHE  31           H        PHE  31 322.195   6.303   3.046
  860    HA   PHE  31           HA       PHE  31 319.704   7.757   3.387
  861    HB2  PHE  31           HB2      PHE  31 321.075   6.502   0.986
  862    HB3  PHE  31           HB3      PHE  31 319.531   7.276   0.898
  863    HD1  PHE  31           HD2      PHE  31 322.527   8.336   2.813
  864    HD2  PHE  31           HD1      PHE  31 319.896   9.165  -0.420
  865    HE1  PHE  31           HE2      PHE  31 323.622  10.492   2.465
  866    HE2  PHE  31           HE1      PHE  31 321.021  11.320  -0.770
  867    HZ   PHE  31           HZ       PHE  31 322.886  11.983   0.674
  868    H    LYS  32           H        LYS  32 317.788   6.675   2.316
  869    HA   LYS  32           HA       LYS  32 317.844   3.773   2.554
  870    HB2  LYS  32           HB2      LYS  32 316.823   4.306   4.630
  871    HB3  LYS  32           HB3      LYS  32 315.836   5.543   3.907
  872    HG2  LYS  32           HG2      LYS  32 314.936   3.426   2.526
  873    HG3  LYS  32           HG3      LYS  32 315.418   2.622   4.024
  874    HD2  LYS  32           HD2      LYS  32 313.899   5.124   4.366
  875    HD3  LYS  32           HD3      LYS  32 313.008   3.800   3.616
  876    HE2  LYS  32           HE2      LYS  32 312.713   2.881   5.620
  877    HE3  LYS  32           HE3      LYS  32 314.457   2.719   5.790
  878    HZ1  LYS  32           HZ1      LYS  32 312.665   4.766   6.864
  879    HZ2  LYS  32           HZ2      LYS  32 314.233   5.239   6.446
  880    HZ3  LYS  32           HZ3      LYS  32 313.997   4.011   7.585
  881    H    ILE  33           H        ILE  33 317.541   3.176   0.661
  882    HA   ILE  33           HA       ILE  33 315.429   4.378  -0.985
  883    HB   ILE  33           HB       ILE  33 317.607   5.374  -1.636
  884   HG12  ILE  33          HG12      ILE  33 317.090   3.550  -3.916
  885   HG13  ILE  33          HG13      ILE  33 315.678   4.380  -3.296
  886   HG21  ILE  33          HG21      ILE  33 318.782   3.104  -2.919
  887   HG22  ILE  33          HG22      ILE  33 318.548   2.763  -1.204
  888   HG23  ILE  33          HG23      ILE  33 319.459   4.186  -1.704
  889   HD11  ILE  33          HD11      ILE  33 316.525   5.704  -5.044
  890   HD12  ILE  33          HD12      ILE  33 318.174   5.586  -4.431
  891   HD13  ILE  33          HD13      ILE  33 316.969   6.524  -3.548
  892    H    LYS  34           H        LYS  34 314.369   2.971  -2.284
  893    HA   LYS  34           HA       LYS  34 314.503   0.243  -1.627
  894    HB2  LYS  34           HB2      LYS  34 312.409   1.176  -2.295
  895    HB3  LYS  34           HB3      LYS  34 313.080   1.734  -3.810
  896    HG2  LYS  34           HG2      LYS  34 313.497  -0.980  -3.900
  897    HG3  LYS  34           HG3      LYS  34 311.935  -0.829  -3.101
  898    HD2  LYS  34           HD2      LYS  34 312.731   0.248  -5.804
  899    HD3  LYS  34           HD3      LYS  34 311.523  -0.984  -5.451
  900    HE2  LYS  34           HE2      LYS  34 311.397   1.955  -4.809
  901    HE3  LYS  34           HE3      LYS  34 310.380   1.058  -5.936
  902    HZ1  LYS  34           HZ1      LYS  34 310.102  -0.218  -3.510
  903    HZ2  LYS  34           HZ2      LYS  34 308.970   0.786  -4.264
  904    HZ3  LYS  34           HZ3      LYS  34 310.055   1.433  -3.140
  905    H    ARG  35           H        ARG  35 314.341   0.590  -5.021
  906    HA   ARG  35           HA       ARG  35 317.151   0.198  -5.445
  907    HB2  ARG  35           HB2      ARG  35 315.397  -2.110  -6.202
  908    HB3  ARG  35           HB3      ARG  35 317.143  -2.001  -6.263
  909    HG2  ARG  35           HG2      ARG  35 316.058  -1.640  -3.586
  910    HG3  ARG  35           HG3      ARG  35 315.704  -3.180  -4.304
  911    HD2  ARG  35           HD2      ARG  35 318.362  -1.970  -3.714
  912    HD3  ARG  35           HD3      ARG  35 317.710  -3.513  -3.176
  913    HE   ARG  35           HE       ARG  35 319.132  -2.998  -5.594
  914   HH11  ARG  35          HH11      ARG  35 316.649  -5.006  -4.195
  915   HH12  ARG  35          HH12      ARG  35 316.974  -6.350  -5.236
  916   HH21  ARG  35          HH21      ARG  35 319.556  -4.778  -6.967
  917   HH22  ARG  35          HH22      ARG  35 318.610  -6.218  -6.811
  918    H    HIS  36           H        HIS  36 314.167  -0.834  -7.087
  919    HA   HIS  36           HA       HIS  36 314.980  -0.191  -9.667
  920    HB2  HIS  36           HB2      HIS  36 313.122  -1.466  -9.855
  921    HB3  HIS  36           HB3      HIS  36 312.456  -0.898  -8.328
  922    HD1  HIS  36           HD1      HIS  36 310.585   0.767  -8.458
  923    HD2  HIS  36           HD2      HIS  36 312.516   0.262 -12.102
  924    HE1  HIS  36           HE1      HIS  36 309.198   2.029 -10.133
  925    HE2  HIS  36           HE2      HIS  36 310.339   1.638 -12.346
  926    H    THR  37           H        THR  37 314.245   1.918  -7.164
  927    HA   THR  37           HA       THR  37 313.272   4.088  -8.822
  928    HB   THR  37           HB       THR  37 314.140   3.966  -5.935
  929    HG1  THR  37           HG1      THR  37 312.074   3.106  -6.481
  930   HG21  THR  37          HG21      THR  37 314.325   6.162  -5.841
  931   HG22  THR  37          HG22      THR  37 312.697   6.338  -6.497
  932   HG23  THR  37          HG23      THR  37 314.086   6.270  -7.590
  933    HA   PRO  38           HA       PRO  38 317.156   5.238 -10.643
  934    HB2  PRO  38           HB2      PRO  38 315.896   7.889 -10.306
  935    HB3  PRO  38           HB3      PRO  38 316.542   7.126 -11.775
  936    HG2  PRO  38           HG2      PRO  38 313.835   7.314 -11.029
  937    HG3  PRO  38           HG3      PRO  38 314.500   6.302 -12.313
  938    HD2  PRO  38           HD2      PRO  38 313.297   5.520  -9.885
  939    HD3  PRO  38           HD3      PRO  38 314.067   4.483 -11.089
  940    H    LEU  39           H        LEU  39 319.044   6.106  -9.803
  941    HA   LEU  39           HA       LEU  39 319.101   6.509  -7.019
  942    HB2  LEU  39           HB2      LEU  39 321.098   6.617  -9.196
  943    HB3  LEU  39           HB3      LEU  39 321.507   7.411  -7.681
  944    HG   LEU  39           HG       LEU  39 320.570   4.548  -7.856
  945   HD11  LEU  39          HD11      LEU  39 323.283   4.670  -7.135
  946   HD12  LEU  39          HD12      LEU  39 323.096   5.661  -8.578
  947   HD13  LEU  39          HD13      LEU  39 322.577   3.976  -8.596
  948   HD21  LEU  39          HD21      LEU  39 322.182   5.141  -5.583
  949   HD22  LEU  39          HD22      LEU  39 320.491   4.644  -5.640
  950   HD23  LEU  39          HD23      LEU  39 320.907   6.358  -5.693
  951    H    SER  40           H        SER  40 318.692   8.793  -9.672
  952    HA   SER  40           HA       SER  40 319.549  11.132  -8.557
  953    HB2  SER  40           HB2      SER  40 318.564  11.925 -10.410
  954    HB3  SER  40           HB3      SER  40 317.830  10.342 -10.669
  955    HG   SER  40           HG       SER  40 315.993  11.026  -9.779
  956    H    LYS  41           H        LYS  41 316.983   9.096  -7.494
  957    HA   LYS  41           HA       LYS  41 315.489  10.985  -6.014
  958    HB2  LYS  41           HB2      LYS  41 315.657   8.070  -6.346
  959    HB3  LYS  41           HB3      LYS  41 314.882   8.659  -4.904
  960    HG2  LYS  41           HG2      LYS  41 313.084   8.519  -6.282
  961    HG3  LYS  41           HG3      LYS  41 313.582  10.163  -6.629
  962    HD2  LYS  41           HD2      LYS  41 314.438   9.624  -8.691
  963    HD3  LYS  41           HD3      LYS  41 314.726   7.937  -8.251
  964    HE2  LYS  41           HE2      LYS  41 312.809   8.437  -9.867
  965    HE3  LYS  41           HE3      LYS  41 312.490   7.367  -8.506
  966    HZ1  LYS  41           HZ1      LYS  41 310.735   9.041  -8.880
  967    HZ2  LYS  41           HZ2      LYS  41 311.851  10.264  -8.536
  968    HZ3  LYS  41           HZ3      LYS  41 311.427   9.146  -7.340
  969    H    LEU  42           H        LEU  42 318.238   8.950  -5.487
  970    HA   LEU  42           HA       LEU  42 318.423   9.424  -2.641
  971    HB2  LEU  42           HB2      LEU  42 318.879   7.219  -3.529
  972    HB3  LEU  42           HB3      LEU  42 320.088   7.872  -4.613
  973    HG   LEU  42           HG       LEU  42 320.412   8.157  -1.671
  974   HD11  LEU  42          HD11      LEU  42 321.911   6.007  -2.201
  975   HD12  LEU  42          HD12      LEU  42 320.508   5.696  -3.223
  976   HD13  LEU  42          HD13      LEU  42 320.300   5.946  -1.489
  977   HD21  LEU  42          HD21      LEU  42 322.369   9.024  -2.256
  978   HD22  LEU  42          HD22      LEU  42 321.898   8.874  -3.950
  979   HD23  LEU  42          HD23      LEU  42 322.771   7.560  -3.155
  980    H    MET  43           H        MET  43 319.641  10.670  -5.591
  981    HA   MET  43           HA       MET  43 322.124  11.678  -4.740
  982    HB2  MET  43           HB2      MET  43 320.440  11.866  -7.088
  983    HB3  MET  43           HB3      MET  43 321.316  13.359  -6.778
  984    HG2  MET  43           HG2      MET  43 323.001  12.400  -7.858
  985    HG3  MET  43           HG3      MET  43 323.236  11.461  -6.386
  986    HE1  MET  43           HE1      MET  43 323.684  10.426  -9.958
  987    HE2  MET  43           HE2      MET  43 324.021   8.951  -9.043
  988    HE3  MET  43           HE3      MET  43 324.544  10.515  -8.411
  989    H    LYS  44           H        LYS  44 318.935  13.298  -4.876
  990    HA   LYS  44           HA       LYS  44 320.030  15.816  -4.097
  991    HB2  LYS  44           HB2      LYS  44 317.932  15.588  -5.357
  992    HB3  LYS  44           HB3      LYS  44 317.161  14.976  -3.907
  993    HG2  LYS  44           HG2      LYS  44 317.002  17.506  -4.606
  994    HG3  LYS  44           HG3      LYS  44 317.077  17.038  -2.924
  995    HD2  LYS  44           HD2      LYS  44 318.764  18.473  -2.751
  996    HD3  LYS  44           HD3      LYS  44 319.713  17.376  -3.732
  997    HE2  LYS  44           HE2      LYS  44 319.880  19.395  -4.854
  998    HE3  LYS  44           HE3      LYS  44 318.656  18.493  -5.741
  999    HZ1  LYS  44           HZ1      LYS  44 317.038  19.916  -5.131
 1000    HZ2  LYS  44           HZ2      LYS  44 318.322  20.998  -4.924
 1001    HZ3  LYS  44           HZ3      LYS  44 317.680  20.183  -3.588
 1002    H    ALA  45           H        ALA  45 319.107  13.034  -2.289
 1003    HA   ALA  45           HA       ALA  45 318.356  14.314   0.116
 1004    HB1  ALA  45           HB1      ALA  45 317.966  12.143   0.536
 1005    HB2  ALA  45           HB2      ALA  45 319.671  12.070   1.005
 1006    HB3  ALA  45           HB3      ALA  45 319.172  11.603  -0.632
 1007    H    TYR  46           H        TYR  46 321.508  13.106  -1.025
 1008    HA   TYR  46           HA       TYR  46 323.026  13.976   1.097
 1009    HB2  TYR  46           HB2      TYR  46 323.688  12.738  -1.187
 1010    HB3  TYR  46           HB3      TYR  46 324.268  14.356  -1.570
 1011    HD1  TYR  46           HD2      TYR  46 324.375  13.800   1.934
 1012    HD2  TYR  46           HD1      TYR  46 326.475  12.983  -1.672
 1013    HE1  TYR  46           HE2      TYR  46 326.384  13.336   3.229
 1014    HE2  TYR  46           HE1      TYR  46 328.509  12.503  -0.377
 1015    HH   TYR  46           HH       TYR  46 328.476  12.167   3.047
 1016    H    CYS  47           H        CYS  47 322.444  15.863  -1.969
 1017    HA   CYS  47           HA       CYS  47 323.645  18.192  -1.381
 1018    HB2  CYS  47           HB2      CYS  47 322.445  18.088  -3.413
 1019    HB3  CYS  47           HB3      CYS  47 321.027  17.441  -2.626
 1020    HG   CYS  47           HG       CYS  47 321.152  20.193  -3.401
 1021    H    GLU  48           H        GLU  48 320.198  17.661  -0.707
 1022    HA   GLU  48           HA       GLU  48 319.757  19.774   0.988
 1023    HB2  GLU  48           HB2      GLU  48 318.393  17.137   1.462
 1024    HB3  GLU  48           HB3      GLU  48 317.729  18.757   1.606
 1025    HG2  GLU  48           HG2      GLU  48 317.693  18.993  -0.825
 1026    HG3  GLU  48           HG3      GLU  48 318.483  17.443  -0.994
 1027    H    ARG  49           H        ARG  49 321.496  16.870   1.591
 1028    HA   ARG  49           HA       ARG  49 321.402  16.901   4.445
 1029    HB2  ARG  49           HB2      ARG  49 322.326  15.226   2.306
 1030    HB3  ARG  49           HB3      ARG  49 323.581  15.398   3.500
 1031    HG2  ARG  49           HG2      ARG  49 322.406  14.229   5.073
 1032    HG3  ARG  49           HG3      ARG  49 320.850  14.739   4.412
 1033    HD2  ARG  49           HD2      ARG  49 322.358  13.146   2.525
 1034    HD3  ARG  49           HD3      ARG  49 322.050  12.284   4.011
 1035    HE   ARG  49           HE       ARG  49 320.147  12.872   2.058
 1036   HH11  ARG  49          HH11      ARG  49 320.531  12.763   5.513
 1037   HH12  ARG  49          HH12      ARG  49 318.856  12.448   5.817
 1038   HH21  ARG  49          HH21      ARG  49 317.935  12.458   2.448
 1039   HH22  ARG  49          HH22      ARG  49 317.384  12.272   4.079
 1040    H    GLN  50           H        GLN  50 323.918  17.550   1.989
 1041    HA   GLN  50           HA       GLN  50 325.597  18.844   4.015
 1042    HB2  GLN  50           HB2      GLN  50 326.428  18.260   1.229
 1043    HB3  GLN  50           HB3      GLN  50 327.438  18.458   2.624
 1044    HG2  GLN  50           HG2      GLN  50 326.534  16.299   3.485
 1045    HG3  GLN  50           HG3      GLN  50 325.715  16.105   1.933
 1046   HE21  GLN  50          HE21      GLN  50 326.828  15.369   0.231
 1047   HE22  GLN  50          HE22      GLN  50 328.524  15.053   0.208
 1048    H    GLY  51           H        GLY  51 323.617  19.575   1.337
 1049    HA2  GLY  51           HA2      GLY  51 323.005  21.718   0.585
 1050    HA3  GLY  51           HA3      GLY  51 324.385  22.388   1.458
 1051    H    LEU  52           H        LEU  52 323.827  19.997  -1.099
 1052    HA   LEU  52           HA       LEU  52 326.058  21.167  -2.642
 1053    HB2  LEU  52           HB2      LEU  52 325.120  18.321  -2.824
 1054    HB3  LEU  52           HB3      LEU  52 326.619  19.020  -3.402
 1055    HG   LEU  52           HG       LEU  52 326.199  19.220  -0.506
 1056   HD11  LEU  52          HD11      LEU  52 327.188  16.592  -1.305
 1057   HD12  LEU  52          HD12      LEU  52 325.462  16.839  -1.587
 1058   HD13  LEU  52          HD13      LEU  52 326.137  17.058   0.035
 1059   HD21  LEU  52          HD21      LEU  52 328.543  18.067  -1.895
 1060   HD22  LEU  52          HD22      LEU  52 328.465  19.134  -0.488
 1061   HD23  LEU  52          HD23      LEU  52 328.170  19.783  -2.112
 1062    H    SER  53           H        SER  53 325.756  21.458  -4.837
 1063    HA   SER  53           HA       SER  53 323.049  21.477  -5.767
 1064    HB2  SER  53           HB2      SER  53 324.832  21.489  -8.000
 1065    HB3  SER  53           HB3      SER  53 323.916  22.835  -7.333
 1066    HG   SER  53           HG       SER  53 326.506  21.985  -6.538
 1067    H    MET  54           H        MET  54 322.241  19.430  -5.518
 1068    HA   MET  54           HA       MET  54 323.104  16.995  -5.701
 1069    HB2  MET  54           HB2      MET  54 320.759  17.686  -5.449
 1070    HB3  MET  54           HB3      MET  54 320.623  17.912  -7.168
 1071    HG2  MET  54           HG2      MET  54 321.588  15.438  -7.120
 1072    HG3  MET  54           HG3      MET  54 320.733  15.489  -5.596
 1073    HE1  MET  54           HE1      MET  54 318.743  16.477  -9.615
 1074    HE2  MET  54           HE2      MET  54 320.244  15.552  -9.601
 1075    HE3  MET  54           HE3      MET  54 320.214  17.193  -8.957
 1076    H    ARG  55           H        ARG  55 322.820  19.039  -8.468
 1077    HA   ARG  55           HA       ARG  55 323.316  16.926 -10.376
 1078    HB2  ARG  55           HB2      ARG  55 323.626  19.317 -11.723
 1079    HB3  ARG  55           HB3      ARG  55 322.123  18.417 -11.571
 1080    HG2  ARG  55           HG2      ARG  55 321.449  19.739  -9.676
 1081    HG3  ARG  55           HG3      ARG  55 323.018  20.553  -9.646
 1082    HD2  ARG  55           HD2      ARG  55 320.760  20.872 -11.576
 1083    HD3  ARG  55           HD3      ARG  55 321.686  22.104 -10.717
 1084    HE   ARG  55           HE       ARG  55 322.268  21.008 -13.275
 1085   HH11  ARG  55          HH11      ARG  55 323.773  22.250 -10.382
 1086   HH12  ARG  55          HH12      ARG  55 325.217  22.748 -11.197
 1087   HH21  ARG  55          HH21      ARG  55 324.167  21.662 -14.349
 1088   HH22  ARG  55          HH22      ARG  55 325.441  22.415 -13.449
 1089    H    GLN  56           H        GLN  56 325.046  19.489  -8.746
 1090    HA   GLN  56           HA       GLN  56 327.365  19.508 -10.297
 1091    HB2  GLN  56           HB2      GLN  56 326.417  20.541  -7.702
 1092    HB3  GLN  56           HB3      GLN  56 328.167  20.470  -7.925
 1093    HG2  GLN  56           HG2      GLN  56 327.552  21.638 -10.220
 1094    HG3  GLN  56           HG3      GLN  56 326.144  22.152  -9.294
 1095   HE21  GLN  56          HE21      GLN  56 329.673  21.955  -9.028
 1096   HE22  GLN  56          HE22      GLN  56 329.869  23.462  -8.207
 1097    H    ILE  57           H        ILE  57 326.504  17.564  -7.415
 1098    HA   ILE  57           HA       ILE  57 329.180  16.746  -6.983
 1099    HB   ILE  57           HB       ILE  57 328.094  14.827  -5.665
 1100   HG12  ILE  57          HG12      ILE  57 325.747  16.280  -6.638
 1101   HG13  ILE  57          HG13      ILE  57 325.877  14.650  -5.991
 1102   HG21  ILE  57          HG21      ILE  57 327.963  16.156  -3.739
 1103   HG22  ILE  57          HG22      ILE  57 327.555  17.596  -4.684
 1104   HG23  ILE  57          HG23      ILE  57 329.176  16.903  -4.786
 1105   HD11  ILE  57          HD11      ILE  57 325.795  17.181  -4.384
 1106   HD12  ILE  57          HD12      ILE  57 325.909  15.538  -3.740
 1107   HD13  ILE  57          HD13      ILE  57 324.454  16.047  -4.606
 1108    H    ARG  58           H        ARG  58 329.595  14.257  -6.849
 1109    HA   ARG  58           HA       ARG  58 328.720  13.036  -9.363
 1110    HB2  ARG  58           HB2      ARG  58 331.497  12.490  -8.624
 1111    HB3  ARG  58           HB3      ARG  58 330.800  12.887 -10.189
 1112    HG2  ARG  58           HG2      ARG  58 331.205  14.974  -8.070
 1113    HG3  ARG  58           HG3      ARG  58 332.486  14.520  -9.185
 1114    HD2  ARG  58           HD2      ARG  58 331.151  15.169 -11.057
 1115    HD3  ARG  58           HD3      ARG  58 329.756  15.445 -10.040
 1116    HE   ARG  58           HE       ARG  58 330.571  17.532  -9.632
 1117   HH11  ARG  58          HH11      ARG  58 333.220  15.516 -10.680
 1118   HH12  ARG  58          HH12      ARG  58 334.365  16.814 -10.693
 1119   HH21  ARG  58          HH21      ARG  58 332.076  19.241  -9.656
 1120   HH22  ARG  58          HH22      ARG  58 333.717  18.928 -10.114
 1121    H    PHE  59           H        PHE  59 327.813  11.125  -8.856
 1122    HA   PHE  59           HA       PHE  59 328.637   9.828  -6.366
 1123    HB2  PHE  59           HB2      PHE  59 326.193   9.452  -8.076
 1124    HB3  PHE  59           HB3      PHE  59 326.630   8.340  -6.813
 1125    HD1  PHE  59           HD1      PHE  59 327.256  11.922  -6.408
 1126    HD2  PHE  59           HD2      PHE  59 324.583   8.706  -5.632
 1127    HE1  PHE  59           HE1      PHE  59 326.080  13.296  -4.753
 1128    HE2  PHE  59           HE2      PHE  59 323.403  10.088  -3.986
 1129    HZ   PHE  59           HZ       PHE  59 324.149  12.390  -3.541
 1130    H    ARG  60           H        ARG  60 329.095   7.689  -6.212
 1131    HA   ARG  60           HA       ARG  60 329.489   6.070  -8.577
 1132    HB2  ARG  60           HB2      ARG  60 331.622   7.494  -8.108
 1133    HB3  ARG  60           HB3      ARG  60 331.842   6.389  -6.757
 1134    HG2  ARG  60           HG2      ARG  60 331.376   4.628  -8.727
 1135    HG3  ARG  60           HG3      ARG  60 332.113   5.927  -9.654
 1136    HD2  ARG  60           HD2      ARG  60 333.426   3.937  -8.278
 1137    HD3  ARG  60           HD3      ARG  60 334.134   5.422  -8.901
 1138    HE   ARG  60           HE       ARG  60 333.726   6.387  -6.661
 1139   HH11  ARG  60          HH11      ARG  60 333.915   2.910  -7.006
 1140   HH12  ARG  60          HH12      ARG  60 334.364   2.653  -5.356
 1141   HH21  ARG  60          HH21      ARG  60 334.320   6.037  -4.497
 1142   HH22  ARG  60          HH22      ARG  60 334.594   4.422  -3.934
 1143    H    PHE  61           H        PHE  61 329.037   3.979  -8.086
 1144    HA   PHE  61           HA       PHE  61 328.657   3.371  -5.265
 1145    HB2  PHE  61           HB2      PHE  61 326.731   2.810  -6.554
 1146    HB3  PHE  61           HB3      PHE  61 327.692   1.982  -7.766
 1147    HD1  PHE  61           HD1      PHE  61 326.798   1.872  -4.183
 1148    HD2  PHE  61           HD2      PHE  61 328.008  -0.328  -7.609
 1149    HE1  PHE  61           HE1      PHE  61 326.491  -0.228  -2.942
 1150    HE2  PHE  61           HE2      PHE  61 327.695  -2.435  -6.381
 1151    HZ   PHE  61           HZ       PHE  61 326.935  -2.387  -4.039
 1152    H    ASP  62           H        ASP  62 329.489   1.380  -4.421
 1153    HA   ASP  62           HA       ASP  62 332.122   1.050  -4.521
 1154    HB2  ASP  62           HB2      ASP  62 330.317  -0.066  -3.093
 1155    HB3  ASP  62           HB3      ASP  62 330.429  -1.339  -4.286
 1156    H    GLY  63           H        GLY  63 332.770   1.345  -6.781
 1157    HA2  GLY  63           HA2      GLY  63 334.172  -0.048  -8.183
 1158    HA3  GLY  63           HA3      GLY  63 332.909  -1.265  -8.147
 1159    H    GLN  64           H        GLN  64 330.956   1.145  -8.576
 1160    HA   GLN  64           HA       GLN  64 331.582   1.630 -11.399
 1161    HB2  GLN  64           HB2      GLN  64 329.990   0.314 -12.179
 1162    HB3  GLN  64           HB3      GLN  64 329.730  -0.273 -10.544
 1163    HG2  GLN  64           HG2      GLN  64 328.355   2.148 -10.702
 1164    HG3  GLN  64           HG3      GLN  64 328.031   1.319 -12.206
 1165   HE21  GLN  64          HE21      GLN  64 326.976   1.746  -9.173
 1166   HE22  GLN  64          HE22      GLN  64 326.107   0.278  -8.921
 1167    HA   PRO  65           HA       PRO  65 329.885   5.666 -10.630
 1168    HB2  PRO  65           HB2      PRO  65 329.599   6.010 -13.485
 1169    HB3  PRO  65           HB3      PRO  65 330.880   6.642 -12.451
 1170    HG2  PRO  65           HG2      PRO  65 331.305   4.775 -14.362
 1171    HG3  PRO  65           HG3      PRO  65 332.227   4.803 -12.843
 1172    HD2  PRO  65           HD2      PRO  65 329.772   3.188 -13.511
 1173    HD3  PRO  65           HD3      PRO  65 331.313   2.639 -12.857
 1174    H    ILE  66           H        ILE  66 327.805   6.215 -10.113
 1175    HA   ILE  66           HA       ILE  66 325.686   4.970 -11.695
 1176    HB   ILE  66           HB       ILE  66 324.267   5.095  -9.906
 1177   HG12  ILE  66          HG12      ILE  66 326.232   7.048  -8.866
 1178   HG13  ILE  66          HG13      ILE  66 324.484   7.029  -8.750
 1179   HG21  ILE  66          HG21      ILE  66 326.228   3.401 -10.026
 1180   HG22  ILE  66          HG22      ILE  66 325.272   3.492  -8.539
 1181   HG23  ILE  66          HG23      ILE  66 326.847   4.279  -8.623
 1182   HD11  ILE  66          HD11      ILE  66 326.500   6.037  -6.899
 1183   HD12  ILE  66          HD12      ILE  66 325.149   4.937  -7.152
 1184   HD13  ILE  66          HD13      ILE  66 324.853   6.586  -6.598
 1185    H    ASN  67           H        ASN  67 325.947   6.442 -13.207
 1186    HA   ASN  67           HA       ASN  67 325.708   9.165 -13.251
 1187    HB2  ASN  67           HB2      ASN  67 324.344   7.524 -15.342
 1188    HB3  ASN  67           HB3      ASN  67 325.166   9.064 -15.543
 1189   HD21  ASN  67          HD21      ASN  67 325.411   5.902 -16.196
 1190   HD22  ASN  67          HD22      ASN  67 327.129   5.728 -16.259
 1191    H    GLU  68           H        GLU  68 324.089   9.035 -11.344
 1192    HA   GLU  68           HA       GLU  68 322.078   9.535 -10.438
 1193    HB2  GLU  68           HB2      GLU  68 322.143  11.692 -10.873
 1194    HB3  GLU  68           HB3      GLU  68 322.816  11.400 -12.471
 1195    HG2  GLU  68           HG2      GLU  68 320.343  10.756 -12.987
 1196    HG3  GLU  68           HG3      GLU  68 320.017  11.818 -11.638
 1197    H    THR  69           H        THR  69 321.782   7.975 -13.448
 1198    HA   THR  69           HA       THR  69 318.883   7.795 -13.063
 1199    HB   THR  69           HB       THR  69 318.683   7.083 -15.341
 1200    HG1  THR  69           HG1      THR  69 321.512   7.244 -15.500
 1201   HG21  THR  69          HG21      THR  69 320.651   9.238 -15.764
 1202   HG22  THR  69          HG22      THR  69 319.289   9.586 -14.698
 1203   HG23  THR  69          HG23      THR  69 318.998   9.066 -16.359
 1204    H    ASP  70           H        ASP  70 321.797   6.144 -12.669
 1205    HA   ASP  70           HA       ASP  70 320.936   3.472 -13.040
 1206    HB2  ASP  70           HB2      ASP  70 323.085   4.452 -11.171
 1207    HB3  ASP  70           HB3      ASP  70 322.990   2.899 -11.946
 1208    H    THR  71           H        THR  71 319.398   2.533 -11.809
 1209    HA   THR  71           HA       THR  71 318.848   3.597  -9.160
 1210    HB   THR  71           HB       THR  71 316.866   2.404  -9.191
 1211    HG1  THR  71           HG1      THR  71 316.585   0.539 -10.553
 1212   HG21  THR  71          HG21      THR  71 316.625   2.164 -12.014
 1213   HG22  THR  71          HG22      THR  71 317.507   3.647 -11.643
 1214   HG23  THR  71          HG23      THR  71 315.913   3.369 -10.940
 1215    HA   PRO  72           HA       PRO  72 321.484   0.905  -6.972
 1216    HB2  PRO  72           HB2      PRO  72 319.271   0.080  -5.203
 1217    HB3  PRO  72           HB3      PRO  72 320.812   0.862  -4.827
 1218    HG2  PRO  72           HG2      PRO  72 318.358   2.139  -4.863
 1219    HG3  PRO  72           HG3      PRO  72 319.936   2.932  -4.963
 1220    HD2  PRO  72           HD2      PRO  72 317.892   2.610  -7.005
 1221    HD3  PRO  72           HD3      PRO  72 319.330   3.645  -7.005
 1222    H    ALA  73           H        ALA  73 318.201  -0.480  -7.345
 1223    HA   ALA  73           HA       ALA  73 318.802  -3.166  -7.418
 1224    HB1  ALA  73           HB1      ALA  73 316.591  -3.144  -7.765
 1225    HB2  ALA  73           HB2      ALA  73 316.947  -2.883  -9.473
 1226    HB3  ALA  73           HB3      ALA  73 316.650  -1.507  -8.417
 1227    H    GLN  74           H        GLN  74 318.574  -1.066 -10.255
 1228    HA   GLN  74           HA       GLN  74 319.339  -2.710 -12.228
 1229    HB2  GLN  74           HB2      GLN  74 319.294   0.079 -11.750
 1230    HB3  GLN  74           HB3      GLN  74 320.628  -0.316 -12.792
 1231    HG2  GLN  74           HG2      GLN  74 317.754  -1.040 -13.240
 1232    HG3  GLN  74           HG3      GLN  74 318.648   0.241 -14.059
 1233   HE21  GLN  74          HE21      GLN  74 319.547  -0.244 -15.931
 1234   HE22  GLN  74          HE22      GLN  74 319.876  -1.835 -16.517
 1235    H    LEU  75           H        LEU  75 321.470  -1.124  -9.904
 1236    HA   LEU  75           HA       LEU  75 323.821  -2.230 -11.182
 1237    HB2  LEU  75           HB2      LEU  75 323.773  -0.625  -8.645
 1238    HB3  LEU  75           HB3      LEU  75 325.042  -0.720  -9.855
 1239    HG   LEU  75           HG       LEU  75 322.427   0.783 -10.035
 1240   HD11  LEU  75          HD11      LEU  75 324.638   1.673  -8.972
 1241   HD12  LEU  75          HD12      LEU  75 323.658   2.695 -10.023
 1242   HD13  LEU  75          HD13      LEU  75 325.101   1.905 -10.657
 1243   HD21  LEU  75          HD21      LEU  75 323.947   1.261 -12.347
 1244   HD22  LEU  75          HD22      LEU  75 322.374   0.471 -12.226
 1245   HD23  LEU  75          HD23      LEU  75 323.852  -0.491 -12.168
 1246    H    GLU  76           H        GLU  76 321.695  -2.787  -8.529
 1247    HA   GLU  76           HA       GLU  76 321.387  -4.707  -7.387
 1248    HB2  GLU  76           HB2      GLU  76 324.219  -5.489  -8.062
 1249    HB3  GLU  76           HB3      GLU  76 323.003  -6.508  -7.306
 1250    HG2  GLU  76           HG2      GLU  76 321.641  -5.855  -9.479
 1251    HG3  GLU  76           HG3      GLU  76 323.271  -5.655 -10.126
 1252    H    MET  77           H        MET  77 322.248  -2.212  -6.338
 1253    HA   MET  77           HA       MET  77 324.186  -2.453  -4.300
 1254    HB2  MET  77           HB2      MET  77 321.729  -0.716  -4.525
 1255    HB3  MET  77           HB3      MET  77 322.973  -0.498  -3.295
 1256    HG2  MET  77           HG2      MET  77 324.502  -0.544  -5.500
 1257    HG3  MET  77           HG3      MET  77 323.015   0.104  -6.183
 1258    HE1  MET  77           HE1      MET  77 324.338   3.541  -5.980
 1259    HE2  MET  77           HE2      MET  77 322.911   2.623  -6.481
 1260    HE3  MET  77           HE3      MET  77 324.530   2.057  -6.917
 1261    H    GLU  78           H        GLU  78 323.334  -2.112  -1.855
 1262    HA   GLU  78           HA       GLU  78 321.069  -3.812  -1.271
 1263    HB2  GLU  78           HB2      GLU  78 323.896  -4.632  -0.847
 1264    HB3  GLU  78           HB3      GLU  78 322.752  -4.998   0.436
 1265    HG2  GLU  78           HG2      GLU  78 321.848  -6.672  -0.707
 1266    HG3  GLU  78           HG3      GLU  78 321.739  -5.716  -2.185
 1267    H    ASP  79           H        ASP  79 321.009  -4.068   1.256
 1268    HA   ASP  79           HA       ASP  79 320.648  -1.505   2.317
 1269    HB2  ASP  79           HB2      ASP  79 320.237  -4.225   3.150
 1270    HB3  ASP  79           HB3      ASP  79 320.910  -3.290   4.485
 1271    H    GLU  80           H        GLU  80 321.964  -0.103   3.199
 1272    HA   GLU  80           HA       GLU  80 323.697   0.819   4.354
 1273    HB2  GLU  80           HB2      GLU  80 324.908  -1.887   4.788
 1274    HB3  GLU  80           HB3      GLU  80 325.109  -0.428   5.742
 1275    HG2  GLU  80           HG2      GLU  80 322.712  -0.571   6.377
 1276    HG3  GLU  80           HG3      GLU  80 322.637  -2.120   5.546
 1277    H    ASP  81           H        ASP  81 323.811  -0.437   1.409
 1278    HA   ASP  81           HA       ASP  81 326.580  -0.674   0.915
 1279    HB2  ASP  81           HB2      ASP  81 324.155  -0.539  -0.705
 1280    HB3  ASP  81           HB3      ASP  81 325.500   0.281  -1.466
 1281    H    THR  82           H        THR  82 327.678   0.979  -0.535
 1282    HA   THR  82           HA       THR  82 327.057   3.683   0.492
 1283    HB   THR  82           HB       THR  82 329.853   2.762  -0.149
 1284    HG1  THR  82           HG1      THR  82 330.065   2.502   2.122
 1285   HG21  THR  82          HG21      THR  82 329.562   5.165  -0.083
 1286   HG22  THR  82          HG22      THR  82 330.463   4.619   1.338
 1287   HG23  THR  82          HG23      THR  82 328.753   5.034   1.485
 1288    H    ILE  83           H        ILE  83 327.826   5.492  -0.856
 1289    HA   ILE  83           HA       ILE  83 328.383   4.895  -3.650
 1290    HB   ILE  83           HB       ILE  83 326.039   6.501  -2.631
 1291   HG12  ILE  83          HG12      ILE  83 326.160   4.357  -4.757
 1292   HG13  ILE  83          HG13      ILE  83 325.798   4.036  -3.063
 1293   HG21  ILE  83          HG21      ILE  83 325.691   7.149  -5.048
 1294   HG22  ILE  83          HG22      ILE  83 327.315   6.548  -5.371
 1295   HG23  ILE  83          HG23      ILE  83 327.082   7.908  -4.276
 1296   HD11  ILE  83          HD11      ILE  83 323.744   4.149  -4.202
 1297   HD12  ILE  83          HD12      ILE  83 324.193   5.646  -5.016
 1298   HD13  ILE  83          HD13      ILE  83 323.891   5.642  -3.278
 1299    H    ASP  84           H        ASP  84 330.359   5.866  -3.631
 1300    HA   ASP  84           HA       ASP  84 331.001   8.066  -2.036
 1301    HB2  ASP  84           HB2      ASP  84 332.337   6.308  -3.851
 1302    HB3  ASP  84           HB3      ASP  84 332.875   7.965  -4.098
 1303    H    VAL  85           H        VAL  85 330.657  10.060  -2.196
 1304    HA   VAL  85           HA       VAL  85 329.979  11.405  -4.741
 1305    HB   VAL  85           HB       VAL  85 329.698  12.336  -1.878
 1306   HG11  VAL  85          HG11      VAL  85 328.408  14.261  -2.912
 1307   HG12  VAL  85          HG12      VAL  85 329.141  13.784  -4.449
 1308   HG13  VAL  85          HG13      VAL  85 330.164  14.298  -3.109
 1309   HG21  VAL  85          HG21      VAL  85 328.007  10.777  -3.487
 1310   HG22  VAL  85          HG22      VAL  85 327.270  12.373  -3.320
 1311   HG23  VAL  85          HG23      VAL  85 327.707  11.446  -1.883
 1312    H    PHE  86           H        PHE  86 331.485  12.830  -5.625
 1313    HA   PHE  86           HA       PHE  86 333.549  13.896  -3.894
 1314    HB2  PHE  86           HB2      PHE  86 334.060  11.930  -6.077
 1315    HB3  PHE  86           HB3      PHE  86 335.161  13.298  -5.930
 1316    HD1  PHE  86           HD2      PHE  86 335.777  13.747  -3.301
 1317    HD2  PHE  86           HD1      PHE  86 334.792  10.008  -5.079
 1318    HE1  PHE  86           HE2      PHE  86 336.999  12.580  -1.513
 1319    HE2  PHE  86           HE1      PHE  86 336.012   8.834  -3.293
 1320    HZ   PHE  86           HZ       PHE  86 337.118  10.120  -1.508
 1321    H    GLN  87           H        GLN  87 333.091  15.888  -4.207
 1322    HA   GLN  87           HA       GLN  87 333.218  16.973  -6.913
 1323    HB2  GLN  87           HB2      GLN  87 330.832  16.365  -6.089
 1324    HB3  GLN  87           HB3      GLN  87 330.944  17.844  -5.161
 1325    HG2  GLN  87           HG2      GLN  87 331.756  18.271  -7.899
 1326    HG3  GLN  87           HG3      GLN  87 330.172  17.536  -7.804
 1327   HE21  GLN  87          HE21      GLN  87 328.847  18.564  -5.812
 1328   HE22  GLN  87          HE22      GLN  87 328.773  20.288  -5.896
 1329    H    GLN  88           H        GLN  88 334.771  18.447  -6.820
 1330    HA   GLN  88           HA       GLN  88 335.399  19.843  -4.383
 1331    HB2  GLN  88           HB2      GLN  88 336.538  20.307  -7.133
 1332    HB3  GLN  88           HB3      GLN  88 337.241  20.799  -5.601
 1333    HG2  GLN  88           HG2      GLN  88 336.746  17.942  -5.734
 1334    HG3  GLN  88           HG3      GLN  88 337.825  18.508  -7.008
 1335   HE21  GLN  88          HE21      GLN  88 338.145  16.934  -4.418
 1336   HE22  GLN  88          HE22      GLN  88 339.485  17.696  -3.639
 1337    H    GLN  89           H        GLN  89 335.523  22.155  -4.197
 1338    HA   GLN  89           HA       GLN  89 333.630  23.600  -5.928
 1339    HB2  GLN  89           HB2      GLN  89 333.699  23.363  -2.964
 1340    HB3  GLN  89           HB3      GLN  89 333.299  24.939  -3.633
 1341    HG2  GLN  89           HG2      GLN  89 331.595  23.615  -5.068
 1342    HG3  GLN  89           HG3      GLN  89 331.811  22.362  -3.847
 1343   HE21  GLN  89          HE21      GLN  89 331.556  25.903  -3.771
 1344   HE22  GLN  89          HE22      GLN  89 330.294  25.957  -2.593
 1345    H    THR  90           H        THR  90 334.189  25.692  -6.476
 1346    HA   THR  90           HA       THR  90 336.557  26.873  -5.251
 1347    HB   THR  90           HB       THR  90 337.759  27.145  -7.272
 1348    HG1  THR  90           HG1      THR  90 336.853  26.514  -9.284
 1349   HG21  THR  90          HG21      THR  90 337.940  24.867  -8.261
 1350   HG22  THR  90          HG22      THR  90 336.598  24.374  -7.228
 1351   HG23  THR  90          HG23      THR  90 338.111  24.924  -6.507
 1352    H1   THR   2           HT1      THR   2 289.328  -5.956  18.805
 1353    H2   THR   2           HT2      THR   2 289.773  -4.527  17.965
 1354    H3   THR   2           HT3      THR   2 290.907  -5.314  18.985
 1355    HA   THR   2           HA       THR   2 291.171  -5.637  16.548
 1356    HB   THR   2           HB       THR   2 290.770  -8.161  18.152
 1357    HG1  THR   2           HG1      THR   2 292.954  -6.369  18.363
 1358   HG21  THR   2          HG21      THR   2 292.757  -8.944  17.086
 1359   HG22  THR   2          HG22      THR   2 293.009  -7.383  16.304
 1360   HG23  THR   2          HG23      THR   2 291.635  -8.388  15.844
 1361    H    VAL   3           H        VAL   3 288.773  -4.942  15.979
 1362    HA   VAL   3           HA       VAL   3 287.668  -7.160  14.487
 1363    HB   VAL   3           HB       VAL   3 285.884  -5.689  16.432
 1364   HG11  VAL   3          HG11      VAL   3 285.405  -7.880  14.430
 1365   HG12  VAL   3          HG12      VAL   3 284.605  -6.313  14.555
 1366   HG13  VAL   3          HG13      VAL   3 284.299  -7.558  15.765
 1367   HG21  VAL   3          HG21      VAL   3 287.295  -7.147  17.704
 1368   HG22  VAL   3          HG22      VAL   3 287.037  -8.471  16.567
 1369   HG23  VAL   3          HG23      VAL   3 285.705  -7.900  17.573
 1370    H    GLY   4           H        GLY   4 287.162  -6.416  12.524
 1371    HA2  GLY   4           HA2      GLY   4 285.749  -3.946  12.152
 1372    HA3  GLY   4           HA3      GLY   4 287.429  -3.832  11.655
 1373    H    ASP   5           H        ASP   5 285.687  -6.831  11.338
 1374    HA   ASP   5           HA       ASP   5 285.335  -8.134   9.494
 1375    HB2  ASP   5           HB2      ASP   5 283.672  -7.261   7.989
 1376    HB3  ASP   5           HB3      ASP   5 283.322  -6.660   9.605
 1377    H    GLU   6           H        GLU   6 285.163  -7.640   6.790
 1378    HA   GLU   6           HA       GLU   6 287.914  -7.563   6.058
 1379    HB2  GLU   6           HB2      GLU   6 285.345  -7.740   4.500
 1380    HB3  GLU   6           HB3      GLU   6 286.900  -7.619   3.691
 1381    HG2  GLU   6           HG2      GLU   6 286.874  -9.850   3.769
 1382    HG3  GLU   6           HG3      GLU   6 287.373  -9.635   5.446
 1383    H    ILE   7           H        ILE   7 285.337  -5.652   4.531
 1384    HA   ILE   7           HA       ILE   7 285.142  -3.351   4.300
 1385    HB   ILE   7           HB       ILE   7 288.045  -3.037   5.058
 1386   HG12  ILE   7          HG12      ILE   7 286.007  -2.256   7.033
 1387   HG13  ILE   7          HG13      ILE   7 286.125  -3.992   6.775
 1388   HG21  ILE   7          HG21      ILE   7 285.736  -1.111   4.903
 1389   HG22  ILE   7          HG22      ILE   7 287.154  -1.161   3.856
 1390   HG23  ILE   7          HG23      ILE   7 287.327  -0.720   5.554
 1391   HD11  ILE   7          HD11      ILE   7 288.640  -2.476   7.198
 1392   HD12  ILE   7          HD12      ILE   7 288.214  -4.120   7.673
 1393   HD13  ILE   7          HD13      ILE   7 287.583  -2.748   8.583
 1394    H    VAL   8           H        VAL   8 288.293  -4.695   3.291
 1395    HA   VAL   8           HA       VAL   8 288.488  -3.066   0.972
 1396    HB   VAL   8           HB       VAL   8 289.893  -5.692   1.440
 1397   HG11  VAL   8          HG11      VAL   8 291.670  -4.540   0.072
 1398   HG12  VAL   8          HG12      VAL   8 290.469  -3.302  -0.296
 1399   HG13  VAL   8          HG13      VAL   8 290.197  -4.970  -0.798
 1400   HG21  VAL   8          HG21      VAL   8 290.633  -4.655   3.308
 1401   HG22  VAL   8          HG22      VAL   8 290.233  -3.047   2.705
 1402   HG23  VAL   8          HG23      VAL   8 291.708  -3.848   2.167
 1403    H    ASP   9           H        ASP   9 288.396  -3.686  -1.228
 1404    HA   ASP   9           HA       ASP   9 287.634  -6.052  -2.365
 1405    HB2  ASP   9           HB2      ASP   9 285.593  -6.051  -1.051
 1406    HB3  ASP   9           HB3      ASP   9 285.207  -4.418  -1.583
 1407    H    LEU  10           H        LEU  10 289.159  -4.845  -3.742
 1408    HA   LEU  10           HA       LEU  10 287.955  -3.807  -6.056
 1409    HB2  LEU  10           HB2      LEU  10 288.593  -1.460  -5.941
 1410    HB3  LEU  10           HB3      LEU  10 287.471  -1.861  -4.654
 1411    HG   LEU  10           HG       LEU  10 290.404  -1.915  -4.085
 1412   HD11  LEU  10          HD11      LEU  10 288.819   0.457  -4.787
 1413   HD12  LEU  10          HD12      LEU  10 290.565   0.209  -4.796
 1414   HD13  LEU  10          HD13      LEU  10 289.735   0.577  -3.285
 1415   HD21  LEU  10          HD21      LEU  10 288.953  -0.742  -2.014
 1416   HD22  LEU  10          HD22      LEU  10 289.575  -2.391  -2.078
 1417   HD23  LEU  10          HD23      LEU  10 287.928  -2.048  -2.607
 1418    H    THR  11           H        THR  11 289.467  -3.531  -7.752
 1419    HA   THR  11           HA       THR  11 292.298  -3.886  -7.021
 1420    HB   THR  11           HB       THR  11 290.789  -5.873  -8.188
 1421    HG1  THR  11           HG1      THR  11 292.573  -6.878  -7.855
 1422   HG21  THR  11          HG21      THR  11 291.244  -6.176 -10.416
 1423   HG22  THR  11          HG22      THR  11 292.559  -5.000 -10.410
 1424   HG23  THR  11          HG23      THR  11 290.885  -4.450 -10.334
 1425    H    CYS  12           H        CYS  12 293.626  -3.669  -9.245
 1426    HA   CYS  12           HA       CYS  12 294.325  -2.330 -10.953
 1427    HB2  CYS  12           HB2      CYS  12 291.536  -2.185 -11.184
 1428    HB3  CYS  12           HB3      CYS  12 292.084  -0.512 -11.206
 1429    HG   CYS  12           HG       CYS  12 293.433  -2.454 -13.190
 1430    H    GLU  13           H        GLU  13 295.261  -0.261 -11.204
 1431    HA   GLU  13           HA       GLU  13 296.080   1.766 -10.555
 1432    HB2  GLU  13           HB2      GLU  13 293.518   2.028  -9.870
 1433    HB3  GLU  13           HB3      GLU  13 294.208   2.019  -8.253
 1434    HG2  GLU  13           HG2      GLU  13 295.561   3.926  -8.747
 1435    HG3  GLU  13           HG3      GLU  13 295.094   3.875 -10.447
 1436    H    SER  14           H        SER  14 297.913   2.047  -9.471
 1437    HA   SER  14           HA       SER  14 298.485   0.312  -7.204
 1438    HB2  SER  14           HB2      SER  14 300.793   0.893  -7.534
 1439    HB3  SER  14           HB3      SER  14 300.096   0.592  -9.125
 1440    HG   SER  14           HG       SER  14 299.842   2.888  -9.316
 1441    H    LEU  15           H        LEU  15 298.360   3.759  -7.985
 1442    HA   LEU  15           HA       LEU  15 298.041   5.595  -6.678
 1443    HB2  LEU  15           HB2      LEU  15 296.566   3.707  -5.441
 1444    HB3  LEU  15           HB3      LEU  15 297.711   4.072  -4.164
 1445    HG   LEU  15           HG       LEU  15 297.055   6.542  -4.576
 1446   HD11  LEU  15          HD11      LEU  15 294.466   6.367  -5.240
 1447   HD12  LEU  15          HD12      LEU  15 295.116   5.075  -6.249
 1448   HD13  LEU  15          HD13      LEU  15 295.743   6.716  -6.405
 1449   HD21  LEU  15          HD21      LEU  15 294.734   5.122  -3.443
 1450   HD22  LEU  15          HD22      LEU  15 295.745   6.388  -2.746
 1451   HD23  LEU  15          HD23      LEU  15 296.303   4.715  -2.749
 1452    H    GLU  16           H        GLU  16 299.587   6.913  -6.009
 1453    HA   GLU  16           HA       GLU  16 301.502   7.713  -5.092
 1454    HB2  GLU  16           HB2      GLU  16 300.525   5.735  -3.158
 1455    HB3  GLU  16           HB3      GLU  16 302.249   6.059  -3.037
 1456    HG2  GLU  16           HG2      GLU  16 300.394   8.371  -3.211
 1457    HG3  GLU  16           HG3      GLU  16 300.473   7.466  -1.699
 1458    HA   PRO  17           HA       PRO  17 304.410   5.084  -7.309
 1459    HB2  PRO  17           HB2      PRO  17 306.281   6.972  -7.743
 1460    HB3  PRO  17           HB3      PRO  17 304.769   6.925  -8.657
 1461    HG2  PRO  17           HG2      PRO  17 305.520   8.639  -6.322
 1462    HG3  PRO  17           HG3      PRO  17 304.663   9.086  -7.808
 1463    HD2  PRO  17           HD2      PRO  17 303.406   8.586  -5.435
 1464    HD3  PRO  17           HD3      PRO  17 302.647   8.328  -7.018
 1465    H    VAL  18           H        VAL  18 307.109   5.335  -7.104
 1466    HA   VAL  18           HA       VAL  18 307.660   5.076  -4.220
 1467    HB   VAL  18           HB       VAL  18 309.323   3.292  -4.833
 1468   HG11  VAL  18          HG11      VAL  18 307.394   1.591  -5.375
 1469   HG12  VAL  18          HG12      VAL  18 306.369   2.988  -5.048
 1470   HG13  VAL  18          HG13      VAL  18 307.478   2.400  -3.810
 1471   HG21  VAL  18          HG21      VAL  18 307.921   2.568  -7.282
 1472   HG22  VAL  18          HG22      VAL  18 309.650   2.612  -6.937
 1473   HG23  VAL  18          HG23      VAL  18 308.808   4.086  -7.418
 1474    H    VAL  19           H        VAL  19 308.625   7.086  -4.021
 1475    HA   VAL  19           HA       VAL  19 310.728   7.922  -5.810
 1476    HB   VAL  19           HB       VAL  19 309.995   9.131  -3.141
 1477   HG11  VAL  19          HG11      VAL  19 311.231  10.972  -3.736
 1478   HG12  VAL  19          HG12      VAL  19 311.085  10.648  -5.464
 1479   HG13  VAL  19          HG13      VAL  19 312.182   9.684  -4.475
 1480   HG21  VAL  19          HG21      VAL  19 308.979  10.565  -5.425
 1481   HG22  VAL  19          HG22      VAL  19 308.126   9.979  -3.997
 1482   HG23  VAL  19          HG23      VAL  19 308.347   8.919  -5.389
 1483    H    VAL  20           H        VAL  20 310.492   6.839  -2.450
 1484    HA   VAL  20           HA       VAL  20 312.063   6.217  -0.925
 1485    HB   VAL  20           HB       VAL  20 313.501   4.382  -1.659
 1486   HG11  VAL  20          HG11      VAL  20 311.764   2.878  -2.273
 1487   HG12  VAL  20          HG12      VAL  20 310.804   4.177  -2.978
 1488   HG13  VAL  20          HG13      VAL  20 311.049   4.108  -1.233
 1489   HG21  VAL  20          HG21      VAL  20 314.151   5.306  -3.873
 1490   HG22  VAL  20          HG22      VAL  20 312.527   4.964  -4.458
 1491   HG23  VAL  20          HG23      VAL  20 313.584   3.636  -3.965
 1492    H    ASP  21           H        ASP  21 313.316   7.781  -0.118
 1493    HA   ASP  21           HA       ASP  21 315.801   8.417  -1.567
 1494    HB2  ASP  21           HB2      ASP  21 315.617  10.688  -0.328
 1495    HB3  ASP  21           HB3      ASP  21 314.631  10.426  -1.764
 1496    H    LEU  22           H        LEU  22 314.338   8.764   1.684
 1497    HA   LEU  22           HA       LEU  22 316.194   7.121   2.969
 1498    HB2  LEU  22           HB2      LEU  22 317.838   8.808   2.418
 1499    HB3  LEU  22           HB3      LEU  22 316.829  10.066   3.096
 1500    HG   LEU  22           HG       LEU  22 318.899   9.162   4.413
 1501   HD11  LEU  22          HD11      LEU  22 317.374   9.415   6.569
 1502   HD12  LEU  22          HD12      LEU  22 316.243  10.028   5.366
 1503   HD13  LEU  22          HD13      LEU  22 317.823  10.781   5.550
 1504   HD21  LEU  22          HD21      LEU  22 318.832   7.059   5.120
 1505   HD22  LEU  22          HD22      LEU  22 317.230   6.840   4.425
 1506   HD23  LEU  22          HD23      LEU  22 317.397   7.442   6.069
 1507    H    THR  23           H        THR  23 314.661  10.269   3.667
 1508    HA   THR  23           HA       THR  23 313.278  10.936   5.349
 1509    HB   THR  23           HB       THR  23 311.354   9.564   5.754
 1510    HG1  THR  23           HG1      THR  23 311.354   7.362   5.105
 1511   HG21  THR  23          HG21      THR  23 311.611  10.445   3.429
 1512   HG22  THR  23          HG22      THR  23 310.574   9.027   3.585
 1513   HG23  THR  23          HG23      THR  23 312.216   8.855   2.967
 1514    H    HIS  24           H        HIS  24 312.399  10.273   7.628
 1515    HA   HIS  24           HA       HIS  24 312.955   9.911   9.808
 1516    HB2  HIS  24           HB2      HIS  24 314.290   7.443   8.676
 1517    HB3  HIS  24           HB3      HIS  24 313.819   7.689  10.355
 1518    HD1  HIS  24           HD1      HIS  24 312.189   7.455   6.931
 1519    HD2  HIS  24           HD2      HIS  24 311.320   6.805  10.942
 1520    HE1  HIS  24           HE1      HIS  24 309.895   6.425   6.964
 1521    HE2  HIS  24           HE2      HIS  24 309.431   5.954   9.395
 1522    H    ASN  25           H        ASN  25 315.075   8.953  11.161
 1523    HA   ASN  25           HA       ASN  25 317.040  10.997  10.751
 1524    HB2  ASN  25           HB2      ASN  25 316.163   9.616  12.939
 1525    HB3  ASN  25           HB3      ASN  25 317.701   8.819  12.623
 1526   HD21  ASN  25          HD21      ASN  25 316.139  11.814  13.456
 1527   HD22  ASN  25          HD22      ASN  25 317.556  12.629  14.015
 1528    H    ASP  26           H        ASP  26 319.237  10.739  10.260
 1529    HA   ASP  26           HA       ASP  26 319.794   8.454   8.540
 1530    HB2  ASP  26           HB2      ASP  26 321.152  11.109   8.974
 1531    HB3  ASP  26           HB3      ASP  26 321.915   9.820   8.048
  Start of MODEL    8
    1    H1   GLY   1           HT1      GLY   1 293.769 -11.804 -14.724
    2    H2   GLY   1           HT2      GLY   1 292.264 -11.878 -15.492
    3    H3   GLY   1           HT3      GLY   1 293.629 -11.380 -16.356
    4    HA2  GLY   1           HA3      GLY   1 293.820 -13.468 -17.054
    5    HA3  GLY   1           HA2      GLY   1 294.384 -13.810 -15.426
    6    H    THR   2           H        THR   2 292.859 -14.590 -13.863
    7    HA   THR   2           HA       THR   2 290.347 -15.598 -14.987
    8    HB   THR   2           HB       THR   2 291.538 -17.567 -15.171
    9    HG1  THR   2           HG1      THR   2 290.787 -17.746 -12.452
   10   HG21  THR   2          HG21      THR   2 292.876 -17.651 -12.565
   11   HG22  THR   2          HG22      THR   2 293.503 -16.452 -13.694
   12   HG23  THR   2          HG23      THR   2 293.443 -18.151 -14.157
   13    H    GLU   3           H        GLU   3 292.053 -15.974 -11.864
   14    HA   GLU   3           HA       GLU   3 289.625 -15.378 -10.444
   15    HB2  GLU   3           HB2      GLU   3 291.659 -17.004  -9.905
   16    HB3  GLU   3           HB3      GLU   3 292.171 -15.598  -8.986
   17    HG2  GLU   3           HG2      GLU   3 290.930 -16.559  -7.377
   18    HG3  GLU   3           HG3      GLU   3 289.610 -15.743  -8.208
   19    H    ASN   4           H        ASN   4 289.192 -13.251 -10.995
   20    HA   ASN   4           HA       ASN   4 291.031 -11.268  -9.832
   21    HB2  ASN   4           HB2      ASN   4 289.738 -11.364 -12.381
   22    HB3  ASN   4           HB3      ASN   4 289.104  -9.996 -11.475
   23   HD21  ASN   4          HD21      ASN   4 290.468  -8.314 -10.893
   24   HD22  ASN   4          HD22      ASN   4 292.015  -8.097 -11.632
   25    H    ASP   5           H        ASP   5 288.709 -12.906  -8.651
   26    HA   ASP   5           HA       ASP   5 286.869 -10.777  -7.871
   27    HB2  ASP   5           HB2      ASP   5 286.676 -13.608  -8.132
   28    HB3  ASP   5           HB3      ASP   5 286.432 -13.224  -6.432
   29    H    HIS   6           H        HIS   6 286.432 -11.782  -5.162
   30    HA   HIS   6           HA       HIS   6 289.065 -11.117  -4.044
   31    HB2  HIS   6           HB2      HIS   6 287.885 -10.290  -1.963
   32    HB3  HIS   6           HB3      HIS   6 287.815  -9.262  -3.370
   33    HD1  HIS   6           HD1      HIS   6 285.287 -10.607  -4.710
   34    HD2  HIS   6           HD2      HIS   6 285.733  -9.408  -0.763
   35    HE1  HIS   6           HE1      HIS   6 282.944 -10.257  -3.861
   36    HE2  HIS   6           HE2      HIS   6 283.238  -9.412  -1.502
   37    H    ILE   7           H        ILE   7 289.662 -11.990  -2.075
   38    HA   ILE   7           HA       ILE   7 288.299 -14.473  -1.351
   39    HB   ILE   7           HB       ILE   7 290.275 -15.730  -1.389
   40   HG12  ILE   7          HG12      ILE   7 291.759 -13.112  -1.568
   41   HG13  ILE   7          HG13      ILE   7 291.775 -14.243  -0.220
   42   HG21  ILE   7          HG21      ILE   7 291.007 -14.045  -3.719
   43   HG22  ILE   7          HG22      ILE   7 289.385 -14.744  -3.672
   44   HG23  ILE   7          HG23      ILE   7 290.798 -15.795  -3.601
   45   HD11  ILE   7          HD11      ILE   7 293.300 -14.253  -2.717
   46   HD12  ILE   7          HD12      ILE   7 292.640 -15.817  -2.241
   47   HD13  ILE   7          HD13      ILE   7 293.692 -14.930  -1.134
   48    H    ASN   8           H        ASN   8 288.701 -15.041   0.907
   49    HA   ASN   8           HA       ASN   8 288.980 -12.632   2.465
   50    HB2  ASN   8           HB2      ASN   8 288.612 -15.436   3.515
   51    HB3  ASN   8           HB3      ASN   8 288.224 -13.929   4.328
   52   HD21  ASN   8          HD21      ASN   8 287.240 -16.261   1.987
   53   HD22  ASN   8          HD22      ASN   8 285.646 -15.645   1.730
   54    H    LEU   9           H        LEU   9 290.776 -12.073   3.748
   55    HA   LEU   9           HA       LEU   9 292.968 -14.019   3.841
   56    HB2  LEU   9           HB2      LEU   9 292.960 -11.128   3.252
   57    HB3  LEU   9           HB3      LEU   9 294.222 -11.675   4.241
   58    HG   LEU   9           HG       LEU   9 295.383 -12.382   2.471
   59   HD11  LEU   9          HD11      LEU   9 294.548 -14.095   0.928
   60   HD12  LEU   9          HD12      LEU   9 292.930 -13.916   1.608
   61   HD13  LEU   9          HD13      LEU   9 294.245 -14.530   2.610
   62   HD21  LEU   9          HD21      LEU   9 293.106 -10.977   1.256
   63   HD22  LEU   9          HD22      LEU   9 294.061 -11.990   0.174
   64   HD23  LEU   9          HD23      LEU   9 294.840 -10.694   1.088
   65    H    LYS  10           H        LYS  10 293.968 -14.342   5.758
   66    HA   LYS  10           HA       LYS  10 292.714 -13.065   8.088
   67    HB2  LYS  10           HB2      LYS  10 294.090 -15.623   7.555
   68    HB3  LYS  10           HB3      LYS  10 294.252 -14.982   9.145
   69    HG2  LYS  10           HG2      LYS  10 292.001 -15.262   9.614
   70    HG3  LYS  10           HG3      LYS  10 291.555 -15.269   7.903
   71    HD2  LYS  10           HD2      LYS  10 291.367 -17.509   8.667
   72    HD3  LYS  10           HD3      LYS  10 292.830 -17.416   7.684
   73    HE2  LYS  10           HE2      LYS  10 293.655 -18.560   9.479
   74    HE3  LYS  10           HE3      LYS  10 293.944 -16.908  10.027
   75    HZ1  LYS  10           HZ1      LYS  10 291.899 -17.001  11.297
   76    HZ2  LYS  10           HZ2      LYS  10 292.923 -18.269  11.750
   77    HZ3  LYS  10           HZ3      LYS  10 291.592 -18.574  10.752
   78    H    VAL  11           H        VAL  11 293.921 -11.227   8.615
   79    HA   VAL  11           HA       VAL  11 296.794 -11.421   8.237
   80    HB   VAL  11           HB       VAL  11 296.015  -9.347   7.461
   81   HG11  VAL  11          HG11      VAL  11 294.844  -8.317   9.942
   82   HG12  VAL  11          HG12      VAL  11 293.919  -9.588   9.145
   83   HG13  VAL  11          HG13      VAL  11 294.343  -8.121   8.263
   84   HG21  VAL  11          HG21      VAL  11 297.714  -9.438   9.742
   85   HG22  VAL  11          HG22      VAL  11 296.827  -7.912   9.706
   86   HG23  VAL  11          HG23      VAL  11 297.784  -8.418   8.309
   87    H    ALA  12           H        ALA  12 298.138 -11.875   9.832
   88    HA   ALA  12           HA       ALA  12 297.010 -12.139  12.543
   89    HB1  ALA  12           HB1      ALA  12 299.454 -13.560  12.368
   90    HB2  ALA  12           HB2      ALA  12 298.472 -13.970  10.960
   91    HB3  ALA  12           HB3      ALA  12 297.819 -14.193  12.585
   92    H    GLY  13           H        GLY  13 297.815 -11.025  14.201
   93    HA2  GLY  13           HA2      GLY  13 299.897  -9.098  13.659
   94    HA3  GLY  13           HA3      GLY  13 298.930  -9.211  15.119
   95    H    GLN  14           H        GLN  14 301.573 -10.723  13.348
   96    HA   GLN  14           HA       GLN  14 303.370 -11.892  14.009
   97    HB2  GLN  14           HB2      GLN  14 302.820 -10.084  16.323
   98    HB3  GLN  14           HB3      GLN  14 304.177 -11.182  16.287
   99    HG2  GLN  14           HG2      GLN  14 305.137 -10.099  14.413
  100    HG3  GLN  14           HG3      GLN  14 303.663  -9.165  14.141
  101   HE21  GLN  14          HE21      GLN  14 306.719  -9.108  15.438
  102   HE22  GLN  14          HE22      GLN  14 306.561  -7.719  16.453
  103    H    ASP  15           H        ASP  15 300.627 -12.856  14.623
  104    HA   ASP  15           HA       ASP  15 299.806 -14.886  15.275
  105    HB2  ASP  15           HB2      ASP  15 302.400 -15.072  16.752
  106    HB3  ASP  15           HB3      ASP  15 301.171 -16.322  16.829
  107    H    GLY  16           H        GLY  16 300.214 -12.183  17.010
  108    HA2  GLY  16           HA2      GLY  16 299.055 -13.245  19.447
  109    HA3  GLY  16           HA3      GLY  16 299.744 -11.645  19.269
  110    H    SER  17           H        SER  17 297.676 -12.830  16.772
  111    HA   SER  17           HA       SER  17 295.133 -12.475  17.276
  112    HB2  SER  17           HB2      SER  17 296.489  -9.871  17.698
  113    HB3  SER  17           HB3      SER  17 294.943  -9.831  16.854
  114    HG   SER  17           HG       SER  17 295.513 -10.455  19.497
  115    H    VAL  18           H        VAL  18 294.216 -12.870  15.289
  116    HA   VAL  18           HA       VAL  18 295.494 -11.599  12.949
  117    HB   VAL  18           HB       VAL  18 295.952 -13.744  12.392
  118   HG11  VAL  18          HG11      VAL  18 295.502 -15.054  14.164
  119   HG12  VAL  18          HG12      VAL  18 294.235 -15.638  13.085
  120   HG13  VAL  18          HG13      VAL  18 293.849 -14.460  14.339
  121   HG21  VAL  18          HG21      VAL  18 293.042 -13.660  11.618
  122   HG22  VAL  18          HG22      VAL  18 294.243 -14.773  10.967
  123   HG23  VAL  18          HG23      VAL  18 294.406 -13.040  10.689
  124    H    VAL  19           H        VAL  19 293.903 -11.327  11.057
  125    HA   VAL  19           HA       VAL  19 291.147 -10.919  11.982
  126    HB   VAL  19           HB       VAL  19 292.627  -8.856  10.411
  127   HG11  VAL  19          HG11      VAL  19 289.976  -8.719  11.820
  128   HG12  VAL  19          HG12      VAL  19 290.205  -8.919  10.083
  129   HG13  VAL  19          HG13      VAL  19 290.727  -7.436  10.877
  130   HG21  VAL  19          HG21      VAL  19 293.654  -8.792  12.531
  131   HG22  VAL  19          HG22      VAL  19 292.104  -8.932  13.354
  132   HG23  VAL  19          HG23      VAL  19 292.501  -7.455  12.465
  133    H    GLN  20           H        GLN  20 289.595 -11.021  10.349
  134    HA   GLN  20           HA       GLN  20 290.566 -12.184   7.862
  135    HB2  GLN  20           HB2      GLN  20 287.732 -11.918   8.875
  136    HB3  GLN  20           HB3      GLN  20 288.256 -12.857   7.479
  137    HG2  GLN  20           HG2      GLN  20 289.776 -13.600   9.772
  138    HG3  GLN  20           HG3      GLN  20 288.054 -13.694  10.149
  139   HE21  GLN  20          HE21      GLN  20 290.096 -15.779   9.816
  140   HE22  GLN  20          HE22      GLN  20 289.490 -16.841   8.600
  141    H    PHE  21           H        PHE  21 290.482 -11.229   5.957
  142    HA   PHE  21           HA       PHE  21 288.893  -8.815   5.560
  143    HB2  PHE  21           HB2      PHE  21 291.892  -8.922   5.184
  144    HB3  PHE  21           HB3      PHE  21 290.863  -7.668   4.510
  145    HD1  PHE  21           HD1      PHE  21 289.617  -6.155   6.064
  146    HD2  PHE  21           HD2      PHE  21 292.637  -8.828   7.397
  147    HE1  PHE  21           HE1      PHE  21 289.837  -4.856   8.138
  148    HE2  PHE  21           HE2      PHE  21 292.863  -7.518   9.471
  149    HZ   PHE  21           HZ       PHE  21 291.471  -5.551   9.840
  150    H    LYS  22           H        LYS  22 287.837  -9.140   3.689
  151    HA   LYS  22           HA       LYS  22 289.143 -10.846   1.708
  152    HB2  LYS  22           HB2      LYS  22 286.572 -10.961   2.500
  153    HB3  LYS  22           HB3      LYS  22 286.425  -9.892   1.114
  154    HG2  LYS  22           HG2      LYS  22 287.823 -11.631  -0.122
  155    HG3  LYS  22           HG3      LYS  22 287.382 -12.704   1.207
  156    HD2  LYS  22           HD2      LYS  22 285.092 -11.350   0.428
  157    HD3  LYS  22           HD3      LYS  22 285.849 -11.928  -1.056
  158    HE2  LYS  22           HE2      LYS  22 286.062 -14.137   0.366
  159    HE3  LYS  22           HE3      LYS  22 284.723 -13.413   1.255
  160    HZ1  LYS  22           HZ1      LYS  22 284.800 -14.150  -1.613
  161    HZ2  LYS  22           HZ2      LYS  22 283.587 -13.174  -0.951
  162    HZ3  LYS  22           HZ3      LYS  22 283.779 -14.766  -0.412
  163    H    ILE  23           H        ILE  23 289.731 -10.182  -0.206
  164    HA   ILE  23           HA       ILE  23 288.974  -7.573  -1.163
  165    HB   ILE  23           HB       ILE  23 290.705  -6.750   0.142
  166   HG12  ILE  23          HG12      ILE  23 291.655  -7.323  -2.614
  167   HG13  ILE  23          HG13      ILE  23 291.451  -5.791  -1.785
  168   HG21  ILE  23          HG21      ILE  23 292.258  -9.268  -0.428
  169   HG22  ILE  23          HG22      ILE  23 291.433  -8.842   1.073
  170   HG23  ILE  23          HG23      ILE  23 292.841  -7.922   0.550
  171   HD11  ILE  23          HD11      ILE  23 293.767  -7.673  -1.658
  172   HD12  ILE  23          HD12      ILE  23 293.510  -6.419  -0.442
  173   HD13  ILE  23          HD13      ILE  23 293.739  -5.975  -2.135
  174    H    LYS  24           H        LYS  24 289.170  -7.364  -3.289
  175    HA   LYS  24           HA       LYS  24 289.184  -9.599  -4.930
  176    HB2  LYS  24           HB2      LYS  24 289.596  -6.719  -5.591
  177    HB3  LYS  24           HB3      LYS  24 289.644  -7.961  -6.835
  178    HG2  LYS  24           HG2      LYS  24 287.343  -8.365  -5.183
  179    HG3  LYS  24           HG3      LYS  24 287.372  -6.704  -5.753
  180    HD2  LYS  24           HD2      LYS  24 287.617  -9.148  -7.488
  181    HD3  LYS  24           HD3      LYS  24 286.153  -8.188  -7.283
  182    HE2  LYS  24           HE2      LYS  24 287.201  -6.276  -8.278
  183    HE3  LYS  24           HE3      LYS  24 288.761  -7.100  -8.320
  184    HZ1  LYS  24           HZ1      LYS  24 288.224  -7.775 -10.349
  185    HZ2  LYS  24           HZ2      LYS  24 286.653  -7.163 -10.215
  186    HZ3  LYS  24           HZ3      LYS  24 286.997  -8.731  -9.682
  187    H    ARG  25           H        ARG  25 290.715 -10.700  -6.144
  188    HA   ARG  25           HA       ARG  25 293.204 -10.975  -5.117
  189    HB2  ARG  25           HB2      ARG  25 292.110 -11.614  -7.844
  190    HB3  ARG  25           HB3      ARG  25 293.745 -12.019  -7.377
  191    HG2  ARG  25           HG2      ARG  25 292.546 -13.091  -5.299
  192    HG3  ARG  25           HG3      ARG  25 291.182 -13.146  -6.417
  193    HD2  ARG  25           HD2      ARG  25 292.045 -15.036  -7.199
  194    HD3  ARG  25           HD3      ARG  25 293.325 -14.062  -7.916
  195    HE   ARG  25           HE       ARG  25 293.852 -14.750  -5.190
  196   HH11  ARG  25          HH11      ARG  25 294.038 -15.892  -8.483
  197   HH12  ARG  25          HH12      ARG  25 295.301 -17.027  -8.150
  198   HH21  ARG  25          HH21      ARG  25 295.515 -16.244  -4.754
  199   HH22  ARG  25          HH22      ARG  25 296.137 -17.229  -6.035
  200    H    HIS  26           H        HIS  26 292.441  -9.174  -8.122
  201    HA   HIS  26           HA       HIS  26 295.150  -8.249  -8.289
  202    HB2  HIS  26           HB2      HIS  26 292.672  -7.620  -9.873
  203    HB3  HIS  26           HB3      HIS  26 294.203  -6.793 -10.150
  204    HD1  HIS  26           HD1      HIS  26 295.346  -7.770 -12.099
  205    HD2  HIS  26           HD2      HIS  26 293.340 -10.663  -9.890
  206    HE1  HIS  26           HE1      HIS  26 295.823  -9.951 -13.257
  207    HE2  HIS  26           HE2      HIS  26 294.546 -11.679 -11.941
  208    H    THR  27           H        THR  27 293.657  -7.503  -5.851
  209    HA   THR  27           HA       THR  27 293.743  -4.582  -6.149
  210    HB   THR  27           HB       THR  27 292.412  -6.231  -3.993
  211    HG1  THR  27           HG1      THR  27 291.194  -4.555  -5.902
  212   HG21  THR  27          HG21      THR  27 293.336  -3.635  -3.766
  213   HG22  THR  27          HG22      THR  27 292.107  -4.405  -2.764
  214   HG23  THR  27          HG23      THR  27 291.627  -3.453  -4.167
  215    HA   PRO  28           HA       PRO  28 297.556  -4.789  -3.882
  216    HB2  PRO  28           HB2      PRO  28 296.830  -2.081  -2.962
  217    HB3  PRO  28           HB3      PRO  28 298.270  -2.616  -3.825
  218    HG2  PRO  28           HG2      PRO  28 296.346  -1.168  -5.019
  219    HG3  PRO  28           HG3      PRO  28 297.283  -2.398  -5.887
  220    HD2  PRO  28           HD2      PRO  28 294.490  -2.503  -4.866
  221    HD3  PRO  28           HD3      PRO  28 295.199  -3.252  -6.310
  222    H    LEU  29           H        LEU  29 297.748  -5.786  -2.015
  223    HA   LEU  29           HA       LEU  29 295.725  -6.127  -0.168
  224    HB2  LEU  29           HB2      LEU  29 298.712  -6.382   0.123
  225    HB3  LEU  29           HB3      LEU  29 297.584  -6.861   1.381
  226    HG   LEU  29           HG       LEU  29 297.275  -7.949  -1.382
  227   HD11  LEU  29          HD11      LEU  29 299.661  -8.223  -0.136
  228   HD12  LEU  29          HD12      LEU  29 298.970  -9.386  -1.267
  229   HD13  LEU  29          HD13      LEU  29 298.787  -9.630   0.470
  230   HD21  LEU  29          HD21      LEU  29 296.579  -9.929   0.171
  231   HD22  LEU  29          HD22      LEU  29 295.477  -8.593  -0.152
  232   HD23  LEU  29          HD23      LEU  29 296.383  -8.644   1.372
  233    H    SER  30           H        SER  30 297.705  -3.343  -0.606
  234    HA   SER  30           HA       SER  30 297.969  -2.310   1.926
  235    HB2  SER  30           HB2      SER  30 297.883  -0.081   0.840
  236    HB3  SER  30           HB3      SER  30 298.899  -1.205  -0.060
  237    HG   SER  30           HG       SER  30 297.670  -0.734  -1.688
  238    H    LYS  31           H        LYS  31 295.094  -2.834   0.056
  239    HA   LYS  31           HA       LYS  31 293.435  -1.017   1.530
  240    HB2  LYS  31           HB2      LYS  31 293.132  -2.069  -0.858
  241    HB3  LYS  31           HB3      LYS  31 292.339  -3.357   0.035
  242    HG2  LYS  31           HG2      LYS  31 290.581  -2.028   0.651
  243    HG3  LYS  31           HG3      LYS  31 291.527  -0.541   0.544
  244    HD2  LYS  31           HD2      LYS  31 291.214  -1.992  -1.993
  245    HD3  LYS  31           HD3      LYS  31 289.717  -1.352  -1.314
  246    HE2  LYS  31           HE2      LYS  31 291.119   0.824  -1.006
  247    HE3  LYS  31           HE3      LYS  31 292.159   0.100  -2.232
  248    HZ1  LYS  31           HZ1      LYS  31 290.746   1.138  -3.617
  249    HZ2  LYS  31           HZ2      LYS  31 289.489   1.207  -2.487
  250    HZ3  LYS  31           HZ3      LYS  31 289.768  -0.218  -3.355
  251    H    LEU  32           H        LEU  32 294.068  -4.486   1.470
  252    HA   LEU  32           HA       LEU  32 292.300  -5.337   3.453
  253    HB2  LEU  32           HB2      LEU  32 293.442  -6.879   1.991
  254    HB3  LEU  32           HB3      LEU  32 295.003  -6.312   2.523
  255    HG   LEU  32           HG       LEU  32 293.279  -7.639   4.564
  256   HD11  LEU  32          HD11      LEU  32 294.481  -9.779   3.606
  257   HD12  LEU  32          HD12      LEU  32 294.290  -8.901   2.090
  258   HD13  LEU  32          HD13      LEU  32 292.876  -9.286   3.070
  259   HD21  LEU  32          HD21      LEU  32 295.743  -6.657   4.658
  260   HD22  LEU  32          HD22      LEU  32 296.123  -8.258   4.011
  261   HD23  LEU  32          HD23      LEU  32 295.273  -8.103   5.563
  262    H    MET  33           H        MET  33 295.605  -4.062   3.649
  263    HA   MET  33           HA       MET  33 295.765  -4.337   6.449
  264    HB2  MET  33           HB2      MET  33 297.520  -2.315   5.365
  265    HB3  MET  33           HB3      MET  33 297.891  -3.745   6.255
  266    HG2  MET  33           HG2      MET  33 297.982  -5.072   4.322
  267    HG3  MET  33           HG3      MET  33 297.259  -3.794   3.361
  268    HE1  MET  33           HE1      MET  33 301.518  -4.655   3.337
  269    HE2  MET  33           HE2      MET  33 300.081  -5.367   2.595
  270    HE3  MET  33           HE3      MET  33 300.351  -5.542   4.330
  271    H    LYS  34           H        LYS  34 295.079  -1.625   4.272
  272    HA   LYS  34           HA       LYS  34 294.997   0.425   6.127
  273    HB2  LYS  34           HB2      LYS  34 293.517  -0.065   3.570
  274    HB3  LYS  34           HB3      LYS  34 293.103   1.328   4.561
  275    HG2  LYS  34           HG2      LYS  34 295.948   0.824   3.821
  276    HG3  LYS  34           HG3      LYS  34 294.851   1.571   2.663
  277    HD2  LYS  34           HD2      LYS  34 294.327   3.000   4.926
  278    HD3  LYS  34           HD3      LYS  34 296.049   2.661   5.102
  279    HE2  LYS  34           HE2      LYS  34 295.587   3.425   2.410
  280    HE3  LYS  34           HE3      LYS  34 294.770   4.593   3.448
  281    HZ1  LYS  34           HZ1      LYS  34 296.849   4.904   4.654
  282    HZ2  LYS  34           HZ2      LYS  34 297.039   5.264   3.012
  283    HZ3  LYS  34           HZ3      LYS  34 297.628   3.805   3.631
  284    H    ALA  35           H        ALA  35 292.591  -2.016   5.385
  285    HA   ALA  35           HA       ALA  35 290.531  -0.968   7.076
  286    HB1  ALA  35           HB1      ALA  35 289.715  -2.439   5.470
  287    HB2  ALA  35           HB2      ALA  35 289.779  -3.479   6.890
  288    HB3  ALA  35           HB3      ALA  35 291.052  -3.577   5.666
  289    H    TYR  36           H        TYR  36 293.246  -3.130   7.403
  290    HA   TYR  36           HA       TYR  36 292.753  -4.159  10.024
  291    HB2  TYR  36           HB2      TYR  36 294.318  -5.129   8.343
  292    HB3  TYR  36           HB3      TYR  36 295.351  -3.725   8.559
  293    HD1  TYR  36           HD2      TYR  36 293.610  -6.188  10.740
  294    HD2  TYR  36           HD1      TYR  36 297.176  -4.037   9.881
  295    HE1  TYR  36           HE2      TYR  36 294.741  -7.310  12.587
  296    HE2  TYR  36           HE1      TYR  36 298.329  -5.151  11.714
  297    HH   TYR  36           HH       TYR  36 296.640  -7.030  14.063
  298    H    CYS  37           H        CYS  37 294.391  -1.322   8.701
  299    HA   CYS  37           HA       CYS  37 295.509  -0.431  11.171
  300    HB2  CYS  37           HB2      CYS  37 296.257   0.185   8.810
  301    HB3  CYS  37           HB3      CYS  37 294.830   1.200   8.719
  302    HG   CYS  37           HG       CYS  37 296.052   2.352  10.967
  303    H    GLU  38           H        GLU  38 292.682   0.096   9.251
  304    HA   GLU  38           HA       GLU  38 291.416   2.145  10.704
  305    HB2  GLU  38           HB2      GLU  38 290.770   1.565   8.451
  306    HB3  GLU  38           HB3      GLU  38 290.370  -0.072   8.946
  307    HG2  GLU  38           HG2      GLU  38 288.854   1.635  10.566
  308    HG3  GLU  38           HG3      GLU  38 288.775   2.258   8.928
  309    H    ARG  39           H        ARG  39 291.292  -1.373  10.835
  310    HA   ARG  39           HA       ARG  39 289.279  -1.929  12.513
  311    HB2  ARG  39           HB2      ARG  39 291.896  -3.101  11.833
  312    HB3  ARG  39           HB3      ARG  39 290.969  -3.809  13.070
  313    HG2  ARG  39           HG2      ARG  39 289.264  -3.464  10.895
  314    HG3  ARG  39           HG3      ARG  39 290.797  -4.108  10.293
  315    HD2  ARG  39           HD2      ARG  39 288.922  -5.251  12.233
  316    HD3  ARG  39           HD3      ARG  39 289.689  -6.030  10.853
  317    HE   ARG  39           HE       ARG  39 291.787  -5.805  12.270
  318   HH11  ARG  39          HH11      ARG  39 288.600  -6.272  13.631
  319   HH12  ARG  39          HH12      ARG  39 289.197  -6.961  15.100
  320   HH21  ARG  39          HH21      ARG  39 292.564  -6.710  14.213
  321   HH22  ARG  39          HH22      ARG  39 291.439  -7.218  15.427
  322    H    GLN  40           H        GLN  40 292.655  -1.188  13.400
  323    HA   GLN  40           HA       GLN  40 291.780  -1.175  16.217
  324    HB2  GLN  40           HB2      GLN  40 294.438  -2.067  15.141
  325    HB3  GLN  40           HB3      GLN  40 293.930  -2.083  16.818
  326    HG2  GLN  40           HG2      GLN  40 291.956  -3.539  15.789
  327    HG3  GLN  40           HG3      GLN  40 293.204  -3.886  14.592
  328   HE21  GLN  40          HE21      GLN  40 291.955  -5.651  16.517
  329   HE22  GLN  40          HE22      GLN  40 293.229  -6.293  17.493
  330    H    GLY  41           H        GLY  41 292.801   1.096  14.027
  331    HA2  GLY  41           HA2      GLY  41 293.518   3.221  14.471
  332    HA3  GLY  41           HA3      GLY  41 293.694   2.775  16.161
  333    H    LEU  42           H        LEU  42 295.234   1.076  13.495
  334    HA   LEU  42           HA       LEU  42 297.831   1.540  14.698
  335    HB2  LEU  42           HB2      LEU  42 296.848  -0.106  12.379
  336    HB3  LEU  42           HB3      LEU  42 298.569   0.133  12.642
  337    HG   LEU  42           HG       LEU  42 296.945  -0.863  14.930
  338   HD11  LEU  42          HD11      LEU  42 297.955  -2.791  12.878
  339   HD12  LEU  42          HD12      LEU  42 296.328  -2.114  12.755
  340   HD13  LEU  42          HD13      LEU  42 296.791  -3.049  14.179
  341   HD21  LEU  42          HD21      LEU  42 299.040  -2.139  15.305
  342   HD22  LEU  42          HD22      LEU  42 299.277  -0.391  15.270
  343   HD23  LEU  42          HD23      LEU  42 299.722  -1.368  13.872
  344    H    SER  43           H        SER  43 299.488   1.612  12.523
  345    HA   SER  43           HA       SER  43 298.831   4.199  11.279
  346    HB2  SER  43           HB2      SER  43 300.738   4.173  12.946
  347    HB3  SER  43           HB3      SER  43 301.599   3.119  11.830
  348    HG   SER  43           HG       SER  43 301.374   4.802  10.251
  349    H    MET  44           H        MET  44 299.424   0.916  10.710
  350    HA   MET  44           HA       MET  44 299.784  -0.383   8.884
  351    HB2  MET  44           HB2      MET  44 297.806   0.994   8.125
  352    HB3  MET  44           HB3      MET  44 298.933   2.044   7.278
  353    HG2  MET  44           HG2      MET  44 299.642  -0.477   6.431
  354    HG3  MET  44           HG3      MET  44 297.883  -0.557   6.542
  355    HE1  MET  44           HE1      MET  44 298.107  -1.139   3.923
  356    HE2  MET  44           HE2      MET  44 299.821  -0.742   3.795
  357    HE3  MET  44           HE3      MET  44 298.656   0.012   2.706
  358    H    ARG  45           H        ARG  45 301.660   2.183   9.615
  359    HA   ARG  45           HA       ARG  45 303.604   1.703   7.459
  360    HB2  ARG  45           HB2      ARG  45 302.611   4.099   7.918
  361    HB3  ARG  45           HB3      ARG  45 303.741   4.092   9.257
  362    HG2  ARG  45           HG2      ARG  45 305.425   4.595   7.919
  363    HG3  ARG  45           HG3      ARG  45 305.061   3.219   6.872
  364    HD2  ARG  45           HD2      ARG  45 303.756   4.460   5.466
  365    HD3  ARG  45           HD3      ARG  45 303.335   5.623   6.720
  366    HE   ARG  45           HE       ARG  45 305.280   6.806   6.268
  367   HH11  ARG  45          HH11      ARG  45 305.177   3.868   4.379
  368   HH12  ARG  45          HH12      ARG  45 306.472   4.349   3.338
  369   HH21  ARG  45          HH21      ARG  45 306.980   7.433   4.897
  370   HH22  ARG  45          HH22      ARG  45 307.495   6.370   3.630
  371    H    GLN  46           H        GLN  46 303.049   2.334  10.860
  372    HA   GLN  46           HA       GLN  46 305.637   1.524  11.793
  373    HB2  GLN  46           HB2      GLN  46 304.032   3.064  12.986
  374    HB3  GLN  46           HB3      GLN  46 303.019   1.665  13.314
  375    HG2  GLN  46           HG2      GLN  46 305.889   1.610  14.114
  376    HG3  GLN  46           HG3      GLN  46 304.740   2.527  15.087
  377   HE21  GLN  46          HE21      GLN  46 302.533   1.053  15.120
  378   HE22  GLN  46          HE22      GLN  46 302.821  -0.504  15.808
  379    H    ILE  47           H        ILE  47 303.018   0.046  10.508
  380    HA   ILE  47           HA       ILE  47 303.607  -2.599  11.614
  381    HB   ILE  47           HB       ILE  47 301.460  -2.232  12.391
  382   HG12  ILE  47          HG12      ILE  47 301.620  -4.234  10.845
  383   HG13  ILE  47          HG13      ILE  47 299.986  -3.616  11.115
  384   HG21  ILE  47          HG21      ILE  47 299.762  -1.216  10.588
  385   HG22  ILE  47          HG22      ILE  47 301.261  -0.401  10.146
  386   HG23  ILE  47          HG23      ILE  47 300.639  -0.269  11.789
  387   HD11  ILE  47          HD11      ILE  47 301.093  -2.325   8.871
  388   HD12  ILE  47          HD12      ILE  47 299.633  -3.291   9.041
  389   HD13  ILE  47          HD13      ILE  47 301.175  -4.079   8.695
  390    H    ARG  48           H        ARG  48 303.489  -4.311  10.153
  391    HA   ARG  48           HA       ARG  48 303.167  -3.726   7.326
  392    HB2  ARG  48           HB2      ARG  48 305.709  -4.904   8.454
  393    HB3  ARG  48           HB3      ARG  48 305.301  -4.789   6.748
  394    HG2  ARG  48           HG2      ARG  48 305.424  -2.357   8.487
  395    HG3  ARG  48           HG3      ARG  48 306.861  -3.031   7.727
  396    HD2  ARG  48           HD2      ARG  48 305.974  -2.717   5.551
  397    HD3  ARG  48           HD3      ARG  48 304.376  -2.341   6.187
  398    HE   ARG  48           HE       ARG  48 306.407  -0.524   7.081
  399   HH11  ARG  48          HH11      ARG  48 304.176  -1.247   4.497
  400   HH12  ARG  48          HH12      ARG  48 304.110   0.388   3.929
  401   HH21  ARG  48          HH21      ARG  48 306.323   1.624   6.335
  402   HH22  ARG  48          HH22      ARG  48 305.329   2.016   4.972
  403    H    PHE  49           H        PHE  49 302.668  -5.598   6.114
  404    HA   PHE  49           HA       PHE  49 301.986  -7.920   7.805
  405    HB2  PHE  49           HB2      PHE  49 300.923  -7.115   5.102
  406    HB3  PHE  49           HB3      PHE  49 300.445  -8.545   5.972
  407    HD1  PHE  49           HD1      PHE  49 300.784  -6.118   8.490
  408    HD2  PHE  49           HD2      PHE  49 298.331  -7.228   5.166
  409    HE1  PHE  49           HE1      PHE  49 298.917  -4.872   9.424
  410    HE2  PHE  49           HE2      PHE  49 296.498  -5.932   6.118
  411    HZ   PHE  49           HZ       PHE  49 296.804  -4.768   8.245
  412    H    ARG  50           H        ARG  50 302.441 -10.001   7.110
  413    HA   ARG  50           HA       ARG  50 304.086 -10.349   4.724
  414    HB2  ARG  50           HB2      ARG  50 305.455 -10.552   6.781
  415    HB3  ARG  50           HB3      ARG  50 304.429 -11.846   7.325
  416    HG2  ARG  50           HG2      ARG  50 305.431 -12.095   4.663
  417    HG3  ARG  50           HG3      ARG  50 306.690 -12.004   5.838
  418    HD2  ARG  50           HD2      ARG  50 304.579 -14.037   5.469
  419    HD3  ARG  50           HD3      ARG  50 306.294 -14.262   5.699
  420    HE   ARG  50           HE       ARG  50 304.574 -13.398   7.915
  421   HH11  ARG  50          HH11      ARG  50 306.871 -15.656   6.550
  422   HH12  ARG  50          HH12      ARG  50 307.023 -16.568   8.012
  423   HH21  ARG  50          HH21      ARG  50 304.765 -14.620   9.825
  424   HH22  ARG  50          HH22      ARG  50 305.831 -15.984   9.865
  425    H    PHE  51           H        PHE  51 303.492 -12.020   3.555
  426    HA   PHE  51           HA       PHE  51 300.966 -13.248   4.304
  427    HB2  PHE  51           HB2      PHE  51 300.632 -12.546   2.178
  428    HB3  PHE  51           HB3      PHE  51 302.309 -12.693   1.744
  429    HD1  PHE  51           HD1      PHE  51 299.391 -14.804   2.595
  430    HD2  PHE  51           HD2      PHE  51 302.897 -14.369   0.237
  431    HE1  PHE  51           HE1      PHE  51 298.842 -16.888   1.404
  432    HE2  PHE  51           HE2      PHE  51 302.364 -16.451  -0.958
  433    HZ   PHE  51           HZ       PHE  51 300.332 -17.715  -0.375
  434    H    ASP  52           H        ASP  52 300.687 -15.504   3.895
  435    HA   ASP  52           HA       ASP  52 302.204 -17.117   5.494
  436    HB2  ASP  52           HB2      ASP  52 300.075 -17.766   4.148
  437    HB3  ASP  52           HB3      ASP  52 301.205 -18.264   2.895
  438    H    GLY  53           H        GLY  53 304.266 -16.630   5.437
  439    HA2  GLY  53           HA2      GLY  53 306.462 -16.664   4.866
  440    HA3  GLY  53           HA3      GLY  53 306.041 -17.946   3.757
  441    H    GLN  54           H        GLN  54 305.556 -14.302   3.887
  442    HA   GLN  54           HA       GLN  54 307.153 -13.902   1.610
  443    HB2  GLN  54           HB2      GLN  54 304.759 -14.944   0.853
  444    HB3  GLN  54           HB3      GLN  54 304.365 -13.231   0.883
  445    HG2  GLN  54           HG2      GLN  54 305.063 -13.951  -1.333
  446    HG3  GLN  54           HG3      GLN  54 306.178 -12.763  -0.659
  447   HE21  GLN  54          HE21      GLN  54 308.272 -13.278  -0.436
  448   HE22  GLN  54          HE22      GLN  54 308.951 -14.823  -0.808
  449    HA   PRO  55           HA       PRO  55 307.119 -10.439   4.610
  450    HB2  PRO  55           HB2      PRO  55 308.724  -9.199   2.547
  451    HB3  PRO  55           HB3      PRO  55 309.172  -9.645   4.193
  452    HG2  PRO  55           HG2      PRO  55 309.664 -11.066   1.707
  453    HG3  PRO  55           HG3      PRO  55 310.319 -11.389   3.320
  454    HD2  PRO  55           HD2      PRO  55 308.569 -13.023   2.035
  455    HD3  PRO  55           HD3      PRO  55 308.673 -12.911   3.800
  456    H    ILE  56           H        ILE  56 304.864 -10.543   2.718
  457    HA   ILE  56           HA       ILE  56 303.957  -9.055   1.065
  458    HB   ILE  56           HB       ILE  56 303.056  -8.759   3.865
  459   HG12  ILE  56          HG12      ILE  56 302.596 -10.542   1.707
  460   HG13  ILE  56          HG13      ILE  56 302.105 -10.665   3.377
  461   HG21  ILE  56          HG21      ILE  56 301.893  -7.365   1.481
  462   HG22  ILE  56          HG22      ILE  56 302.440  -6.650   3.000
  463   HG23  ILE  56          HG23      ILE  56 300.991  -7.651   2.976
  464   HD11  ILE  56          HD11      ILE  56 300.266 -10.741   1.725
  465   HD12  ILE  56          HD12      ILE  56 300.612  -9.049   1.379
  466   HD13  ILE  56          HD13      ILE  56 300.121  -9.534   3.004
  467    H    ASN  57           H        ASN  57 303.466  -7.270   0.290
  468    HA   ASN  57           HA       ASN  57 304.762  -4.803   1.240
  469    HB2  ASN  57           HB2      ASN  57 304.613  -6.097  -1.376
  470    HB3  ASN  57           HB3      ASN  57 304.307  -4.366  -1.404
  471   HD21  ASN  57          HD21      ASN  57 306.517  -6.329   0.580
  472   HD22  ASN  57          HD22      ASN  57 307.949  -5.493   0.101
  473    H    GLU  58           H        GLU  58 303.591  -2.858   0.003
  474    HA   GLU  58           HA       GLU  58 300.902  -2.901   1.013
  475    HB2  GLU  58           HB2      GLU  58 302.837  -0.901   0.189
  476    HB3  GLU  58           HB3      GLU  58 301.230  -0.540  -0.428
  477    HG2  GLU  58           HG2      GLU  58 300.315  -0.624   1.802
  478    HG3  GLU  58           HG3      GLU  58 301.884  -1.095   2.456
  479    H    THR  59           H        THR  59 302.449  -2.903  -2.134
  480    HA   THR  59           HA       THR  59 299.892  -2.725  -3.473
  481    HB   THR  59           HB       THR  59 301.325  -2.854  -5.549
  482    HG1  THR  59           HG1      THR  59 303.461  -2.434  -3.748
  483   HG21  THR  59          HG21      THR  59 301.008  -0.749  -3.656
  484   HG22  THR  59          HG22      THR  59 301.142  -0.659  -5.416
  485   HG23  THR  59          HG23      THR  59 302.597  -0.621  -4.419
  486    H    ASP  60           H        ASP  60 301.999  -5.213  -2.431
  487    HA   ASP  60           HA       ASP  60 301.567  -7.223  -4.295
  488    HB2  ASP  60           HB2      ASP  60 302.137  -7.180  -1.375
  489    HB3  ASP  60           HB3      ASP  60 301.549  -8.692  -2.054
  490    H    THR  61           H        THR  61 299.849  -8.454  -4.876
  491    HA   THR  61           HA       THR  61 297.397  -8.175  -3.264
  492    HB   THR  61           HB       THR  61 296.090  -7.979  -5.106
  493    HG1  THR  61           HG1      THR  61 297.576  -8.758  -7.189
  494   HG21  THR  61          HG21      THR  61 297.664  -6.089  -5.171
  495   HG22  THR  61          HG22      THR  61 297.035  -6.523  -6.764
  496   HG23  THR  61          HG23      THR  61 298.671  -6.999  -6.297
  497    HA   PRO  62           HA       PRO  62 296.973 -12.476  -2.387
  498    HB2  PRO  62           HB2      PRO  62 294.419 -12.124  -3.943
  499    HB3  PRO  62           HB3      PRO  62 294.680 -12.984  -2.418
  500    HG2  PRO  62           HG2      PRO  62 293.620 -10.578  -2.378
  501    HG3  PRO  62           HG3      PRO  62 294.888 -10.991  -1.208
  502    HD2  PRO  62           HD2      PRO  62 295.049  -9.286  -3.645
  503    HD3  PRO  62           HD3      PRO  62 295.920  -9.142  -2.106
  504    H    ALA  63           H        ALA  63 295.809 -11.593  -5.727
  505    HA   ALA  63           HA       ALA  63 296.305 -14.098  -6.921
  506    HB1  ALA  63           HB1      ALA  63 295.163 -12.826  -8.405
  507    HB2  ALA  63           HB2      ALA  63 296.773 -12.262  -8.877
  508    HB3  ALA  63           HB3      ALA  63 295.819 -11.326  -7.732
  509    H    GLN  64           H        GLN  64 298.066 -11.167  -6.570
  510    HA   GLN  64           HA       GLN  64 300.414 -11.805  -7.981
  511    HB2  GLN  64           HB2      GLN  64 299.207  -9.678  -6.536
  512    HB3  GLN  64           HB3      GLN  64 300.794  -9.912  -5.888
  513    HG2  GLN  64           HG2      GLN  64 300.169  -9.549  -8.791
  514    HG3  GLN  64           HG3      GLN  64 300.668  -8.249  -7.711
  515   HE21  GLN  64          HE21      GLN  64 302.794  -8.329  -6.811
  516   HE22  GLN  64          HE22      GLN  64 304.059  -9.175  -7.628
  517    H    LEU  65           H        LEU  65 299.136 -12.707  -5.010
  518    HA   LEU  65           HA       LEU  65 301.713 -13.636  -3.973
  519    HB2  LEU  65           HB2      LEU  65 299.196 -12.656  -2.681
  520    HB3  LEU  65           HB3      LEU  65 300.404 -13.512  -1.773
  521    HG   LEU  65           HG       LEU  65 300.595 -10.828  -3.105
  522   HD11  LEU  65          HD11      LEU  65 299.723 -11.152  -0.743
  523   HD12  LEU  65          HD12      LEU  65 301.022  -9.983  -0.976
  524   HD13  LEU  65          HD13      LEU  65 301.379 -11.578  -0.313
  525   HD21  LEU  65          HD21      LEU  65 302.999 -10.862  -2.347
  526   HD22  LEU  65          HD22      LEU  65 302.607 -11.861  -3.748
  527   HD23  LEU  65          HD23      LEU  65 302.819 -12.607  -2.165
  528    H    GLU  66           H        GLU  66 299.168 -14.706  -5.605
  529    HA   GLU  66           HA       GLU  66 297.988 -16.633  -5.828
  530    HB2  GLU  66           HB2      GLU  66 300.689 -17.531  -4.859
  531    HB3  GLU  66           HB3      GLU  66 299.418 -18.714  -5.135
  532    HG2  GLU  66           HG2      GLU  66 299.226 -17.955  -7.454
  533    HG3  GLU  66           HG3      GLU  66 300.520 -16.792  -7.172
  534    H    MET  67           H        MET  67 297.156 -15.292  -3.697
  535    HA   MET  67           HA       MET  67 297.133 -16.980  -1.341
  536    HB2  MET  67           HB2      MET  67 296.032 -14.261  -1.993
  537    HB3  MET  67           HB3      MET  67 295.617 -15.073  -0.505
  538    HG2  MET  67           HG2      MET  67 298.323 -15.302  -0.515
  539    HG3  MET  67           HG3      MET  67 298.090 -13.737  -1.291
  540    HE1  MET  67           HE1      MET  67 298.870 -11.891   0.804
  541    HE2  MET  67           HE2      MET  67 297.248 -11.362   1.248
  542    HE3  MET  67           HE3      MET  67 297.603 -11.807  -0.422
  543    H    GLU  68           H        GLU  68 294.984 -17.413  -0.268
  544    HA   GLU  68           HA       GLU  68 293.004 -18.174  -2.318
  545    HB2  GLU  68           HB2      GLU  68 294.215 -19.715  -0.186
  546    HB3  GLU  68           HB3      GLU  68 292.459 -19.708  -0.073
  547    HG2  GLU  68           HG2      GLU  68 292.203 -20.779  -2.107
  548    HG3  GLU  68           HG3      GLU  68 293.801 -20.304  -2.682
  549    H    ASP  69           H        ASP  69 290.932 -18.876  -1.030
  550    HA   ASP  69           HA       ASP  69 290.018 -16.435   0.231
  551    HB2  ASP  69           HB2      ASP  69 287.905 -16.983  -0.436
  552    HB3  ASP  69           HB3      ASP  69 288.856 -17.786  -1.675
  553    H    GLU  70           H        GLU  70 290.315 -16.260   2.142
  554    HA   GLU  70           HA       GLU  70 289.818 -16.545   4.440
  555    HB2  GLU  70           HB2      GLU  70 289.827 -19.519   3.870
  556    HB3  GLU  70           HB3      GLU  70 289.479 -18.762   5.416
  557    HG2  GLU  70           HG2      GLU  70 287.523 -17.651   4.388
  558    HG3  GLU  70           HG3      GLU  70 287.842 -18.542   2.903
  559    H    ASP  71           H        ASP  71 292.243 -17.171   2.446
  560    HA   ASP  71           HA       ASP  71 294.224 -18.539   3.708
  561    HB2  ASP  71           HB2      ASP  71 294.083 -16.972   1.476
  562    HB3  ASP  71           HB3      ASP  71 295.138 -16.014   2.504
  563    H    THR  72           H        THR  72 296.333 -16.796   4.226
  564    HA   THR  72           HA       THR  72 295.387 -15.163   6.446
  565    HB   THR  72           HB       THR  72 297.379 -17.380   6.768
  566    HG1  THR  72           HG1      THR  72 295.218 -16.906   8.462
  567   HG21  THR  72          HG21      THR  72 298.412 -16.248   8.365
  568   HG22  THR  72          HG22      THR  72 296.883 -16.145   9.237
  569   HG23  THR  72          HG23      THR  72 297.343 -14.868   8.111
  570    H    ILE  73           H        ILE  73 296.281 -13.392   6.566
  571    HA   ILE  73           HA       ILE  73 298.780 -12.779   5.145
  572    HB   ILE  73           HB       ILE  73 296.355 -11.149   5.927
  573   HG12  ILE  73          HG12      ILE  73 296.502 -11.525   3.657
  574   HG13  ILE  73          HG13      ILE  73 297.215  -9.939   3.867
  575   HG21  ILE  73          HG21      ILE  73 299.190 -10.059   5.915
  576   HG22  ILE  73          HG22      ILE  73 298.053 -10.044   7.265
  577   HG23  ILE  73          HG23      ILE  73 297.736  -9.059   5.838
  578   HD11  ILE  73          HD11      ILE  73 298.690 -10.879   2.474
  579   HD12  ILE  73          HD12      ILE  73 298.513 -12.479   3.189
  580   HD13  ILE  73          HD13      ILE  73 299.415 -11.222   4.039
  581    H    ASP  74           H        ASP  74 300.506 -12.263   6.443
  582    HA   ASP  74           HA       ASP  74 300.046 -12.556   9.324
  583    HB2  ASP  74           HB2      ASP  74 302.771 -12.589   8.031
  584    HB3  ASP  74           HB3      ASP  74 302.273 -13.274   9.574
  585    H    VAL  75           H        VAL  75 300.763 -11.021  10.770
  586    HA   VAL  75           HA       VAL  75 301.442  -8.464   9.501
  587    HB   VAL  75           HB       VAL  75 299.712  -9.044  11.815
  588   HG11  VAL  75          HG11      VAL  75 301.670  -6.757  11.805
  589   HG12  VAL  75          HG12      VAL  75 301.448  -7.979  13.067
  590   HG13  VAL  75          HG13      VAL  75 300.197  -6.765  12.779
  591   HG21  VAL  75          HG21      VAL  75 299.687  -6.478  10.384
  592   HG22  VAL  75          HG22      VAL  75 298.353  -7.536  10.844
  593   HG23  VAL  75          HG23      VAL  75 299.335  -7.919   9.429
  594    H    PHE  76           H        PHE  76 303.168  -7.443   9.955
  595    HA   PHE  76           HA       PHE  76 304.793  -8.125  12.266
  596    HB2  PHE  76           HB2      PHE  76 305.726  -7.855   9.451
  597    HB3  PHE  76           HB3      PHE  76 306.804  -7.823  10.806
  598    HD1  PHE  76           HD1      PHE  76 306.143  -9.890  12.503
  599    HD2  PHE  76           HD2      PHE  76 305.905  -9.913   8.231
  600    HE1  PHE  76           HE1      PHE  76 306.402 -12.331  12.501
  601    HE2  PHE  76           HE2      PHE  76 306.168 -12.346   8.251
  602    HZ   PHE  76           HZ       PHE  76 306.417 -13.560  10.375
  603    H    GLN  77           H        GLN  77 305.062  -6.326  13.211
  604    HA   GLN  77           HA       GLN  77 304.524  -3.849  11.816
  605    HB2  GLN  77           HB2      GLN  77 304.122  -4.846  14.481
  606    HB3  GLN  77           HB3      GLN  77 304.887  -3.263  14.520
  607    HG2  GLN  77           HG2      GLN  77 303.068  -2.247  13.509
  608    HG3  GLN  77           HG3      GLN  77 302.496  -3.760  12.792
  609   HE21  GLN  77          HE21      GLN  77 300.462  -3.739  13.578
  610   HE22  GLN  77          HE22      GLN  77 300.067  -3.839  15.256
  611    H    GLN  78           H        GLN  78 306.155  -2.874  10.904
  612    HA   GLN  78           HA       GLN  78 308.153  -1.940  10.492
  613    HB2  GLN  78           HB2      GLN  78 307.571  -1.467  13.232
  614    HB3  GLN  78           HB3      GLN  78 309.307  -1.712  13.070
  615    HG2  GLN  78           HG2      GLN  78 308.273  -0.009  10.980
  616    HG3  GLN  78           HG3      GLN  78 307.890   0.623  12.582
  617   HE21  GLN  78          HE21      GLN  78 310.214   0.394  10.185
  618   HE22  GLN  78          HE22      GLN  78 311.573   0.974  11.080
  619    H    GLN  79           H        GLN  79 308.903  -3.830   9.471
  620    HA   GLN  79           HA       GLN  79 311.431  -4.660  10.241
  621    HB2  GLN  79           HB2      GLN  79 310.541  -7.217  10.438
  622    HB3  GLN  79           HB3      GLN  79 310.977  -6.209  11.806
  623    HG2  GLN  79           HG2      GLN  79 308.688  -5.657  12.212
  624    HG3  GLN  79           HG3      GLN  79 308.183  -6.443  10.717
  625   HE21  GLN  79          HE21      GLN  79 308.263  -6.782  13.950
  626   HE22  GLN  79          HE22      GLN  79 308.252  -8.505  14.080
  627    H    THR  80           H        THR  80 309.050  -6.880   8.965
  628    HA   THR  80           HA       THR  80 308.899  -7.949   6.952
  629    HB   THR  80           HB       THR  80 308.851  -6.398   4.982
  630    HG1  THR  80           HG1      THR  80 309.200  -4.239   5.326
  631   HG21  THR  80          HG21      THR  80 306.746  -6.390   5.736
  632   HG22  THR  80          HG22      THR  80 307.152  -4.748   6.239
  633   HG23  THR  80          HG23      THR  80 307.227  -6.073   7.404
  634    H    GLY  81           H        GLY  81 310.007  -7.935   4.582
  635    HA2  GLY  81           HA2      GLY  81 312.918  -7.797   4.897
  636    HA3  GLY  81           HA3      GLY  81 312.197  -9.340   4.474
  637    H    GLY  82           H        GLY  82 310.122  -7.911   2.789
  638    HA2  GLY  82           HA2      GLY  82 310.043  -6.762   0.724
  639    HA3  GLY  82           HA3      GLY  82 311.796  -6.838   0.643
  640    H1   GLY   1           HT1      GLY   1 316.433  -0.460  19.969
  641    H2   GLY   1           HT2      GLY   1 315.004   0.128  19.282
  642    H3   GLY   1           HT3      GLY   1 315.929   1.124  20.288
  643    HA2  GLY   1           HA3      GLY   1 316.458   1.884  18.175
  644    HA3  GLY   1           HA2      GLY   1 317.794   0.830  18.613
  645    H    SER   2           H        SER   2 314.818   1.055  16.744
  646    HA   SER   2           HA       SER   2 315.929  -0.923  14.886
  647    HB2  SER   2           HB2      SER   2 313.424  -1.679  14.624
  648    HB3  SER   2           HB3      SER   2 314.412  -2.339  15.928
  649    HG   SER   2           HG       SER   2 312.527  -0.227  16.097
  650    H    GLU   3           H        GLU   3 316.047  -0.091  12.946
  651    HA   GLU   3           HA       GLU   3 314.395   2.217  12.252
  652    HB2  GLU   3           HB2      GLU   3 317.075   1.382  11.686
  653    HB3  GLU   3           HB3      GLU   3 316.212   1.584  10.166
  654    HG2  GLU   3           HG2      GLU   3 316.478   3.770  10.299
  655    HG3  GLU   3           HG3      GLU   3 315.575   3.796  11.813
  656    H    GLU   4           H        GLU   4 314.375   2.038   9.488
  657    HA   GLU   4           HA       GLU   4 312.628  -0.278   9.029
  658    HB2  GLU   4           HB2      GLU   4 311.633   1.187   7.226
  659    HB3  GLU   4           HB3      GLU   4 311.334   1.692   8.879
  660    HG2  GLU   4           HG2      GLU   4 313.738   2.897   7.876
  661    HG3  GLU   4           HG3      GLU   4 312.380   3.220   6.802
  662    H    LYS   5           H        LYS   5 312.717   0.635   6.132
  663    HA   LYS   5           HA       LYS   5 313.816   0.087   4.206
  664    HB2  LYS   5           HB2      LYS   5 316.459  -0.341   5.395
  665    HB3  LYS   5           HB3      LYS   5 315.985   0.633   4.018
  666    HG2  LYS   5           HG2      LYS   5 315.789   1.406   6.907
  667    HG3  LYS   5           HG3      LYS   5 316.927   2.018   5.721
  668    HD2  LYS   5           HD2      LYS   5 315.041   2.937   4.436
  669    HD3  LYS   5           HD3      LYS   5 313.937   2.382   5.690
  670    HE2  LYS   5           HE2      LYS   5 315.361   3.762   7.297
  671    HE3  LYS   5           HE3      LYS   5 316.051   4.504   5.857
  672    HZ1  LYS   5           HZ1      LYS   5 313.263   4.528   5.604
  673    HZ2  LYS   5           HZ2      LYS   5 314.308   5.844   5.763
  674    HZ3  LYS   5           HZ3      LYS   5 313.645   5.127   7.139
  675    HA   PRO   6           HA       PRO   6 313.556  -4.374   4.569
  676    HB2  PRO   6           HB2      PRO   6 315.052  -4.283   1.989
  677    HB3  PRO   6           HB3      PRO   6 313.572  -5.165   2.388
  678    HG2  PRO   6           HG2      PRO   6 313.452  -2.968   0.919
  679    HG3  PRO   6           HG3      PRO   6 312.243  -3.245   2.184
  680    HD2  PRO   6           HD2      PRO   6 314.628  -1.425   2.204
  681    HD3  PRO   6           HD3      PRO   6 313.002  -1.148   2.860
  682    H    LYS   7           H        LYS   7 315.034  -4.923   6.214
  683    HA   LYS   7           HA       LYS   7 317.766  -4.588   6.148
  684    HB2  LYS   7           HB2      LYS   7 317.780  -6.774   7.594
  685    HB3  LYS   7           HB3      LYS   7 317.086  -5.293   8.232
  686    HG2  LYS   7           HG2      LYS   7 315.831  -7.594   8.417
  687    HG3  LYS   7           HG3      LYS   7 314.952  -6.088   8.142
  688    HD2  LYS   7           HD2      LYS   7 314.034  -7.169   6.409
  689    HD3  LYS   7           HD3      LYS   7 315.572  -6.846   5.607
  690    HE2  LYS   7           HE2      LYS   7 315.300  -9.126   5.276
  691    HE3  LYS   7           HE3      LYS   7 316.334  -9.064   6.702
  692    HZ1  LYS   7           HZ1      LYS   7 314.819 -10.198   7.822
  693    HZ2  LYS   7           HZ2      LYS   7 313.848 -10.296   6.441
  694    HZ3  LYS   7           HZ3      LYS   7 313.648  -9.013   7.524
  695    H    GLU   8           H        GLU   8 318.197  -4.888   3.891
  696    HA   GLU   8           HA       GLU   8 319.183  -6.048   2.191
  697    HB2  GLU   8           HB2      GLU   8 319.840  -7.564   4.457
  698    HB3  GLU   8           HB3      GLU   8 319.171  -8.727   3.321
  699    HG2  GLU   8           HG2      GLU   8 321.000  -6.955   1.989
  700    HG3  GLU   8           HG3      GLU   8 321.765  -7.706   3.388
  701    H    GLY   9           H        GLY   9 316.946  -5.582   1.339
  702    HA2  GLY   9           HA2      GLY   9 315.515  -8.100   0.913
  703    HA3  GLY   9           HA3      GLY   9 314.656  -6.596   1.161
  704    H    VAL  10           H        VAL  10 317.549  -6.742  -0.600
  705    HA   VAL  10           HA       VAL  10 316.339  -5.744  -3.006
  706    HB   VAL  10           HB       VAL  10 318.528  -4.941  -2.360
  707   HG11  VAL  10          HG11      VAL  10 318.976  -7.406  -1.383
  708   HG12  VAL  10          HG12      VAL  10 320.261  -6.238  -1.708
  709   HG13  VAL  10          HG13      VAL  10 319.899  -7.501  -2.885
  710   HG21  VAL  10          HG21      VAL  10 319.226  -4.774  -4.482
  711   HG22  VAL  10          HG22      VAL  10 317.876  -5.833  -4.888
  712   HG23  VAL  10          HG23      VAL  10 319.481  -6.513  -4.622
  713    H    LYS  11           H        LYS  11 315.039  -7.250  -3.892
  714    HA   LYS  11           HA       LYS  11 315.997  -9.937  -4.390
  715    HB2  LYS  11           HB2      LYS  11 313.440  -8.523  -4.522
  716    HB3  LYS  11           HB3      LYS  11 313.680  -9.800  -5.715
  717    HG2  LYS  11           HG2      LYS  11 312.901 -11.054  -4.023
  718    HG3  LYS  11           HG3      LYS  11 314.588 -11.096  -3.615
  719    HD2  LYS  11           HD2      LYS  11 313.276 -10.657  -1.629
  720    HD3  LYS  11           HD3      LYS  11 314.267  -9.258  -2.036
  721    HE2  LYS  11           HE2      LYS  11 312.057  -8.567  -3.339
  722    HE3  LYS  11           HE3      LYS  11 311.325  -9.599  -2.114
  723    HZ1  LYS  11           HZ3      LYS  11 312.992  -7.187  -1.689
  724    H    THR  12           H        THR  12 314.364  -7.656  -6.557
  725    HA   THR  12           HA       THR  12 316.522  -8.030  -8.513
  726    HB   THR  12           HB       THR  12 314.953  -8.342 -10.289
  727    HG1  THR  12           HG1      THR  12 312.874  -8.008  -8.393
  728   HG21  THR  12          HG21      THR  12 313.979 -10.406  -9.799
  729   HG22  THR  12          HG22      THR  12 313.792 -10.009  -8.089
  730   HG23  THR  12          HG23      THR  12 315.398 -10.310  -8.755
  731    H    GLU  13           H        GLU  13 313.587  -6.155  -7.810
  732    HA   GLU  13           HA       GLU  13 314.781  -3.659  -7.720
  733    HB2  GLU  13           HB2      GLU  13 313.613  -2.904  -9.969
  734    HB3  GLU  13           HB3      GLU  13 315.277  -3.456  -9.943
  735    HG2  GLU  13           HG2      GLU  13 313.738  -5.755 -10.320
  736    HG3  GLU  13           HG3      GLU  13 312.991  -4.519 -11.328
  737    H    ASN  14           H        ASN  14 312.971  -1.894  -8.232
  738    HA   ASN  14           HA       ASN  14 311.010  -1.029  -7.463
  739    HB2  ASN  14           HB2      ASN  14 310.462  -2.680  -9.493
  740    HB3  ASN  14           HB3      ASN  14 309.483  -3.406  -8.225
  741   HD21  ASN  14          HD21      ASN  14 307.463  -2.783  -8.450
  742   HD22  ASN  14          HD22      ASN  14 306.929  -1.175  -8.790
  743    H    ASP  15           H        ASP  15 312.165  -1.703  -5.302
  744    HA   ASP  15           HA       ASP  15 310.115  -2.402  -3.497
  745    HB2  ASP  15           HB2      ASP  15 311.977  -4.560  -4.336
  746    HB3  ASP  15           HB3      ASP  15 311.622  -4.434  -2.617
  747    H    HIS  16           H        HIS  16 311.401  -0.217  -3.365
  748    HA   HIS  16           HA       HIS  16 313.372   0.888  -2.609
  749    HB2  HIS  16           HB2      HIS  16 311.594   0.352  -0.260
  750    HB3  HIS  16           HB3      HIS  16 312.693   1.686  -0.464
  751    HD1  HIS  16           HD1      HIS  16 309.282   1.131  -0.548
  752    HD2  HIS  16           HD2      HIS  16 311.911   3.123  -3.072
  753    HE1  HIS  16           HE1      HIS  16 307.856   2.728  -1.875
  754    HE2  HIS  16           HE2      HIS  16 309.455   3.848  -3.469
  755    H    ILE  17           H        ILE  17 315.232   0.861  -1.636
  756    HA   ILE  17           HA       ILE  17 315.839  -1.098   0.436
  757    HB   ILE  17           HB       ILE  17 317.915  -1.806  -0.502
  758   HG12  ILE  17          HG12      ILE  17 317.403   0.161  -2.728
  759   HG13  ILE  17          HG13      ILE  17 318.679   0.256  -1.539
  760   HG21  ILE  17          HG21      ILE  17 316.643  -2.209  -3.040
  761   HG22  ILE  17          HG22      ILE  17 315.471  -2.384  -1.734
  762   HG23  ILE  17          HG23      ILE  17 316.938  -3.362  -1.739
  763   HD11  ILE  17          HD11      ILE  17 319.989  -0.697  -3.025
  764   HD12  ILE  17          HD12      ILE  17 318.619  -1.121  -4.068
  765   HD13  ILE  17          HD13      ILE  17 319.084  -2.191  -2.742
  766    H    ASN  18           H        ASN  18 317.788  -0.441   1.683
  767    HA   ASN  18           HA       ASN  18 317.847   2.419   1.861
  768    HB2  ASN  18           HB2      ASN  18 317.929   0.429   3.680
  769    HB3  ASN  18           HB3      ASN  18 319.645   0.690   3.469
  770   HD21  ASN  18          HD21      ASN  18 319.597   1.204   5.609
  771   HD22  ASN  18          HD22      ASN  18 319.205   2.806   6.148
  772    H    LEU  19           H        LEU  19 319.488   3.653   1.033
  773    HA   LEU  19           HA       LEU  19 321.815   2.241  -0.020
  774    HB2  LEU  19           HB2      LEU  19 320.039   4.128  -1.286
  775    HB3  LEU  19           HB3      LEU  19 321.684   4.731  -1.320
  776    HG   LEU  19           HG       LEU  19 320.585   2.164  -2.491
  777   HD11  LEU  19          HD11      LEU  19 321.700   2.891  -4.515
  778   HD12  LEU  19          HD12      LEU  19 322.268   4.336  -3.687
  779   HD13  LEU  19          HD13      LEU  19 320.551   4.093  -3.949
  780   HD21  LEU  19          HD21      LEU  19 323.077   2.320  -1.180
  781   HD22  LEU  19          HD22      LEU  19 323.412   2.340  -2.905
  782   HD23  LEU  19          HD23      LEU  19 322.460   1.024  -2.214
  783    H    LYS  20           H        LYS  20 323.638   2.660   0.890
  784    HA   LYS  20           HA       LYS  20 323.865   4.869   2.765
  785    HB2  LYS  20           HB2      LYS  20 324.720   2.320   2.818
  786    HB3  LYS  20           HB3      LYS  20 326.157   3.081   2.276
  787    HG2  LYS  20           HG2      LYS  20 326.399   4.224   4.166
  788    HG3  LYS  20           HG3      LYS  20 324.706   4.122   4.605
  789    HD2  LYS  20           HD2      LYS  20 326.607   2.631   5.738
  790    HD3  LYS  20           HD3      LYS  20 324.941   2.104   5.571
  791    HE2  LYS  20           HE2      LYS  20 325.495   0.443   4.186
  792    HE3  LYS  20           HE3      LYS  20 326.600   1.462   3.259
  793    HZ1  LYS  20           HZ1      LYS  20 327.620   0.872   5.858
  794    HZ2  LYS  20           HZ2      LYS  20 328.336   0.636   4.344
  795    HZ3  LYS  20           HZ3      LYS  20 327.300  -0.539   4.981
  796    H    VAL  21           H        VAL  21 325.098   6.742   2.334
  797    HA   VAL  21           HA       VAL  21 326.809   6.678  -0.066
  798    HB   VAL  21           HB       VAL  21 325.746   9.249   1.032
  799   HG11  VAL  21          HG11      VAL  21 327.458   9.004  -0.822
  800   HG12  VAL  21          HG12      VAL  21 326.058  10.015  -1.180
  801   HG13  VAL  21          HG13      VAL  21 326.147   8.373  -1.820
  802   HG21  VAL  21          HG21      VAL  21 323.771   7.750   0.847
  803   HG22  VAL  21          HG22      VAL  21 324.166   7.486  -0.851
  804   HG23  VAL  21          HG23      VAL  21 323.721   9.098  -0.290
  805    H    ALA  22           H        ALA  22 328.943   7.028   0.366
  806    HA   ALA  22           HA       ALA  22 329.636   7.900   3.080
  807    HB1  ALA  22           HB1      ALA  22 331.931   7.056   1.630
  808    HB2  ALA  22           HB2      ALA  22 330.635   5.884   1.375
  809    HB3  ALA  22           HB3      ALA  22 331.145   6.294   3.015
  810    H    GLY  23           H        GLY  23 329.861  10.029   3.233
  811    HA2  GLY  23           HA2      GLY  23 331.083  11.517   1.024
  812    HA3  GLY  23           HA3      GLY  23 330.174  12.215   2.340
  813    H    GLN  24           H        GLN  24 332.430  13.435   1.679
  814    HA   GLN  24           HA       GLN  24 334.835  12.571   2.783
  815    HB2  GLN  24           HB2      GLN  24 334.047  15.448   2.818
  816    HB3  GLN  24           HB3      GLN  24 335.624  14.747   2.524
  817    HG2  GLN  24           HG2      GLN  24 334.536  13.768   0.403
  818    HG3  GLN  24           HG3      GLN  24 333.294  14.993   0.675
  819   HE21  GLN  24          HE21      GLN  24 334.762  17.088   1.606
  820   HE22  GLN  24          HE22      GLN  24 335.842  17.646   0.379
  821    H    ASP  25           H        ASP  25 331.992  13.395   4.385
  822    HA   ASP  25           HA       ASP  25 332.863  14.703   6.670
  823    HB2  ASP  25           HB2      ASP  25 330.842  13.725   7.761
  824    HB3  ASP  25           HB3      ASP  25 330.516  14.486   6.206
  825    H    GLY  26           H        GLY  26 333.903  11.680   5.677
  826    HA2  GLY  26           HA2      GLY  26 335.172  10.090   6.748
  827    HA3  GLY  26           HA3      GLY  26 335.254  11.185   8.126
  828    H    SER  27           H        SER  27 332.516   9.665   6.500
  829    HA   SER  27           HA       SER  27 331.977   7.756   8.532
  830    HB2  SER  27           HB2      SER  27 330.042  10.075   8.440
  831    HB3  SER  27           HB3      SER  27 330.065   8.732   9.581
  832    HG   SER  27           HG       SER  27 331.765  10.970   9.433
  833    H    VAL  28           H        VAL  28 329.085   7.924   8.108
  834    HA   VAL  28           HA       VAL  28 328.794   7.575   5.242
  835    HB   VAL  28           HB       VAL  28 329.586   5.402   5.872
  836   HG11  VAL  28          HG11      VAL  28 328.685   4.083   7.635
  837   HG12  VAL  28          HG12      VAL  28 327.390   5.245   7.923
  838   HG13  VAL  28          HG13      VAL  28 329.066   5.677   8.296
  839   HG21  VAL  28          HG21      VAL  28 326.577   5.170   5.664
  840   HG22  VAL  28          HG22      VAL  28 327.788   4.011   5.107
  841   HG23  VAL  28          HG23      VAL  28 327.625   5.570   4.303
  842    H    VAL  29           H        VAL  29 326.556   7.196   4.643
  843    HA   VAL  29           HA       VAL  29 324.591   7.837   6.698
  844    HB   VAL  29           HB       VAL  29 323.402   9.120   4.742
  845   HG11  VAL  29          HG11      VAL  29 323.516  10.576   6.380
  846   HG12  VAL  29          HG12      VAL  29 325.067  11.112   5.724
  847   HG13  VAL  29          HG13      VAL  29 325.015   9.874   6.982
  848   HG21  VAL  29          HG21      VAL  29 324.782  10.313   3.294
  849   HG22  VAL  29          HG22      VAL  29 325.336   8.644   3.216
  850   HG23  VAL  29          HG23      VAL  29 326.248   9.833   4.149
  851    H    GLN  30           H        GLN  30 322.514   7.084   6.182
  852    HA   GLN  30           HA       GLN  30 322.577   5.078   4.037
  853    HB2  GLN  30           HB2      GLN  30 321.937   4.832   6.852
  854    HB3  GLN  30           HB3      GLN  30 320.789   4.026   5.798
  855    HG2  GLN  30           HG2      GLN  30 322.995   3.105   4.699
  856    HG3  GLN  30           HG3      GLN  30 323.676   3.487   6.281
  857   HE21  GLN  30          HE21      GLN  30 322.669   2.505   8.148
  858   HE22  GLN  30          HE22      GLN  30 321.918   0.957   7.996
  859    H    PHE  31           H        PHE  31 321.356   5.618   2.500
  860    HA   PHE  31           HA       PHE  31 318.922   7.189   2.767
  861    HB2  PHE  31           HB2      PHE  31 320.538   6.177   0.398
  862    HB3  PHE  31           HB3      PHE  31 319.103   7.116   0.222
  863    HD1  PHE  31           HD1      PHE  31 321.811   7.569   2.713
  864    HD2  PHE  31           HD2      PHE  31 319.874   9.105  -0.746
  865    HE1  PHE  31           HE1      PHE  31 323.140   9.611   2.879
  866    HE2  PHE  31           HE2      PHE  31 321.227  11.148  -0.581
  867    HZ   PHE  31           HZ       PHE  31 322.860  11.405   1.231
  868    H    LYS  32           H        LYS  32 317.031   6.421   1.376
  869    HA   LYS  32           HA       LYS  32 317.043   3.534   1.021
  870    HB2  LYS  32           HB2      LYS  32 315.719   3.843   3.078
  871    HB3  LYS  32           HB3      LYS  32 314.646   4.915   2.205
  872    HG2  LYS  32           HG2      LYS  32 313.890   3.158   0.772
  873    HG3  LYS  32           HG3      LYS  32 315.147   2.078   1.358
  874    HD2  LYS  32           HD2      LYS  32 312.831   1.622   2.180
  875    HD3  LYS  32           HD3      LYS  32 314.088   1.755   3.405
  876    HE2  LYS  32           HE2      LYS  32 312.647   3.110   4.433
  877    HE3  LYS  32           HE3      LYS  32 313.202   4.318   3.277
  878    HZ1  LYS  32           HZ1      LYS  32 310.999   4.463   2.879
  879    HZ2  LYS  32           HZ2      LYS  32 310.672   2.888   3.401
  880    HZ3  LYS  32           HZ3      LYS  32 311.303   3.152   1.854
  881    H    ILE  33           H        ILE  33 316.928   3.237  -0.908
  882    HA   ILE  33           HA       ILE  33 315.115   4.784  -2.628
  883    HB   ILE  33           HB       ILE  33 317.404   5.728  -2.810
  884   HG12  ILE  33          HG12      ILE  33 317.127   4.307  -5.402
  885   HG13  ILE  33          HG13      ILE  33 315.682   5.138  -4.848
  886   HG21  ILE  33          HG21      ILE  33 319.192   4.450  -2.830
  887   HG22  ILE  33          HG22      ILE  33 318.638   3.594  -4.267
  888   HG23  ILE  33          HG23      ILE  33 318.159   3.033  -2.665
  889   HD11  ILE  33          HD11      ILE  33 316.891   6.604  -6.272
  890   HD12  ILE  33          HD12      ILE  33 318.385   6.335  -5.374
  891   HD13  ILE  33          HD13      ILE  33 317.048   7.206  -4.621
  892    H    LYS  34           H        LYS  34 314.109   3.595  -4.192
  893    HA   LYS  34           HA       LYS  34 314.058   0.803  -3.948
  894    HB2  LYS  34           HB2      LYS  34 312.157   1.970  -4.834
  895    HB3  LYS  34           HB3      LYS  34 313.112   2.628  -6.131
  896    HG2  LYS  34           HG2      LYS  34 313.417  -0.046  -6.554
  897    HG3  LYS  34           HG3      LYS  34 311.800   0.026  -5.882
  898    HD2  LYS  34           HD2      LYS  34 312.179   0.186  -8.469
  899    HD3  LYS  34           HD3      LYS  34 310.938   1.146  -7.687
  900    HE2  LYS  34           HE2      LYS  34 313.184   2.780  -7.615
  901    HE3  LYS  34           HE3      LYS  34 313.295   1.973  -9.168
  902    HZ1  LYS  34           HZ1      LYS  34 311.953   3.622  -9.810
  903    HZ2  LYS  34           HZ2      LYS  34 311.390   3.940  -8.249
  904    HZ3  LYS  34           HZ3      LYS  34 310.726   2.667  -9.141
  905    H    ARG  35           H        ARG  35 314.423   1.387  -7.251
  906    HA   ARG  35           HA       ARG  35 317.271   0.900  -7.279
  907    HB2  ARG  35           HB2      ARG  35 315.496  -1.091  -8.657
  908    HB3  ARG  35           HB3      ARG  35 317.219  -1.200  -8.342
  909    HG2  ARG  35           HG2      ARG  35 316.180  -1.026  -5.825
  910    HG3  ARG  35           HG3      ARG  35 314.948  -1.932  -6.681
  911    HD2  ARG  35           HD2      ARG  35 317.308  -3.095  -7.504
  912    HD3  ARG  35           HD3      ARG  35 317.595  -2.726  -5.813
  913    HE   ARG  35           HE       ARG  35 316.203  -4.898  -6.677
  914   HH11  ARG  35          HH11      ARG  35 315.478  -2.201  -4.561
  915   HH12  ARG  35          HH12      ARG  35 314.297  -3.081  -3.660
  916   HH21  ARG  35          HH21      ARG  35 314.659  -6.036  -5.474
  917   HH22  ARG  35          HH22      ARG  35 313.837  -5.249  -4.168
  918    H    HIS  36           H        HIS  36 314.485   0.427  -9.420
  919    HA   HIS  36           HA       HIS  36 315.751   1.329 -11.731
  920    HB2  HIS  36           HB2      HIS  36 313.874   0.536 -12.656
  921    HB3  HIS  36           HB3      HIS  36 313.255   0.243 -11.037
  922    HD1  HIS  36           HD1      HIS  36 311.079   1.307 -10.578
  923    HD2  HIS  36           HD2      HIS  36 313.180   3.326 -13.539
  924    HE1  HIS  36           HE1      HIS  36 309.537   3.128 -11.371
  925    HE2  HIS  36           HE2      HIS  36 310.795   4.281 -13.225
  926    H    THR  37           H        THR  37 314.864   3.161  -9.072
  927    HA   THR  37           HA       THR  37 314.220   5.588 -10.548
  928    HB   THR  37           HB       THR  37 314.561   4.986  -7.612
  929    HG1  THR  37           HG1      THR  37 312.424   5.848  -9.256
  930   HG21  THR  37          HG21      THR  37 315.150   7.086  -7.215
  931   HG22  THR  37          HG22      THR  37 313.554   7.561  -7.798
  932   HG23  THR  37          HG23      THR  37 314.931   7.550  -8.907
  933    HA   PRO  38           HA       PRO  38 318.325   6.733 -11.663
  934    HB2  PRO  38           HB2      PRO  38 317.130   9.374 -11.061
  935    HB3  PRO  38           HB3      PRO  38 317.975   8.816 -12.516
  936    HG2  PRO  38           HG2      PRO  38 315.222   9.047 -12.253
  937    HG3  PRO  38           HG3      PRO  38 316.053   8.073 -13.469
  938    HD2  PRO  38           HD2      PRO  38 314.446   7.260 -11.254
  939    HD3  PRO  38           HD3      PRO  38 315.202   6.255 -12.495
  940    H    LEU  39           H        LEU  39 320.150   7.257 -10.524
  941    HA   LEU  39           HA       LEU  39 319.933   7.344  -7.706
  942    HB2  LEU  39           HB2      LEU  39 322.174   7.405  -9.648
  943    HB3  LEU  39           HB3      LEU  39 322.492   7.945  -8.005
  944    HG   LEU  39           HG       LEU  39 321.268   5.272  -8.691
  945   HD11  LEU  39          HD11      LEU  39 323.318   4.263  -8.595
  946   HD12  LEU  39          HD12      LEU  39 324.051   5.574  -7.672
  947   HD13  LEU  39          HD13      LEU  39 323.738   5.777  -9.397
  948   HD21  LEU  39          HD21      LEU  39 321.126   4.870  -6.481
  949   HD22  LEU  39          HD22      LEU  39 321.138   6.629  -6.341
  950   HD23  LEU  39          HD23      LEU  39 322.631   5.715  -6.123
  951    H    SER  40           H        SER  40 319.922   9.877 -10.092
  952    HA   SER  40           HA       SER  40 321.001  11.971  -8.607
  953    HB2  SER  40           HB2      SER  40 320.538  12.908 -10.604
  954    HB3  SER  40           HB3      SER  40 319.369  11.646 -10.991
  955    HG   SER  40           HG       SER  40 317.779  12.868 -10.251
  956    H    LYS  41           H        LYS  41 318.261  10.091  -7.989
  957    HA   LYS  41           HA       LYS  41 316.708  12.047  -6.599
  958    HB2  LYS  41           HB2      LYS  41 316.596   9.181  -7.243
  959    HB3  LYS  41           HB3      LYS  41 315.718   9.704  -5.834
  960    HG2  LYS  41           HG2      LYS  41 314.083   9.954  -7.372
  961    HG3  LYS  41           HG3      LYS  41 314.836  11.529  -7.548
  962    HD2  LYS  41           HD2      LYS  41 315.818  11.000  -9.551
  963    HD3  LYS  41           HD3      LYS  41 315.862   9.271  -9.194
  964    HE2  LYS  41           HE2      LYS  41 314.205  10.104 -10.966
  965    HE3  LYS  41           HE3      LYS  41 313.631   8.977  -9.741
  966    HZ1  LYS  41           HZ1      LYS  41 313.363  11.842  -9.211
  967    HZ2  LYS  41           HZ2      LYS  41 312.363  10.562  -8.740
  968    HZ3  LYS  41           HZ3      LYS  41 312.303  11.142 -10.328
  969    H    LEU  42           H        LEU  42 319.181   9.716  -6.014
  970    HA   LEU  42           HA       LEU  42 318.988   9.759  -3.139
  971    HB2  LEU  42           HB2      LEU  42 319.467   7.708  -4.417
  972    HB3  LEU  42           HB3      LEU  42 320.937   8.441  -5.027
  973    HG   LEU  42           HG       LEU  42 320.569   8.154  -2.090
  974   HD11  LEU  42          HD11      LEU  42 320.301   5.965  -2.302
  975   HD12  LEU  42          HD12      LEU  42 321.999   5.952  -2.776
  976   HD13  LEU  42          HD13      LEU  42 320.739   5.987  -4.010
  977   HD21  LEU  42          HD21      LEU  42 322.783   8.501  -4.037
  978   HD22  LEU  42          HD22      LEU  42 323.113   7.629  -2.538
  979   HD23  LEU  42          HD23      LEU  42 322.518   9.290  -2.480
  980    H    MET  43           H        MET  43 321.115  10.920  -5.690
  981    HA   MET  43           HA       MET  43 323.268  11.740  -4.135
  982    HB2  MET  43           HB2      MET  43 322.370  12.109  -6.867
  983    HB3  MET  43           HB3      MET  43 323.273  13.493  -6.266
  984    HG2  MET  43           HG2      MET  43 325.165  12.155  -5.777
  985    HG3  MET  43           HG3      MET  43 324.260  10.668  -6.038
  986    HE1  MET  43           HE1      MET  43 326.181   9.776  -8.722
  987    HE2  MET  43           HE2      MET  43 324.455   9.538  -9.010
  988    HE3  MET  43           HE3      MET  43 325.099   9.423  -7.370
  989    H    LYS  44           H        LYS  44 320.278  13.528  -4.782
  990    HA   LYS  44           HA       LYS  44 321.404  15.994  -3.753
  991    HB2  LYS  44           HB2      LYS  44 319.635  16.015  -5.446
  992    HB3  LYS  44           HB3      LYS  44 318.510  15.367  -4.268
  993    HG2  LYS  44           HG2      LYS  44 318.761  17.974  -4.800
  994    HG3  LYS  44           HG3      LYS  44 318.237  17.368  -3.251
  995    HD2  LYS  44           HD2      LYS  44 319.884  18.539  -2.343
  996    HD3  LYS  44           HD3      LYS  44 321.027  17.484  -3.149
  997    HE2  LYS  44           HE2      LYS  44 321.668  19.593  -3.850
  998    HE3  LYS  44           HE3      LYS  44 320.695  18.988  -5.188
  999    HZ1  LYS  44           HZ1      LYS  44 318.841  20.199  -3.692
 1000    HZ2  LYS  44           HZ2      LYS  44 319.662  20.952  -4.964
 1001    HZ3  LYS  44           HZ3      LYS  44 320.180  21.183  -3.371
 1002    H    ALA  45           H        ALA  45 319.887  13.226  -2.371
 1003    HA   ALA  45           HA       ALA  45 318.747  14.429  -0.068
 1004    HB1  ALA  45           HB1      ALA  45 319.421  11.716  -0.878
 1005    HB2  ALA  45           HB2      ALA  45 318.124  12.289   0.171
 1006    HB3  ALA  45           HB3      ALA  45 319.740  12.007   0.839
 1007    H    TYR  46           H        TYR  46 321.864  12.859  -0.618
 1008    HA   TYR  46           HA       TYR  46 323.093  13.378   1.769
 1009    HB2  TYR  46           HB2      TYR  46 323.926  12.204  -0.490
 1010    HB3  TYR  46           HB3      TYR  46 324.733  13.756  -0.698
 1011    HD1  TYR  46           HD2      TYR  46 324.228  12.656   2.686
 1012    HD2  TYR  46           HD1      TYR  46 326.893  12.472  -0.605
 1013    HE1  TYR  46           HE2      TYR  46 325.979  11.895   4.188
 1014    HE2  TYR  46           HE1      TYR  46 328.682  11.697   0.895
 1015    HH   TYR  46           HH       TYR  46 328.080  10.701   4.116
 1016    H    CYS  47           H        CYS  47 322.729  15.555  -1.054
 1017    HA   CYS  47           HA       CYS  47 324.333  17.638  -0.130
 1018    HB2  CYS  47           HB2      CYS  47 321.826  17.700  -1.801
 1019    HB3  CYS  47           HB3      CYS  47 323.095  18.889  -1.817
 1020    HG   CYS  47           HG       CYS  47 324.542  17.372  -3.180
 1021    H    GLU  48           H        GLU  48 320.759  17.502  -0.299
 1022    HA   GLU  48           HA       GLU  48 320.200  19.650   1.317
 1023    HB2  GLU  48           HB2      GLU  48 318.542  17.142   1.445
 1024    HB3  GLU  48           HB3      GLU  48 318.004  18.811   1.554
 1025    HG2  GLU  48           HG2      GLU  48 318.561  19.118  -0.850
 1026    HG3  GLU  48           HG3      GLU  48 319.031  17.435  -0.916
 1027    H    ARG  49           H        ARG  49 321.484  16.593   2.087
 1028    HA   ARG  49           HA       ARG  49 320.971  16.458   4.885
 1029    HB2  ARG  49           HB2      ARG  49 322.062  14.864   2.807
 1030    HB3  ARG  49           HB3      ARG  49 323.286  15.015   4.033
 1031    HG2  ARG  49           HG2      ARG  49 321.506  14.239   5.651
 1032    HG3  ARG  49           HG3      ARG  49 320.578  13.803   4.201
 1033    HD2  ARG  49           HD2      ARG  49 321.903  11.904   4.845
 1034    HD3  ARG  49           HD3      ARG  49 322.548  12.567   3.369
 1035    HE   ARG  49           HE       ARG  49 324.489  12.921   4.519
 1036   HH11  ARG  49          HH11      ARG  49 321.885  12.827   6.836
 1037   HH12  ARG  49          HH12      ARG  49 322.917  13.126   8.192
 1038   HH21  ARG  49          HH21      ARG  49 325.850  13.304   6.302
 1039   HH22  ARG  49          HH22      ARG  49 325.167  13.394   7.891
 1040    H    GLN  50           H        GLN  50 323.898  17.064   2.924
 1041    HA   GLN  50           HA       GLN  50 325.311  18.136   5.255
 1042    HB2  GLN  50           HB2      GLN  50 326.498  17.567   2.591
 1043    HB3  GLN  50           HB3      GLN  50 327.322  17.679   4.112
 1044    HG2  GLN  50           HG2      GLN  50 326.245  15.579   4.809
 1045    HG3  GLN  50           HG3      GLN  50 325.500  15.475   3.217
 1046   HE21  GLN  50          HE21      GLN  50 326.591  14.565   1.621
 1047   HE22  GLN  50          HE22      GLN  50 328.258  14.125   1.656
 1048    H    GLY  51           H        GLY  51 323.904  19.108   2.295
 1049    HA2  GLY  51           HA2      GLY  51 323.548  21.329   1.589
 1050    HA3  GLY  51           HA3      GLY  51 324.827  21.853   2.688
 1051    H    LEU  52           H        LEU  52 324.500  19.563  -0.007
 1052    HA   LEU  52           HA       LEU  52 327.047  20.567  -1.108
 1053    HB2  LEU  52           HB2      LEU  52 325.851  17.858  -1.599
 1054    HB3  LEU  52           HB3      LEU  52 327.480  18.405  -1.925
 1055    HG   LEU  52           HG       LEU  52 326.696  18.556   0.889
 1056   HD11  LEU  52          HD11      LEU  52 326.268  16.411   1.316
 1057   HD12  LEU  52          HD12      LEU  52 327.435  15.842   0.116
 1058   HD13  LEU  52          HD13      LEU  52 325.814  16.324  -0.395
 1059   HD21  LEU  52          HD21      LEU  52 329.041  17.193  -0.345
 1060   HD22  LEU  52          HD22      LEU  52 328.916  18.034   1.207
 1061   HD23  LEU  52          HD23      LEU  52 328.915  18.960  -0.310
 1062    H    SER  53           H        SER  53 327.128  21.125  -3.232
 1063    HA   SER  53           HA       SER  53 324.657  21.386  -4.660
 1064    HB2  SER  53           HB2      SER  53 326.844  21.541  -6.485
 1065    HB3  SER  53           HB3      SER  53 325.885  22.867  -5.835
 1066    HG   SER  53           HG       SER  53 327.460  23.354  -4.522
 1067    H    MET  54           H        MET  54 323.759  19.348  -4.827
 1068    HA   MET  54           HA       MET  54 324.652  16.922  -5.136
 1069    HB2  MET  54           HB2      MET  54 322.274  17.803  -5.297
 1070    HB3  MET  54           HB3      MET  54 322.517  17.908  -7.016
 1071    HG2  MET  54           HG2      MET  54 323.373  15.433  -6.619
 1072    HG3  MET  54           HG3      MET  54 322.233  15.597  -5.300
 1073    HE1  MET  54           HE1      MET  54 322.580  15.444  -9.302
 1074    HE2  MET  54           HE2      MET  54 322.377  17.125  -8.806
 1075    HE3  MET  54           HE3      MET  54 321.095  16.308  -9.700
 1076    H    ARG  55           H        ARG  55 324.908  19.285  -7.654
 1077    HA   ARG  55           HA       ARG  55 325.756  17.400  -9.655
 1078    HB2  ARG  55           HB2      ARG  55 326.476  19.926 -10.545
 1079    HB3  ARG  55           HB3      ARG  55 324.959  19.106 -10.889
 1080    HG2  ARG  55           HG2      ARG  55 323.872  20.209  -9.046
 1081    HG3  ARG  55           HG3      ARG  55 325.404  20.915  -8.522
 1082    HD2  ARG  55           HD2      ARG  55 323.757  21.586 -10.937
 1083    HD3  ARG  55           HD3      ARG  55 324.334  22.651  -9.654
 1084    HE   ARG  55           HE       ARG  55 325.763  21.845 -12.017
 1085   HH11  ARG  55          HH11      ARG  55 326.066  23.021  -8.745
 1086   HH12  ARG  55          HH12      ARG  55 327.629  23.720  -9.008
 1087   HH21  ARG  55          HH21      ARG  55 327.820  22.762 -12.364
 1088   HH22  ARG  55          HH22      ARG  55 328.625  23.573 -11.061
 1089    H    GLN  56           H        GLN  56 327.190  19.633  -7.376
 1090    HA   GLN  56           HA       GLN  56 329.802  19.638  -8.370
 1091    HB2  GLN  56           HB2      GLN  56 328.334  20.507  -5.964
 1092    HB3  GLN  56           HB3      GLN  56 330.081  20.328  -5.790
 1093    HG2  GLN  56           HG2      GLN  56 330.185  21.756  -7.953
 1094    HG3  GLN  56           HG3      GLN  56 328.535  22.205  -7.523
 1095   HE21  GLN  56          HE21      GLN  56 328.518  24.117  -6.600
 1096   HE22  GLN  56          HE22      GLN  56 329.649  24.699  -5.432
 1097    H    ILE  57           H        ILE  57 328.232  17.530  -5.940
 1098    HA   ILE  57           HA       ILE  57 330.724  16.446  -5.072
 1099    HB   ILE  57           HB       ILE  57 329.322  14.547  -4.128
 1100   HG12  ILE  57          HG12      ILE  57 327.275  16.140  -5.484
 1101   HG13  ILE  57          HG13      ILE  57 327.258  14.448  -4.997
 1102   HG21  ILE  57          HG21      ILE  57 328.615  17.264  -3.095
 1103   HG22  ILE  57          HG22      ILE  57 330.196  16.514  -2.864
 1104   HG23  ILE  57          HG23      ILE  57 328.751  15.751  -2.187
 1105   HD11  ILE  57          HD11      ILE  57 326.744  16.834  -3.264
 1106   HD12  ILE  57          HD12      ILE  57 326.843  15.164  -2.688
 1107   HD13  ILE  57          HD13      ILE  57 325.566  15.634  -3.813
 1108    H    ARG  58           H        ARG  58 331.157  14.075  -5.198
 1109    HA   ARG  58           HA       ARG  58 330.546  13.074  -7.883
 1110    HB2  ARG  58           HB2      ARG  58 333.108  12.205  -6.808
 1111    HB3  ARG  58           HB3      ARG  58 332.712  12.854  -8.395
 1112    HG2  ARG  58           HG2      ARG  58 332.985  14.593  -5.966
 1113    HG3  ARG  58           HG3      ARG  58 334.346  14.174  -6.993
 1114    HD2  ARG  58           HD2      ARG  58 333.268  15.199  -8.883
 1115    HD3  ARG  58           HD3      ARG  58 331.830  15.524  -7.933
 1116    HE   ARG  58           HE       ARG  58 333.923  16.750  -6.627
 1117   HH11  ARG  58          HH11      ARG  58 332.461  16.958  -9.787
 1118   HH12  ARG  58          HH12      ARG  58 332.891  18.620 -10.014
 1119   HH21  ARG  58          HH21      ARG  58 334.490  18.938  -6.922
 1120   HH22  ARG  58          HH22      ARG  58 334.043  19.744  -8.388
 1121    H    PHE  59           H        PHE  59 329.442  11.205  -7.690
 1122    HA   PHE  59           HA       PHE  59 329.739   9.714  -5.190
 1123    HB2  PHE  59           HB2      PHE  59 327.574   9.794  -7.264
 1124    HB3  PHE  59           HB3      PHE  59 327.703   8.453  -6.155
 1125    HD1  PHE  59           HD1      PHE  59 328.395  11.995  -5.316
 1126    HD2  PHE  59           HD2      PHE  59 325.709   8.711  -5.000
 1127    HE1  PHE  59           HE1      PHE  59 327.075  13.225  -3.639
 1128    HE2  PHE  59           HE2      PHE  59 324.390   9.939  -3.335
 1129    HZ   PHE  59           HZ       PHE  59 325.072  12.206  -2.655
 1130    H    ARG  60           H        ARG  60 329.783   7.458  -5.203
 1131    HA   ARG  60           HA       ARG  60 330.453   6.047  -7.629
 1132    HB2  ARG  60           HB2      ARG  60 332.625   6.958  -6.283
 1133    HB3  ARG  60           HB3      ARG  60 332.331   5.471  -5.405
 1134    HG2  ARG  60           HG2      ARG  60 332.165   4.483  -7.840
 1135    HG3  ARG  60           HG3      ARG  60 333.170   5.876  -8.215
 1136    HD2  ARG  60           HD2      ARG  60 334.723   5.152  -6.404
 1137    HD3  ARG  60           HD3      ARG  60 333.745   3.698  -6.220
 1138    HE   ARG  60           HE       ARG  60 334.408   3.767  -8.874
 1139   HH11  ARG  60          HH11      ARG  60 336.192   3.753  -5.874
 1140   HH12  ARG  60          HH12      ARG  60 337.559   2.930  -6.547
 1141   HH21  ARG  60          HH21      ARG  60 336.205   2.685  -9.759
 1142   HH22  ARG  60          HH22      ARG  60 337.567   2.324  -8.752
 1143    H    PHE  61           H        PHE  61 329.656   4.001  -7.517
 1144    HA   PHE  61           HA       PHE  61 328.506   3.234  -4.947
 1145    HB2  PHE  61           HB2      PHE  61 326.785   3.080  -6.507
 1146    HB3  PHE  61           HB3      PHE  61 327.828   2.474  -7.781
 1147    HD1  PHE  61           HD1      PHE  61 326.467   1.573  -4.440
 1148    HD2  PHE  61           HD2      PHE  61 327.854   0.201  -8.228
 1149    HE1  PHE  61           HE1      PHE  61 325.807  -0.734  -3.864
 1150    HE2  PHE  61           HE2      PHE  61 327.189  -2.097  -7.655
 1151    HZ   PHE  61           HZ       PHE  61 326.164  -2.565  -5.465
 1152    H    ASP  62           H        ASP  62 328.858   0.929  -4.255
 1153    HA   ASP  62           HA       ASP  62 331.406   0.320  -3.848
 1154    HB2  ASP  62           HB2      ASP  62 328.970  -1.310  -4.035
 1155    HB3  ASP  62           HB3      ASP  62 330.474  -2.208  -4.157
 1156    H    GLY  63           H        GLY  63 333.061   0.186  -5.043
 1157    HA2  GLY  63           HA2      GLY  63 334.551  -0.329  -6.660
 1158    HA3  GLY  63           HA3      GLY  63 333.559  -1.737  -6.997
 1159    H    GLN  64           H        GLN  64 331.391   0.548  -7.661
 1160    HA   GLN  64           HA       GLN  64 332.487   1.047 -10.338
 1161    HB2  GLN  64           HB2      GLN  64 330.895  -0.230 -11.203
 1162    HB3  GLN  64           HB3      GLN  64 330.143  -0.438  -9.628
 1163    HG2  GLN  64           HG2      GLN  64 329.127   1.862 -10.044
 1164    HG3  GLN  64           HG3      GLN  64 329.569   1.637 -11.714
 1165   HE21  GLN  64          HE21      GLN  64 327.596   1.429 -12.581
 1166   HE22  GLN  64          HE22      GLN  64 326.506   0.151 -12.201
 1167    HA   PRO  65           HA       PRO  65 331.242   5.262  -9.877
 1168    HB2  PRO  65           HB2      PRO  65 331.181   5.513 -12.753
 1169    HB3  PRO  65           HB3      PRO  65 332.476   6.007 -11.664
 1170    HG2  PRO  65           HG2      PRO  65 332.742   4.015 -13.479
 1171    HG3  PRO  65           HG3      PRO  65 333.576   3.986 -11.909
 1172    HD2  PRO  65           HD2      PRO  65 330.956   2.700 -12.658
 1173    HD3  PRO  65           HD3      PRO  65 332.365   1.968 -11.896
 1174    H    ILE  66           H        ILE  66 329.595   6.852 -11.008
 1175    HA   ILE  66           HA       ILE  66 327.322   5.546 -12.159
 1176    HB   ILE  66           HB       ILE  66 325.690   6.180 -10.530
 1177   HG12  ILE  66          HG12      ILE  66 328.043   7.480  -9.234
 1178   HG13  ILE  66          HG13      ILE  66 326.395   8.026  -9.398
 1179   HG21  ILE  66          HG21      ILE  66 327.796   4.735  -8.969
 1180   HG22  ILE  66          HG22      ILE  66 327.142   4.012 -10.439
 1181   HG23  ILE  66          HG23      ILE  66 326.068   4.406  -9.093
 1182   HD11  ILE  66          HD11      ILE  66 326.016   5.932  -7.761
 1183   HD12  ILE  66          HD12      ILE  66 326.312   7.576  -7.197
 1184   HD13  ILE  66          HD13      ILE  66 327.642   6.419  -7.286
 1185    H    ASN  67           H        ASN  67 325.429   7.379 -12.182
 1186    HA   ASN  67           HA       ASN  67 326.477  10.031 -12.658
 1187    HB2  ASN  67           HB2      ASN  67 325.409   8.471 -14.996
 1188    HB3  ASN  67           HB3      ASN  67 325.974  10.134 -15.030
 1189   HD21  ASN  67          HD21      ASN  67 326.900   6.790 -14.857
 1190   HD22  ASN  67          HD22      ASN  67 328.577   7.026 -15.197
 1191    H    GLU  68           H        GLU  68 324.693   9.585 -10.939
 1192    HA   GLU  68           HA       GLU  68 322.543   9.775 -10.191
 1193    HB2  GLU  68           HB2      GLU  68 321.809  11.995 -11.844
 1194    HB3  GLU  68           HB3      GLU  68 322.223  11.948 -10.136
 1195    HG2  GLU  68           HG2      GLU  68 324.467  12.343 -10.543
 1196    HG3  GLU  68           HG3      GLU  68 324.330  11.891 -12.233
 1197    H    THR  69           H        THR  69 322.756   8.749 -13.377
 1198    HA   THR  69           HA       THR  69 319.834   8.685 -13.641
 1199    HB   THR  69           HB       THR  69 320.109   8.601 -16.026
 1200    HG1  THR  69           HG1      THR  69 322.908   8.688 -15.578
 1201   HG21  THR  69          HG21      THR  69 322.084  10.698 -15.275
 1202   HG22  THR  69          HG22      THR  69 320.412  10.818 -14.726
 1203   HG23  THR  69          HG23      THR  69 320.770  10.753 -16.452
 1204    H    ASP  70           H        ASP  70 322.697   6.807 -13.362
 1205    HA   ASP  70           HA       ASP  70 322.163   4.406 -14.559
 1206    HB2  ASP  70           HB2      ASP  70 323.520   5.232 -12.047
 1207    HB3  ASP  70           HB3      ASP  70 323.202   3.521 -12.281
 1208    H    THR  71           H        THR  71 321.626   4.685 -11.165
 1209    HA   THR  71           HA       THR  71 319.641   4.585  -9.953
 1210    HB   THR  71           HB       THR  71 317.733   3.423 -10.606
 1211    HG1  THR  71           HG1      THR  71 318.747   2.314 -12.946
 1212   HG21  THR  71          HG21      THR  71 317.869   3.985 -13.359
 1213   HG22  THR  71          HG22      THR  71 318.745   5.267 -12.522
 1214   HG23  THR  71          HG23      THR  71 317.072   4.912 -12.090
 1215    HA   PRO  72           HA       PRO  72 321.760   1.417  -7.868
 1216    HB2  PRO  72           HB2      PRO  72 319.186   0.628  -6.630
 1217    HB3  PRO  72           HB3      PRO  72 320.711   1.131  -5.882
 1218    HG2  PRO  72           HG2      PRO  72 318.483   2.729  -6.058
 1219    HG3  PRO  72           HG3      PRO  72 320.142   3.318  -5.864
 1220    HD2  PRO  72           HD2      PRO  72 318.367   3.454  -8.177
 1221    HD3  PRO  72           HD3      PRO  72 319.852   4.361  -7.835
 1222    H    ALA  73           H        ALA  73 318.624   0.825  -9.256
 1223    HA   ALA  73           HA       ALA  73 318.761  -1.940  -9.666
 1224    HB1  ALA  73           HB1      ALA  73 316.656  -1.241 -10.166
 1225    HB2  ALA  73           HB2      ALA  73 317.318  -1.201 -11.800
 1226    HB3  ALA  73           HB3      ALA  73 317.219   0.280 -10.857
 1227    H    GLN  74           H        GLN  74 319.484   0.687 -12.079
 1228    HA   GLN  74           HA       GLN  74 320.295  -0.951 -14.088
 1229    HB2  GLN  74           HB2      GLN  74 320.515   1.775 -13.382
 1230    HB3  GLN  74           HB3      GLN  74 321.937   1.276 -14.233
 1231    HG2  GLN  74           HG2      GLN  74 320.589   0.460 -16.061
 1232    HG3  GLN  74           HG3      GLN  74 319.124   0.917 -15.193
 1233   HE21  GLN  74          HE21      GLN  74 318.272   2.773 -15.780
 1234   HE22  GLN  74          HE22      GLN  74 319.112   4.109 -16.484
 1235    H    LEU  75           H        LEU  75 322.115   0.065 -11.300
 1236    HA   LEU  75           HA       LEU  75 324.543  -1.140 -12.300
 1237    HB2  LEU  75           HB2      LEU  75 324.079   0.163  -9.628
 1238    HB3  LEU  75           HB3      LEU  75 325.593   0.012 -10.504
 1239    HG   LEU  75           HG       LEU  75 323.278   1.873 -11.102
 1240   HD11  LEU  75          HD11      LEU  75 324.753   2.853  -9.585
 1241   HD12  LEU  75          HD12      LEU  75 325.247   3.488 -11.155
 1242   HD13  LEU  75          HD13      LEU  75 326.174   2.194 -10.395
 1243   HD21  LEU  75          HD21      LEU  75 323.706   1.880 -13.265
 1244   HD22  LEU  75          HD22      LEU  75 324.843   0.550 -13.046
 1245   HD23  LEU  75          HD23      LEU  75 325.413   2.213 -12.959
 1246    H    GLU  76           H        GLU  76 321.906  -1.814 -10.202
 1247    HA   GLU  76           HA       GLU  76 321.209  -3.771  -9.375
 1248    HB2  GLU  76           HB2      GLU  76 323.956  -4.858  -9.980
 1249    HB3  GLU  76           HB3      GLU  76 322.588  -5.800  -9.408
 1250    HG2  GLU  76           HG2      GLU  76 321.364  -5.395 -11.402
 1251    HG3  GLU  76           HG3      GLU  76 322.545  -4.211 -11.956
 1252    H    MET  77           H        MET  77 322.217  -1.662  -7.873
 1253    HA   MET  77           HA       MET  77 323.918  -2.294  -5.754
 1254    HB2  MET  77           HB2      MET  77 321.522  -0.488  -5.965
 1255    HB3  MET  77           HB3      MET  77 322.532  -0.535  -4.519
 1256    HG2  MET  77           HG2      MET  77 324.427  -0.263  -6.382
 1257    HG3  MET  77           HG3      MET  77 323.099   0.529  -7.214
 1258    HE1  MET  77           HE1      MET  77 324.482   2.446  -7.445
 1259    HE2  MET  77           HE2      MET  77 324.495   3.769  -6.280
 1260    HE3  MET  77           HE3      MET  77 322.960   3.203  -6.957
 1261    H    GLU  78           H        GLU  78 322.710  -2.155  -3.368
 1262    HA   GLU  78           HA       GLU  78 320.571  -4.088  -3.198
 1263    HB2  GLU  78           HB2      GLU  78 323.394  -4.635  -2.365
 1264    HB3  GLU  78           HB3      GLU  78 322.069  -5.330  -1.448
 1265    HG2  GLU  78           HG2      GLU  78 321.765  -6.912  -2.956
 1266    HG3  GLU  78           HG3      GLU  78 321.678  -5.743  -4.264
 1267    H    ASP  79           H        ASP  79 320.156  -4.474  -0.729
 1268    HA   ASP  79           HA       ASP  79 319.667  -1.935   0.410
 1269    HB2  ASP  79           HB2      ASP  79 318.867  -4.609   0.911
 1270    HB3  ASP  79           HB3      ASP  79 319.496  -3.953   2.419
 1271    H    GLU  80           H        GLU  80 320.813  -0.703   1.712
 1272    HA   GLU  80           HA       GLU  80 322.349   0.004   3.236
 1273    HB2  GLU  80           HB2      GLU  80 323.407  -2.787   3.519
 1274    HB3  GLU  80           HB3      GLU  80 323.496  -1.460   4.664
 1275    HG2  GLU  80           HG2      GLU  80 321.021  -1.559   4.889
 1276    HG3  GLU  80           HG3      GLU  80 321.042  -3.001   3.882
 1277    H    ASP  81           H        ASP  81 322.984  -1.195   0.236
 1278    HA   ASP  81           HA       ASP  81 325.763  -1.370   0.146
 1279    HB2  ASP  81           HB2      ASP  81 323.804  -0.389  -1.952
 1280    HB3  ASP  81           HB3      ASP  81 325.510  -0.613  -2.262
 1281    H    THR  82           H        THR  82 327.207   0.313  -0.734
 1282    HA   THR  82           HA       THR  82 326.397   2.943   0.299
 1283    HB   THR  82           HB       THR  82 329.278   2.157   0.189
 1284    HG1  THR  82           HG1      THR  82 329.093   1.327   2.264
 1285   HG21  THR  82          HG21      THR  82 328.477   4.511   0.690
 1286   HG22  THR  82          HG22      THR  82 329.571   3.773   1.867
 1287   HG23  THR  82          HG23      THR  82 327.836   3.850   2.205
 1288    H    ILE  83           H        ILE  83 327.266   4.822  -0.723
 1289    HA   ILE  83           HA       ILE  83 328.385   4.415  -3.392
 1290    HB   ILE  83           HB       ILE  83 326.053   6.170  -2.604
 1291   HG12  ILE  83          HG12      ILE  83 326.281   4.208  -4.882
 1292   HG13  ILE  83          HG13      ILE  83 325.681   3.766  -3.286
 1293   HG21  ILE  83          HG21      ILE  83 327.898   6.331  -4.975
 1294   HG22  ILE  83          HG22      ILE  83 327.288   7.632  -3.954
 1295   HG23  ILE  83          HG23      ILE  83 326.219   6.849  -5.121
 1296   HD11  ILE  83          HD11      ILE  83 323.779   4.200  -4.514
 1297   HD12  ILE  83          HD12      ILE  83 324.484   5.615  -5.290
 1298   HD13  ILE  83          HD13      ILE  83 324.031   5.675  -3.583
 1299    H    ASP  84           H        ASP  84 330.433   5.237  -2.835
 1300    HA   ASP  84           HA       ASP  84 330.801   7.185  -0.898
 1301    HB2  ASP  84           HB2      ASP  84 332.866   6.418  -1.036
 1302    HB3  ASP  84           HB3      ASP  84 332.393   5.491  -2.448
 1303    H    VAL  85           H        VAL  85 330.964   9.260  -0.833
 1304    HA   VAL  85           HA       VAL  85 330.716  10.911  -3.273
 1305    HB   VAL  85           HB       VAL  85 329.976  11.511  -0.403
 1306   HG11  VAL  85          HG11      VAL  85 330.739  13.579  -1.214
 1307   HG12  VAL  85          HG12      VAL  85 328.985  13.641  -1.418
 1308   HG13  VAL  85          HG13      VAL  85 330.030  13.310  -2.805
 1309   HG21  VAL  85          HG21      VAL  85 328.524  10.317  -2.495
 1310   HG22  VAL  85          HG22      VAL  85 327.858  11.928  -2.211
 1311   HG23  VAL  85          HG23      VAL  85 327.977  10.773  -0.880
 1312    H    PHE  86           H        PHE  86 332.526  12.071  -3.776
 1313    HA   PHE  86           HA       PHE  86 334.271  12.918  -1.594
 1314    HB2  PHE  86           HB2      PHE  86 335.030  11.087  -3.808
 1315    HB3  PHE  86           HB3      PHE  86 336.159  12.384  -3.426
 1316    HD1  PHE  86           HD2      PHE  86 336.006  12.616  -0.555
 1317    HD2  PHE  86           HD1      PHE  86 335.923   9.127  -2.990
 1318    HE1  PHE  86           HE2      PHE  86 336.899  11.293   1.318
 1319    HE2  PHE  86           HE1      PHE  86 336.816   7.797  -1.121
 1320    HZ   PHE  86           HZ       PHE  86 337.305   8.881   1.036
 1321    H    GLN  87           H        GLN  87 334.016  14.981  -1.781
 1322    HA   GLN  87           HA       GLN  87 334.673  16.274  -4.314
 1323    HB2  GLN  87           HB2      GLN  87 332.146  15.829  -3.981
 1324    HB3  GLN  87           HB3      GLN  87 332.206  17.163  -2.848
 1325    HG2  GLN  87           HG2      GLN  87 333.505  17.898  -5.302
 1326    HG3  GLN  87           HG3      GLN  87 331.912  17.252  -5.623
 1327   HE21  GLN  87          HE21      GLN  87 330.166  18.105  -3.980
 1328   HE22  GLN  87          HE22      GLN  87 330.209  19.818  -3.738
 1329    H    GLN  88           H        GLN  88 336.260  17.637  -3.846
 1330    HA   GLN  88           HA       GLN  88 336.560  18.754  -1.205
 1331    HB2  GLN  88           HB2      GLN  88 338.161  19.028  -3.739
 1332    HB3  GLN  88           HB3      GLN  88 338.569  19.877  -2.255
 1333    HG2  GLN  88           HG2      GLN  88 338.246  16.903  -2.293
 1334    HG3  GLN  88           HG3      GLN  88 339.758  17.664  -2.788
 1335   HE21  GLN  88          HE21      GLN  88 337.636  16.946  -0.153
 1336   HE22  GLN  88          HE22      GLN  88 338.705  17.427   1.116
 1337    H    GLN  89           H        GLN  89 336.042  20.758  -0.543
 1338    HA   GLN  89           HA       GLN  89 334.725  22.507  -2.491
 1339    HB2  GLN  89           HB2      GLN  89 334.548  22.216   0.489
 1340    HB3  GLN  89           HB3      GLN  89 334.036  23.711  -0.281
 1341    HG2  GLN  89           HG2      GLN  89 332.439  22.469  -1.643
 1342    HG3  GLN  89           HG3      GLN  89 332.956  20.966  -0.880
 1343   HE21  GLN  89          HE21      GLN  89 332.649  20.798   1.450
 1344   HE22  GLN  89          HE22      GLN  89 331.290  21.583   2.173
 1345    H    THR  90           H        THR  90 335.124  24.791  -2.457
 1346    HA   THR  90           HA       THR  90 337.432  25.803  -1.057
 1347    HB   THR  90           HB       THR  90 338.522  26.540  -3.240
 1348    HG1  THR  90           HG1      THR  90 338.031  25.184  -5.027
 1349   HG21  THR  90          HG21      THR  90 339.430  24.705  -1.844
 1350   HG22  THR  90          HG22      THR  90 339.759  24.527  -3.568
 1351   HG23  THR  90          HG23      THR  90 338.490  23.566  -2.808
 1352    H1   THR   2           HT1      THR   2 319.602   6.395  10.515
 1353    H2   THR   2           HT2      THR   2 318.301   7.504  10.356
 1354    H3   THR   2           HT3      THR   2 318.981   7.191  11.900
 1355    HA   THR   2           HA       THR   2 320.926   8.280  11.408
 1356    HB   THR   2           HB       THR   2 319.949   8.414   8.548
 1357    HG1  THR   2           HG1      THR   2 321.635   6.898   8.184
 1358   HG21  THR   2          HG21      THR   2 322.123   9.194   7.962
 1359   HG22  THR   2          HG22      THR   2 322.686   9.029   9.625
 1360   HG23  THR   2          HG23      THR   2 321.477  10.248   9.220
 1361    H    VAL   3           H        VAL   3 321.219  10.583  11.290
 1362    HA   VAL   3           HA       VAL   3 318.759  12.016  11.806
 1363    HB   VAL   3           HB       VAL   3 320.232  13.915  12.380
 1364   HG11  VAL   3          HG11      VAL   3 321.414  11.559  13.770
 1365   HG12  VAL   3          HG12      VAL   3 319.679  11.850  13.899
 1366   HG13  VAL   3          HG13      VAL   3 320.822  13.081  14.435
 1367   HG21  VAL   3          HG21      VAL   3 322.507  12.032  11.767
 1368   HG22  VAL   3          HG22      VAL   3 322.633  13.682  12.378
 1369   HG23  VAL   3          HG23      VAL   3 322.021  13.388  10.750
 1370    H    GLY   4           H        GLY   4 318.069  13.891  10.715
 1371    HA2  GLY   4           HA2      GLY   4 318.168  15.501   8.979
 1372    HA3  GLY   4           HA3      GLY   4 319.383  14.521   8.173
 1373    H    ASP   5           H        ASP   5 317.978  15.011   6.290
 1374    HA   ASP   5           HA       ASP   5 315.860  12.979   6.078
 1375    HB2  ASP   5           HB2      ASP   5 315.138  15.496   6.232
 1376    HB3  ASP   5           HB3      ASP   5 315.659  15.550   4.551
 1377    H    GLU   6           H        GLU   6 317.450  11.611   5.126
 1378    HA   GLU   6           HA       GLU   6 318.310  12.424   2.430
 1379    HB2  GLU   6           HB2      GLU   6 320.067  10.747   2.617
 1380    HB3  GLU   6           HB3      GLU   6 320.141  11.865   3.971
 1381    HG2  GLU   6           HG2      GLU   6 318.612   9.341   4.305
 1382    HG3  GLU   6           HG3      GLU   6 320.373   9.272   4.313
 1383    H    ILE   7           H        ILE   7 316.550  10.061   4.276
 1384    HA   ILE   7           HA       ILE   7 316.335   8.035   2.338
 1385    HB   ILE   7           HB       ILE   7 314.387   8.770   4.528
 1386   HG12  ILE   7          HG12      ILE   7 316.749   8.282   5.237
 1387   HG13  ILE   7          HG13      ILE   7 315.551   7.181   5.903
 1388   HG21  ILE   7          HG21      ILE   7 314.070   6.946   2.431
 1389   HG22  ILE   7          HG22      ILE   7 313.096   7.077   3.894
 1390   HG23  ILE   7          HG23      ILE   7 314.471   5.976   3.847
 1391   HD11  ILE   7          HD11      ILE   7 317.543   5.987   5.197
 1392   HD12  ILE   7          HD12      ILE   7 317.357   6.627   3.567
 1393   HD13  ILE   7          HD13      ILE   7 316.156   5.516   4.214
 1394    H    VAL   8           H        VAL   8 315.147   7.847   0.547
 1395    HA   VAL   8           HA       VAL   8 312.777   9.501   0.165
 1396    HB   VAL   8           HB       VAL   8 314.575  10.871  -0.763
 1397   HG11  VAL   8          HG11      VAL   8 316.273  10.086  -1.982
 1398   HG12  VAL   8          HG12      VAL   8 315.205   9.146  -3.023
 1399   HG13  VAL   8          HG13      VAL   8 315.737   8.483  -1.478
 1400   HG21  VAL   8          HG21      VAL   8 313.712  11.023  -3.124
 1401   HG22  VAL   8          HG22      VAL   8 312.481  11.095  -1.862
 1402   HG23  VAL   8          HG23      VAL   8 312.724   9.604  -2.773
 1403    H    ASP   9           H        ASP   9 311.313   7.947  -0.180
 1404    HA   ASP   9           HA       ASP   9 311.949   5.491  -1.522
 1405    HB2  ASP   9           HB2      ASP   9 309.410   6.668  -0.413
 1406    HB3  ASP   9           HB3      ASP   9 309.405   5.163  -1.328
 1407    H    LEU  10           H        LEU  10 311.895   5.112  -3.629
 1408    HA   LEU  10           HA       LEU  10 310.042   6.596  -5.332
 1409    HB2  LEU  10           HB2      LEU  10 313.002   6.389  -5.889
 1410    HB3  LEU  10           HB3      LEU  10 311.806   7.053  -6.985
 1411    HG   LEU  10           HG       LEU  10 311.659   8.404  -4.445
 1412   HD11  LEU  10          HD11      LEU  10 314.370   8.112  -5.685
 1413   HD12  LEU  10          HD12      LEU  10 313.904   7.996  -3.988
 1414   HD13  LEU  10          HD13      LEU  10 313.921   9.565  -4.792
 1415   HD21  LEU  10          HD21      LEU  10 310.802   9.643  -6.145
 1416   HD22  LEU  10          HD22      LEU  10 311.975   9.047  -7.320
 1417   HD23  LEU  10          HD23      LEU  10 312.445  10.284  -6.154
 1418    H    THR  11           H        THR  11 308.888   4.684  -5.670
 1419    HA   THR  11           HA       THR  11 310.353   2.627  -7.172
 1420    HB   THR  11           HB       THR  11 307.967   2.239  -5.364
 1421    HG1  THR  11           HG1      THR  11 310.516   1.086  -5.057
 1422   HG21  THR  11          HG21      THR  11 309.564   0.073  -6.686
 1423   HG22  THR  11          HG22      THR  11 308.066   0.707  -7.369
 1424   HG23  THR  11          HG23      THR  11 308.054  -0.069  -5.785
 1425    H    CYS  12           H        CYS  12 306.958   3.593  -6.663
 1426    HA   CYS  12           HA       CYS  12 306.512   4.384  -9.325
 1427    HB2  CYS  12           HB2      CYS  12 306.608   1.590  -9.012
 1428    HB3  CYS  12           HB3      CYS  12 304.903   1.995  -9.177
 1429    HG   CYS  12           HG       CYS  12 305.247   2.391 -11.566
 1430    H    GLU  13           H        GLU  13 305.315   3.380  -6.229
 1431    HA   GLU  13           HA       GLU  13 303.592   4.180  -4.972
 1432    HB2  GLU  13           HB2      GLU  13 303.834   6.156  -7.027
 1433    HB3  GLU  13           HB3      GLU  13 302.126   5.858  -6.740
 1434    HG2  GLU  13           HG2      GLU  13 303.843   6.209  -4.361
 1435    HG3  GLU  13           HG3      GLU  13 303.549   7.632  -5.359
 1436    H    SER  14           H        SER  14 301.629   3.332  -4.533
 1437    HA   SER  14           HA       SER  14 300.529   1.488  -6.456
 1438    HB2  SER  14           HB2      SER  14 300.764   1.223  -3.857
 1439    HB3  SER  14           HB3      SER  14 299.227   2.085  -3.823
 1440    HG   SER  14           HG       SER  14 298.915  -0.170  -3.906
 1441    H    LEU  15           H        LEU  15 298.622   1.625  -7.532
 1442    HA   LEU  15           HA       LEU  15 296.490   3.324  -6.946
 1443    HB2  LEU  15           HB2      LEU  15 298.573   4.823  -7.865
 1444    HB3  LEU  15           HB3      LEU  15 297.715   4.487  -9.357
 1445    HG   LEU  15           HG       LEU  15 296.926   6.578  -8.517
 1446   HD11  LEU  15          HD11      LEU  15 294.746   6.177  -8.870
 1447   HD12  LEU  15          HD12      LEU  15 294.649   4.987  -7.571
 1448   HD13  LEU  15          HD13      LEU  15 295.278   4.519  -9.150
 1449   HD21  LEU  15          HD21      LEU  15 295.782   6.619  -6.243
 1450   HD22  LEU  15          HD22      LEU  15 297.545   6.565  -6.250
 1451   HD23  LEU  15          HD23      LEU  15 296.618   5.101  -5.919
 1452    H    GLU  16           H        GLU  16 296.297   0.838  -7.563
 1453    HA   GLU  16           HA       GLU  16 294.854   0.802 -10.051
 1454    HB2  GLU  16           HB2      GLU  16 297.445   0.217 -10.390
 1455    HB3  GLU  16           HB3      GLU  16 296.880  -1.371  -9.889
 1456    HG2  GLU  16           HG2      GLU  16 296.503  -1.650 -12.076
 1457    HG3  GLU  16           HG3      GLU  16 295.018  -0.761 -11.737
 1458    HA   PRO  17           HA       PRO  17 293.557  -2.109  -6.587
 1459    HB2  PRO  17           HB2      PRO  17 291.381  -0.803  -5.703
 1460    HB3  PRO  17           HB3      PRO  17 293.004  -0.427  -5.112
 1461    HG2  PRO  17           HG2      PRO  17 291.361   0.995  -7.171
 1462    HG3  PRO  17           HG3      PRO  17 292.349   1.674  -5.864
 1463    HD2  PRO  17           HD2      PRO  17 293.188   1.511  -8.458
 1464    HD3  PRO  17           HD3      PRO  17 294.292   1.484  -7.069
 1465    H    VAL  18           H        VAL  18 291.071  -2.753  -6.199
 1466    HA   VAL  18           HA       VAL  18 289.288  -2.650  -8.362
 1467    HB   VAL  18           HB       VAL  18 291.068  -4.059  -9.434
 1468   HG11  VAL  18          HG11      VAL  18 291.158  -6.467  -8.769
 1469   HG12  VAL  18          HG12      VAL  18 290.284  -6.039  -7.303
 1470   HG13  VAL  18          HG13      VAL  18 291.881  -5.362  -7.601
 1471   HG21  VAL  18          HG21      VAL  18 289.290  -6.007  -9.890
 1472   HG22  VAL  18          HG22      VAL  18 289.148  -4.386 -10.572
 1473   HG23  VAL  18          HG23      VAL  18 288.233  -4.817  -9.127
 1474    H    VAL  19           H        VAL  19 289.209  -2.406  -5.535
 1475    HA   VAL  19           HA       VAL  19 286.891  -3.836  -4.918
 1476    HB   VAL  19           HB       VAL  19 288.679  -5.683  -4.889
 1477   HG11  VAL  19          HG11      VAL  19 290.290  -5.740  -3.355
 1478   HG12  VAL  19          HG12      VAL  19 289.215  -5.177  -2.075
 1479   HG13  VAL  19          HG13      VAL  19 289.971  -4.016  -3.166
 1480   HG21  VAL  19          HG21      VAL  19 286.269  -5.480  -3.733
 1481   HG22  VAL  19          HG22      VAL  19 287.270  -5.768  -2.309
 1482   HG23  VAL  19          HG23      VAL  19 287.275  -6.926  -3.638
 1483    H    VAL  20           H        VAL  20 286.562  -3.913  -2.390
 1484    HA   VAL  20           HA       VAL  20 287.967  -1.935  -0.870
 1485    HB   VAL  20           HB       VAL  20 285.833  -0.604  -0.423
 1486   HG11  VAL  20          HG11      VAL  20 286.477   1.006  -1.927
 1487   HG12  VAL  20          HG12      VAL  20 286.739  -0.157  -3.227
 1488   HG13  VAL  20          HG13      VAL  20 287.909  -0.024  -1.914
 1489   HG21  VAL  20          HG21      VAL  20 284.326  -0.525  -2.474
 1490   HG22  VAL  20          HG22      VAL  20 284.153  -1.921  -1.411
 1491   HG23  VAL  20          HG23      VAL  20 285.045  -2.071  -2.925
 1492    H    ASP  21           H        ASP  21 286.628  -1.524   1.258
 1493    HA   ASP  21           HA       ASP  21 285.899  -2.438   3.208
 1494    HB2  ASP  21           HB2      ASP  21 283.899  -2.761   1.396
 1495    HB3  ASP  21           HB3      ASP  21 284.151  -4.428   1.905
 1496    H    LEU  22           H        LEU  22 285.122  -4.923   4.006
 1497    HA   LEU  22           HA       LEU  22 287.124  -6.851   3.123
 1498    HB2  LEU  22           HB2      LEU  22 288.088  -7.152   5.296
 1499    HB3  LEU  22           HB3      LEU  22 288.206  -5.458   4.876
 1500    HG   LEU  22           HG       LEU  22 285.802  -6.093   6.423
 1501   HD11  LEU  22          HD11      LEU  22 288.016  -6.015   8.282
 1502   HD12  LEU  22          HD12      LEU  22 288.096  -7.441   7.245
 1503   HD13  LEU  22          HD13      LEU  22 286.648  -7.127   8.199
 1504   HD21  LEU  22          HD21      LEU  22 287.736  -4.214   7.523
 1505   HD22  LEU  22          HD22      LEU  22 286.053  -3.968   7.054
 1506   HD23  LEU  22          HD23      LEU  22 287.328  -3.878   5.839
 1507    H    THR  23           H        THR  23 286.791  -8.565   5.416
 1508    HA   THR  23           HA       THR  23 284.322  -9.805   4.680
 1509    HB   THR  23           HB       THR  23 284.956 -11.437   6.517
 1510    HG1  THR  23           HG1      THR  23 286.513 -10.912   7.793
 1511   HG21  THR  23          HG21      THR  23 285.653 -11.677   4.106
 1512   HG22  THR  23          HG22      THR  23 286.652 -12.509   5.297
 1513   HG23  THR  23          HG23      THR  23 287.207 -10.994   4.585
 1514    H    HIS  24           H        HIS  24 285.340  -9.378   8.053
 1515    HA   HIS  24           HA       HIS  24 283.067  -7.713   8.666
 1516    HB2  HIS  24           HB2      HIS  24 283.161 -10.608   9.487
 1517    HB3  HIS  24           HB3      HIS  24 282.242  -9.418  10.402
 1518    HD1  HIS  24           HD1      HIS  24 282.157 -11.456   7.323
 1519    HD2  HIS  24           HD2      HIS  24 280.005  -8.324   9.003
 1520    HE1  HIS  24           HE1      HIS  24 280.013 -11.337   6.015
 1521    HE2  HIS  24           HE2      HIS  24 278.685  -9.501   7.116
 1522    H    ASN  25           H        ASN  25 284.650 -10.062  10.797
 1523    HA   ASN  25           HA       ASN  25 286.027  -7.825  12.130
 1524    HB2  ASN  25           HB2      ASN  25 285.537  -8.844  14.299
 1525    HB3  ASN  25           HB3      ASN  25 284.046  -8.499  13.429
 1526   HD21  ASN  25          HD21      ASN  25 282.646 -10.006  13.988
 1527   HD22  ASN  25          HD22      ASN  25 282.938 -11.709  13.987
 1528    H    ASP  26           H        ASP  26 287.469  -9.089  14.004
 1529    HA   ASP  26           HA       ASP  26 289.374 -10.597  12.402
 1530    HB2  ASP  26           HB2      ASP  26 290.911 -10.262  14.306
 1531    HB3  ASP  26           HB3      ASP  26 290.235  -8.743  13.739
  Start of MODEL    9
    1    H1   GLY   1           HT1      GLY   1 291.281  -8.818 -15.438
    2    H2   GLY   1           HT2      GLY   1 292.647  -9.812 -15.526
    3    H3   GLY   1           HT3      GLY   1 291.665  -9.845 -14.149
    4    HA2  GLY   1           HA3      GLY   1 289.940 -10.951 -15.217
    5    HA3  GLY   1           HA2      GLY   1 290.573 -10.534 -16.802
    6    H    THR   2           H        THR   2 290.002 -13.094 -15.048
    7    HA   THR   2           HA       THR   2 290.783 -15.229 -14.973
    8    HB   THR   2           HB       THR   2 292.657 -14.400 -17.192
    9    HG1  THR   2           HG1      THR   2 290.981 -14.187 -18.406
   10   HG21  THR   2          HG21      THR   2 293.205 -16.532 -17.311
   11   HG22  THR   2          HG22      THR   2 291.516 -16.939 -17.615
   12   HG23  THR   2          HG23      THR   2 292.133 -16.906 -15.963
   13    H    GLU   3           H        GLU   3 291.867 -15.725 -13.181
   14    HA   GLU   3           HA       GLU   3 293.609 -16.136 -11.777
   15    HB2  GLU   3           HB2      GLU   3 294.809 -16.533 -14.028
   16    HB3  GLU   3           HB3      GLU   3 295.532 -14.955 -13.749
   17    HG2  GLU   3           HG2      GLU   3 297.031 -15.832 -12.384
   18    HG3  GLU   3           HG3      GLU   3 295.764 -16.536 -11.382
   19    H    ASN   4           H        ASN   4 292.262 -13.413 -12.205
   20    HA   ASN   4           HA       ASN   4 293.951 -12.029 -10.293
   21    HB2  ASN   4           HB2      ASN   4 294.715 -11.230 -12.518
   22    HB3  ASN   4           HB3      ASN   4 293.082 -10.665 -12.840
   23   HD21  ASN   4          HD21      ASN   4 294.085  -8.578 -13.114
   24   HD22  ASN   4          HD22      ASN   4 294.423  -7.606 -11.726
   25    H    ASP   5           H        ASP   5 291.370 -13.313 -10.151
   26    HA   ASP   5           HA       ASP   5 289.448 -11.131  -9.929
   27    HB2  ASP   5           HB2      ASP   5 289.075 -13.730 -10.571
   28    HB3  ASP   5           HB3      ASP   5 288.823 -13.826  -8.831
   29    H    HIS   6           H        HIS   6 288.106 -11.917  -7.517
   30    HA   HIS   6           HA       HIS   6 290.138 -11.052  -5.622
   31    HB2  HIS   6           HB2      HIS   6 287.159 -11.377  -5.186
   32    HB3  HIS   6           HB3      HIS   6 288.335 -10.861  -4.038
   33    HD1  HIS   6           HD1      HIS   6 287.799  -9.486  -7.531
   34    HD2  HIS   6           HD2      HIS   6 287.825  -8.445  -3.511
   35    HE1  HIS   6           HE1      HIS   6 287.457  -6.989  -7.501
   36    HE2  HIS   6           HE2      HIS   6 287.649  -6.349  -5.066
   37    H    ILE   7           H        ILE   7 290.600 -12.102  -3.788
   38    HA   ILE   7           HA       ILE   7 289.455 -14.735  -3.316
   39    HB   ILE   7           HB       ILE   7 291.433 -15.926  -3.208
   40   HG12  ILE   7          HG12      ILE   7 292.984 -13.336  -3.033
   41   HG13  ILE   7          HG13      ILE   7 292.651 -14.439  -1.696
   42   HG21  ILE   7          HG21      ILE   7 292.733 -14.295  -5.220
   43   HG22  ILE   7          HG22      ILE   7 291.008 -14.537  -5.526
   44   HG23  ILE   7          HG23      ILE   7 292.068 -15.929  -5.321
   45   HD11  ILE   7          HD11      ILE   7 294.674 -15.246  -2.183
   46   HD12  ILE   7          HD12      ILE   7 294.651 -14.600  -3.827
   47   HD13  ILE   7          HD13      ILE   7 293.817 -16.111  -3.462
   48    H    ASN   8           H        ASN   8 289.273 -15.185  -1.143
   49    HA   ASN   8           HA       ASN   8 289.609 -12.869   0.537
   50    HB2  ASN   8           HB2      ASN   8 287.830 -15.052   0.440
   51    HB3  ASN   8           HB3      ASN   8 288.702 -15.202   1.962
   52   HD21  ASN   8          HD21      ASN   8 287.036 -14.659   3.272
   53   HD22  ASN   8          HD22      ASN   8 286.342 -13.079   3.330
   54    H    LEU   9           H        LEU   9 291.096 -12.640   2.167
   55    HA   LEU   9           HA       LEU   9 292.913 -14.896   2.606
   56    HB2  LEU   9           HB2      LEU   9 293.446 -12.086   2.069
   57    HB3  LEU   9           HB3      LEU   9 294.293 -12.676   3.428
   58    HG   LEU   9           HG       LEU   9 295.742 -13.857   2.173
   59   HD11  LEU   9          HD11      LEU   9 293.438 -14.586   0.380
   60   HD12  LEU   9          HD12      LEU   9 294.272 -15.620   1.539
   61   HD13  LEU   9          HD13      LEU   9 295.105 -15.083   0.079
   62   HD21  LEU   9          HD21      LEU   9 294.511 -11.868   0.373
   63   HD22  LEU   9          HD22      LEU   9 295.666 -13.008  -0.316
   64   HD23  LEU   9          HD23      LEU   9 296.153 -11.945   1.008
   65    H    LYS  10           H        LYS  10 293.235 -15.504   4.638
   66    HA   LYS  10           HA       LYS  10 291.663 -14.137   6.683
   67    HB2  LYS  10           HB2      LYS  10 292.918 -16.795   6.331
   68    HB3  LYS  10           HB3      LYS  10 292.722 -16.242   7.956
   69    HG2  LYS  10           HG2      LYS  10 290.408 -16.307   7.827
   70    HG3  LYS  10           HG3      LYS  10 290.419 -16.199   6.061
   71    HD2  LYS  10           HD2      LYS  10 289.825 -18.434   6.668
   72    HD3  LYS  10           HD3      LYS  10 291.455 -18.448   5.988
   73    HE2  LYS  10           HE2      LYS  10 291.882 -19.707   7.826
   74    HE3  LYS  10           HE3      LYS  10 292.074 -18.120   8.578
   75    HZ1  LYS  10           HZ1      LYS  10 289.451 -18.508   8.860
   76    HZ2  LYS  10           HZ2      LYS  10 290.591 -18.955  10.026
   77    HZ3  LYS  10           HZ3      LYS  10 289.991 -20.109   8.945
   78    H    VAL  11           H        VAL  11 292.823 -12.450   7.602
   79    HA   VAL  11           HA       VAL  11 295.691 -12.847   7.854
   80    HB   VAL  11           HB       VAL  11 295.367 -10.732   7.016
   81   HG11  VAL  11          HG11      VAL  11 293.488  -9.617   7.094
   82   HG12  VAL  11          HG12      VAL  11 293.610  -9.415   8.840
   83   HG13  VAL  11          HG13      VAL  11 292.823 -10.840   8.174
   84   HG21  VAL  11          HG21      VAL  11 296.865 -10.100   8.463
   85   HG22  VAL  11          HG22      VAL  11 296.053 -10.847   9.829
   86   HG23  VAL  11          HG23      VAL  11 295.559  -9.244   9.279
   87    H    ALA  12           H        ALA  12 296.411 -13.754   9.517
   88    HA   ALA  12           HA       ALA  12 294.870 -13.870  12.009
   89    HB1  ALA  12           HB1      ALA  12 295.395 -16.034  11.706
   90    HB2  ALA  12           HB2      ALA  12 296.914 -15.556  12.476
   91    HB3  ALA  12           HB3      ALA  12 296.810 -15.657  10.718
   92    H    GLY  13           H        GLY  13 295.578 -13.057  13.924
   93    HA2  GLY  13           HA2      GLY  13 297.850 -11.238  13.701
   94    HA3  GLY  13           HA3      GLY  13 296.611 -11.206  14.945
   95    H    GLN  14           H        GLN  14 299.131 -10.939  15.719
   96    HA   GLN  14           HA       GLN  14 300.437 -13.381  16.341
   97    HB2  GLN  14           HB2      GLN  14 300.722 -10.557  17.332
   98    HB3  GLN  14           HB3      GLN  14 301.727 -11.875  17.930
   99    HG2  GLN  14           HG2      GLN  14 302.436 -12.304  15.585
  100    HG3  GLN  14           HG3      GLN  14 301.542 -10.860  15.103
  101   HE21  GLN  14          HE21      GLN  14 302.116  -9.125  17.110
  102   HE22  GLN  14          HE22      GLN  14 303.807  -8.770  17.128
  103    H    ASP  15           H        ASP  15 297.650 -11.982  17.562
  104    HA   ASP  15           HA       ASP  15 297.980 -13.217  20.202
  105    HB2  ASP  15           HB2      ASP  15 295.562 -11.914  20.299
  106    HB3  ASP  15           HB3      ASP  15 297.091 -11.260  20.870
  107    H    GLY  16           H        GLY  16 296.787 -13.993  17.213
  108    HA2  GLY  16           HA2      GLY  16 295.790 -16.135  16.849
  109    HA3  GLY  16           HA3      GLY  16 294.994 -15.992  18.407
  110    H    SER  17           H        SER  17 294.791 -13.104  16.678
  111    HA   SER  17           HA       SER  17 292.031 -13.726  15.934
  112    HB2  SER  17           HB2      SER  17 293.364 -11.377  17.061
  113    HB3  SER  17           HB3      SER  17 292.312 -10.986  15.701
  114    HG   SER  17           HG       SER  17 291.640 -12.287  18.122
  115    H    VAL  18           H        VAL  18 291.756 -14.221  13.880
  116    HA   VAL  18           HA       VAL  18 293.461 -12.957  11.838
  117    HB   VAL  18           HB       VAL  18 293.745 -15.132  11.293
  118   HG11  VAL  18          HG11      VAL  18 292.570 -15.945  13.285
  119   HG12  VAL  18          HG12      VAL  18 292.342 -16.981  11.877
  120   HG13  VAL  18          HG13      VAL  18 291.051 -15.890  12.387
  121   HG21  VAL  18          HG21      VAL  18 292.580 -14.286   9.387
  122   HG22  VAL  18          HG22      VAL  18 291.020 -14.696  10.099
  123   HG23  VAL  18          HG23      VAL  18 292.140 -15.974   9.635
  124    H    VAL  19           H        VAL  19 292.281 -12.494   9.694
  125    HA   VAL  19           HA       VAL  19 289.449 -11.845  10.053
  126    HB   VAL  19           HB       VAL  19 291.457  -9.827   9.108
  127   HG11  VAL  19          HG11      VAL  19 288.527  -9.432   9.656
  128   HG12  VAL  19          HG12      VAL  19 289.202  -9.698   8.050
  129   HG13  VAL  19          HG13      VAL  19 289.654  -8.261   8.970
  130   HG21  VAL  19          HG21      VAL  19 291.132  -8.644  11.122
  131   HG22  VAL  19          HG22      VAL  19 291.500 -10.312  11.557
  132   HG23  VAL  19          HG23      VAL  19 289.839  -9.727  11.622
  133    H    GLN  20           H        GLN  20 288.281 -11.735   8.124
  134    HA   GLN  20           HA       GLN  20 289.630 -12.982   5.872
  135    HB2  GLN  20           HB2      GLN  20 286.706 -12.370   6.316
  136    HB3  GLN  20           HB3      GLN  20 287.366 -13.282   4.966
  137    HG2  GLN  20           HG2      GLN  20 288.260 -14.319   7.501
  138    HG3  GLN  20           HG3      GLN  20 286.499 -14.303   7.381
  139   HE21  GLN  20          HE21      GLN  20 288.472 -16.506   7.404
  140   HE22  GLN  20          HE22      GLN  20 288.154 -17.426   5.978
  141    H    PHE  21           H        PHE  21 289.879 -12.122   3.891
  142    HA   PHE  21           HA       PHE  21 288.833  -9.467   3.298
  143    HB2  PHE  21           HB2      PHE  21 291.768 -10.071   3.612
  144    HB3  PHE  21           HB3      PHE  21 291.181  -8.718   2.657
  145    HD1  PHE  21           HD2      PHE  21 289.656  -7.025   3.855
  146    HD2  PHE  21           HD1      PHE  21 292.112  -9.849   5.868
  147    HE1  PHE  21           HE2      PHE  21 289.554  -5.649   5.893
  148    HE2  PHE  21           HE1      PHE  21 292.008  -8.470   7.916
  149    HZ   PHE  21           HZ       PHE  21 290.731  -6.373   7.926
  150    H    LYS  22           H        LYS  22 288.091  -9.633   1.236
  151    HA   LYS  22           HA       LYS  22 289.420 -11.516  -0.533
  152    HB2  LYS  22           HB2      LYS  22 286.759 -10.592  -0.522
  153    HB3  LYS  22           HB3      LYS  22 287.504  -9.924  -1.954
  154    HG2  LYS  22           HG2      LYS  22 287.714 -11.934  -2.929
  155    HG3  LYS  22           HG3      LYS  22 288.084 -12.721  -1.439
  156    HD2  LYS  22           HD2      LYS  22 285.984 -13.370  -1.145
  157    HD3  LYS  22           HD3      LYS  22 285.369 -11.763  -1.562
  158    HE2  LYS  22           HE2      LYS  22 284.508 -13.048  -3.266
  159    HE3  LYS  22           HE3      LYS  22 286.001 -12.425  -3.966
  160    HZ1  LYS  22           HZ1      LYS  22 285.735 -14.789  -4.398
  161    HZ2  LYS  22           HZ2      LYS  22 285.666 -15.108  -2.739
  162    HZ3  LYS  22           HZ3      LYS  22 287.091 -14.509  -3.426
  163    H    ILE  23           H        ILE  23 290.957 -10.993  -1.837
  164    HA   ILE  23           HA       ILE  23 291.251  -8.205  -2.650
  165    HB   ILE  23           HB       ILE  23 292.774  -8.305  -0.849
  166   HG12  ILE  23          HG12      ILE  23 294.140  -8.778  -3.493
  167   HG13  ILE  23          HG13      ILE  23 293.869  -7.256  -2.659
  168   HG21  ILE  23          HG21      ILE  23 292.901 -10.518  -0.216
  169   HG22  ILE  23          HG22      ILE  23 294.525 -10.224  -0.835
  170   HG23  ILE  23          HG23      ILE  23 293.342 -11.067  -1.834
  171   HD11  ILE  23          HD11      ILE  23 295.518  -7.809  -1.002
  172   HD12  ILE  23          HD12      ILE  23 296.214  -7.969  -2.617
  173   HD13  ILE  23          HD13      ILE  23 295.737  -9.408  -1.716
  174    H    LYS  24           H        LYS  24 291.685  -8.018  -4.720
  175    HA   LYS  24           HA       LYS  24 291.693 -10.303  -6.383
  176    HB2  LYS  24           HB2      LYS  24 292.323  -7.440  -6.952
  177    HB3  LYS  24           HB3      LYS  24 292.361  -8.678  -8.195
  178    HG2  LYS  24           HG2      LYS  24 289.926  -8.970  -6.831
  179    HG3  LYS  24           HG3      LYS  24 290.127  -7.248  -7.123
  180    HD2  LYS  24           HD2      LYS  24 290.156  -9.469  -9.157
  181    HD3  LYS  24           HD3      LYS  24 288.942  -8.205  -8.977
  182    HE2  LYS  24           HE2      LYS  24 290.467  -6.527  -9.700
  183    HE3  LYS  24           HE3      LYS  24 291.826  -7.645  -9.620
  184    HZ1  LYS  24           HZ1      LYS  24 290.263  -8.927 -11.331
  185    HZ2  LYS  24           HZ2      LYS  24 291.419  -7.792 -11.818
  186    HZ3  LYS  24           HZ3      LYS  24 289.796  -7.337 -11.677
  187    H    ARG  25           H        ARG  25 293.365 -11.457  -7.241
  188    HA   ARG  25           HA       ARG  25 295.653 -11.712  -5.823
  189    HB2  ARG  25           HB2      ARG  25 295.140 -12.408  -8.695
  190    HB3  ARG  25           HB3      ARG  25 296.533 -12.936  -7.779
  191    HG2  ARG  25           HG2      ARG  25 295.391 -14.522  -6.697
  192    HG3  ARG  25           HG3      ARG  25 294.005 -13.464  -6.440
  193    HD2  ARG  25           HD2      ARG  25 292.908 -14.333  -8.168
  194    HD3  ARG  25           HD3      ARG  25 294.308 -14.182  -9.226
  195    HE   ARG  25           HE       ARG  25 295.051 -16.337  -8.438
  196   HH11  ARG  25          HH11      ARG  25 291.759 -15.490  -7.603
  197   HH12  ARG  25          HH12      ARG  25 291.275 -17.133  -7.359
  198   HH21  ARG  25          HH21      ARG  25 294.402 -18.489  -8.115
  199   HH22  ARG  25          HH22      ARG  25 292.769 -18.831  -7.647
  200    H    HIS  26           H        HIS  26 295.375  -9.813  -8.846
  201    HA   HIS  26           HA       HIS  26 298.173  -9.198  -8.695
  202    HB2  HIS  26           HB2      HIS  26 296.021  -8.117 -10.509
  203    HB3  HIS  26           HB3      HIS  26 297.727  -7.678 -10.605
  204    HD1  HIS  26           HD1      HIS  26 298.689  -8.845 -12.557
  205    HD2  HIS  26           HD2      HIS  26 296.064 -11.280 -10.448
  206    HE1  HIS  26           HE1      HIS  26 298.780 -11.082 -13.702
  207    HE2  HIS  26           HE2      HIS  26 297.253 -12.564 -12.353
  208    H    THR  27           H        THR  27 296.605  -8.358  -6.375
  209    HA   THR  27           HA       THR  27 297.132  -5.472  -6.590
  210    HB   THR  27           HB       THR  27 294.910  -6.929  -5.300
  211    HG1  THR  27           HG1      THR  27 295.335  -4.275  -6.209
  212   HG21  THR  27          HG21      THR  27 296.486  -4.920  -3.789
  213   HG22  THR  27          HG22      THR  27 295.476  -6.246  -3.211
  214   HG23  THR  27          HG23      THR  27 294.735  -4.755  -3.787
  215    HA   PRO  28           HA       PRO  28 300.284  -6.153  -3.609
  216    HB2  PRO  28           HB2      PRO  28 299.891  -3.445  -2.610
  217    HB3  PRO  28           HB3      PRO  28 301.250  -4.107  -3.515
  218    HG2  PRO  28           HG2      PRO  28 299.500  -2.293  -4.542
  219    HG3  PRO  28           HG3      PRO  28 300.401  -3.459  -5.527
  220    HD2  PRO  28           HD2      PRO  28 297.557  -3.506  -4.646
  221    HD3  PRO  28           HD3      PRO  28 298.285  -4.073  -6.163
  222    H    LEU  29           H        LEU  29 300.007  -7.222  -1.793
  223    HA   LEU  29           HA       LEU  29 297.716  -7.371  -0.278
  224    HB2  LEU  29           HB2      LEU  29 300.589  -7.887   0.443
  225    HB3  LEU  29           HB3      LEU  29 299.256  -8.281   1.520
  226    HG   LEU  29           HG       LEU  29 299.343  -9.286  -1.309
  227   HD11  LEU  29          HD11      LEU  29 300.170 -11.433  -0.202
  228   HD12  LEU  29          HD12      LEU  29 300.744 -10.374   1.087
  229   HD13  LEU  29          HD13      LEU  29 301.334 -10.157  -0.564
  230   HD21  LEU  29          HD21      LEU  29 297.293  -9.861  -0.672
  231   HD22  LEU  29          HD22      LEU  29 297.652  -9.695   1.056
  232   HD23  LEU  29          HD23      LEU  29 298.111 -11.165   0.188
  233    H    SER  30           H        SER  30 299.989  -4.796  -0.345
  234    HA   SER  30           HA       SER  30 299.914  -3.784   2.215
  235    HB2  SER  30           HB2      SER  30 301.350  -2.626   0.803
  236    HB3  SER  30           HB3      SER  30 300.175  -2.561  -0.507
  237    HG   SER  30           HG       SER  30 300.653  -0.762   1.444
  238    H    LYS  31           H        LYS  31 297.371  -4.097  -0.072
  239    HA   LYS  31           HA       LYS  31 295.703  -2.069   1.140
  240    HB2  LYS  31           HB2      LYS  31 295.788  -2.838  -1.355
  241    HB3  LYS  31           HB3      LYS  31 294.696  -4.100  -0.805
  242    HG2  LYS  31           HG2      LYS  31 292.964  -2.702  -0.707
  243    HG3  LYS  31           HG3      LYS  31 293.911  -1.453   0.104
  244    HD2  LYS  31           HD2      LYS  31 293.917  -2.033  -2.857
  245    HD3  LYS  31           HD3      LYS  31 293.098  -0.682  -2.071
  246    HE2  LYS  31           HE2      LYS  31 295.445  -0.119  -1.139
  247    HE3  LYS  31           HE3      LYS  31 296.031  -1.172  -2.426
  248    HZ1  LYS  31           HZ1      LYS  31 296.029   1.026  -3.260
  249    HZ2  LYS  31           HZ2      LYS  31 294.455   1.322  -2.716
  250    HZ3  LYS  31           HZ3      LYS  31 294.718   0.242  -3.991
  251    H    LEU  32           H        LEU  32 295.864  -5.620   0.916
  252    HA   LEU  32           HA       LEU  32 293.545  -6.203   2.370
  253    HB2  LEU  32           HB2      LEU  32 294.645  -7.888   1.064
  254    HB3  LEU  32           HB3      LEU  32 296.126  -7.694   1.969
  255    HG   LEU  32           HG       LEU  32 293.723  -8.620   3.466
  256   HD11  LEU  32          HD11      LEU  32 293.363 -10.335   2.134
  257   HD12  LEU  32          HD12      LEU  32 294.980 -10.912   2.541
  258   HD13  LEU  32          HD13      LEU  32 294.735  -9.913   1.110
  259   HD21  LEU  32          HD21      LEU  32 296.114  -8.168   4.354
  260   HD22  LEU  32          HD22      LEU  32 296.515  -9.693   3.558
  261   HD23  LEU  32          HD23      LEU  32 295.280  -9.652   4.838
  262    H    MET  33           H        MET  33 296.915  -5.729   3.377
  263    HA   MET  33           HA       MET  33 296.433  -6.205   6.122
  264    HB2  MET  33           HB2      MET  33 298.713  -4.516   5.197
  265    HB3  MET  33           HB3      MET  33 298.643  -5.728   6.424
  266    HG2  MET  33           HG2      MET  33 299.316  -7.345   5.082
  267    HG3  MET  33           HG3      MET  33 298.173  -6.886   3.831
  268    HE1  MET  33           HE1      MET  33 301.575  -7.526   4.602
  269    HE2  MET  33           HE2      MET  33 301.739  -5.959   5.393
  270    HE3  MET  33           HE3      MET  33 302.605  -6.287   3.881
  271    H    LYS  34           H        LYS  34 296.373  -3.438   3.999
  272    HA   LYS  34           HA       LYS  34 296.261  -1.432   5.982
  273    HB2  LYS  34           HB2      LYS  34 295.638  -1.614   3.086
  274    HB3  LYS  34           HB3      LYS  34 294.851  -0.317   3.976
  275    HG2  LYS  34           HG2      LYS  34 297.808  -0.770   4.113
  276    HG3  LYS  34           HG3      LYS  34 297.059   0.218   2.858
  277    HD2  LYS  34           HD2      LYS  34 295.887   1.353   4.924
  278    HD3  LYS  34           HD3      LYS  34 297.279   0.704   5.787
  279    HE2  LYS  34           HE2      LYS  34 298.499   1.808   3.645
  280    HE3  LYS  34           HE3      LYS  34 297.116   2.888   3.816
  281    HZ1  LYS  34           HZ1      LYS  34 299.383   3.215   5.144
  282    HZ2  LYS  34           HZ2      LYS  34 298.559   2.246   6.258
  283    HZ3  LYS  34           HZ3      LYS  34 297.884   3.712   5.753
  284    H    ALA  35           H        ALA  35 293.963  -3.667   4.643
  285    HA   ALA  35           HA       ALA  35 291.621  -2.375   5.686
  286    HB1  ALA  35           HB1      ALA  35 291.905  -5.253   4.832
  287    HB2  ALA  35           HB2      ALA  35 291.700  -3.926   3.690
  288    HB3  ALA  35           HB3      ALA  35 290.440  -4.271   4.874
  289    H    TYR  36           H        TYR  36 293.856  -4.894   6.697
  290    HA   TYR  36           HA       TYR  36 292.409  -5.722   9.062
  291    HB2  TYR  36           HB2      TYR  36 294.268  -7.041   7.948
  292    HB3  TYR  36           HB3      TYR  36 295.399  -5.846   8.570
  293    HD1  TYR  36           HD1      TYR  36 292.477  -7.667  10.017
  294    HD2  TYR  36           HD2      TYR  36 296.592  -6.646  10.362
  295    HE1  TYR  36           HE1      TYR  36 292.642  -8.922  12.118
  296    HE2  TYR  36           HE2      TYR  36 296.759  -7.878  12.444
  297    HH   TYR  36           HH       TYR  36 294.410 -10.057  13.481
  298    H    CYS  37           H        CYS  37 294.629  -3.197   8.148
  299    HA   CYS  37           HA       CYS  37 295.266  -2.274  10.774
  300    HB2  CYS  37           HB2      CYS  37 296.761  -1.733   8.998
  301    HB3  CYS  37           HB3      CYS  37 295.468  -1.179   7.974
  302    HG   CYS  37           HG       CYS  37 295.713   0.627  10.352
  303    H    GLU  38           H        GLU  38 293.078  -1.585   8.202
  304    HA   GLU  38           HA       GLU  38 291.669   0.596   9.394
  305    HB2  GLU  38           HB2      GLU  38 291.846  -0.373   6.905
  306    HB3  GLU  38           HB3      GLU  38 290.307  -1.062   7.404
  307    HG2  GLU  38           HG2      GLU  38 290.959   1.627   6.656
  308    HG3  GLU  38           HG3      GLU  38 289.418   0.834   6.854
  309    H    ARG  39           H        ARG  39 291.267  -2.893   9.183
  310    HA   ARG  39           HA       ARG  39 288.715  -3.070  10.387
  311    HB2  ARG  39           HB2      ARG  39 288.923  -5.202   9.677
  312    HB3  ARG  39           HB3      ARG  39 290.439  -4.713   8.970
  313    HG2  ARG  39           HG2      ARG  39 291.293  -6.362  10.180
  314    HG3  ARG  39           HG3      ARG  39 291.181  -5.276  11.523
  315    HD2  ARG  39           HD2      ARG  39 288.714  -6.210  11.594
  316    HD3  ARG  39           HD3      ARG  39 289.484  -7.562  10.777
  317    HE   ARG  39           HE       ARG  39 291.043  -7.593  12.754
  318   HH11  ARG  39          HH11      ARG  39 287.758  -6.421  13.026
  319   HH12  ARG  39          HH12      ARG  39 287.642  -6.792  14.711
  320   HH21  ARG  39          HH21      ARG  39 290.877  -8.078  14.965
  321   HH22  ARG  39          HH22      ARG  39 289.406  -7.730  15.811
  322    H    GLN  40           H        GLN  40 292.036  -3.529  11.482
  323    HA   GLN  40           HA       GLN  40 291.190  -4.188  14.141
  324    HB2  GLN  40           HB2      GLN  40 293.908  -3.921  12.880
  325    HB3  GLN  40           HB3      GLN  40 293.679  -4.288  14.582
  326    HG2  GLN  40           HG2      GLN  40 292.091  -6.044  12.969
  327    HG3  GLN  40           HG3      GLN  40 293.773  -6.081  12.445
  328   HE21  GLN  40          HE21      GLN  40 295.357  -6.194  14.336
  329   HE22  GLN  40          HE22      GLN  40 294.970  -7.326  15.582
  330    H    GLY  41           H        GLY  41 292.697  -1.443  12.511
  331    HA2  GLY  41           HA2      GLY  41 292.457   0.794  13.322
  332    HA3  GLY  41           HA3      GLY  41 292.320   0.149  14.957
  333    H    LEU  42           H        LEU  42 294.644  -0.899  12.586
  334    HA   LEU  42           HA       LEU  42 296.843  -0.172  14.360
  335    HB2  LEU  42           HB2      LEU  42 296.348  -2.138  12.192
  336    HB3  LEU  42           HB3      LEU  42 297.991  -1.600  12.414
  337    HG   LEU  42           HG       LEU  42 296.374  -2.708  14.681
  338   HD11  LEU  42          HD11      LEU  42 296.411  -4.377  12.931
  339   HD12  LEU  42          HD12      LEU  42 297.499  -4.850  14.238
  340   HD13  LEU  42          HD13      LEU  42 298.155  -4.179  12.742
  341   HD21  LEU  42          HD21      LEU  42 298.869  -1.444  14.508
  342   HD22  LEU  42          HD22      LEU  42 299.214  -3.161  14.714
  343   HD23  LEU  42          HD23      LEU  42 298.202  -2.321  15.887
  344    H    SER  43           H        SER  43 298.894  -0.180  12.446
  345    HA   SER  43           HA       SER  43 298.344   2.163  10.771
  346    HB2  SER  43           HB2      SER  43 299.932   2.092  13.098
  347    HB3  SER  43           HB3      SER  43 301.061   2.117  11.749
  348    HG   SER  43           HG       SER  43 300.465   4.228  12.390
  349    H    MET  44           H        MET  44 299.282  -1.015  10.786
  350    HA   MET  44           HA       MET  44 300.410  -2.453   9.398
  351    HB2  MET  44           HB2      MET  44 298.893  -1.325   7.767
  352    HB3  MET  44           HB3      MET  44 300.183  -0.186   7.395
  353    HG2  MET  44           HG2      MET  44 301.386  -2.656   7.152
  354    HG3  MET  44           HG3      MET  44 299.775  -2.903   6.487
  355    HE1  MET  44           HE1      MET  44 300.461  -3.349   4.034
  356    HE2  MET  44           HE2      MET  44 300.278  -1.925   3.012
  357    HE3  MET  44           HE3      MET  44 299.070  -2.288   4.243
  358    H    ARG  45           H        ARG  45 301.791   0.375  10.490
  359    HA   ARG  45           HA       ARG  45 304.389  -0.112   9.227
  360    HB2  ARG  45           HB2      ARG  45 303.111   2.247   9.709
  361    HB3  ARG  45           HB3      ARG  45 304.125   2.116  11.133
  362    HG2  ARG  45           HG2      ARG  45 305.458   1.574   8.570
  363    HG3  ARG  45           HG3      ARG  45 304.904   3.232   8.812
  364    HD2  ARG  45           HD2      ARG  45 306.065   2.495  11.230
  365    HD3  ARG  45           HD3      ARG  45 307.140   1.843   9.995
  366    HE   ARG  45           HE       ARG  45 306.900   4.547  10.736
  367   HH11  ARG  45          HH11      ARG  45 307.219   2.550   7.891
  368   HH12  ARG  45          HH12      ARG  45 307.995   3.785   6.959
  369   HH21  ARG  45          HH21      ARG  45 307.923   6.172   9.511
  370   HH22  ARG  45          HH22      ARG  45 308.396   5.841   7.878
  371    H    GLN  46           H        GLN  46 302.663   0.135  12.250
  372    HA   GLN  46           HA       GLN  46 304.888  -0.813  13.858
  373    HB2  GLN  46           HB2      GLN  46 303.305   0.886  14.713
  374    HB3  GLN  46           HB3      GLN  46 301.985  -0.259  14.542
  375    HG2  GLN  46           HG2      GLN  46 304.358  -0.947  16.219
  376    HG3  GLN  46           HG3      GLN  46 303.100   0.110  16.860
  377   HE21  GLN  46          HE21      GLN  46 300.824  -0.942  15.929
  378   HE22  GLN  46          HE22      GLN  46 300.609  -2.558  16.495
  379    H    ILE  47           H        ILE  47 302.490  -1.940  11.900
  380    HA   ILE  47           HA       ILE  47 302.561  -4.680  12.960
  381    HB   ILE  47           HB       ILE  47 300.324  -3.949  13.330
  382   HG12  ILE  47          HG12      ILE  47 299.351  -5.033  11.039
  383   HG13  ILE  47          HG13      ILE  47 300.883  -5.743  11.144
  384   HG21  ILE  47          HG21      ILE  47 299.429  -3.160  10.804
  385   HG22  ILE  47          HG22      ILE  47 300.852  -2.212  11.229
  386   HG23  ILE  47          HG23      ILE  47 299.467  -2.248  12.310
  387   HD11  ILE  47          HD11      ILE  47 299.101  -5.772  13.485
  388   HD12  ILE  47          HD12      ILE  47 300.226  -7.000  12.910
  389   HD13  ILE  47          HD13      ILE  47 298.668  -6.766  12.089
  390    H    ARG  48           H        ARG  48 302.567  -6.314  11.478
  391    HA   ARG  48           HA       ARG  48 302.887  -5.679   8.668
  392    HB2  ARG  48           HB2      ARG  48 305.037  -6.983  10.339
  393    HB3  ARG  48           HB3      ARG  48 305.003  -7.010   8.583
  394    HG2  ARG  48           HG2      ARG  48 304.942  -4.441  10.111
  395    HG3  ARG  48           HG3      ARG  48 306.452  -5.251   9.694
  396    HD2  ARG  48           HD2      ARG  48 306.139  -4.964   7.433
  397    HD3  ARG  48           HD3      ARG  48 304.402  -4.803   7.587
  398    HE   ARG  48           HE       ARG  48 305.220  -2.598   8.829
  399   HH11  ARG  48          HH11      ARG  48 306.241  -3.985   5.789
  400   HH12  ARG  48          HH12      ARG  48 306.675  -2.459   5.098
  401   HH21  ARG  48          HH21      ARG  48 305.792  -0.593   7.917
  402   HH22  ARG  48          HH22      ARG  48 306.421  -0.534   6.305
  403    H    PHE  49           H        PHE  49 302.772  -7.546   7.283
  404    HA   PHE  49           HA       PHE  49 301.392  -9.767   8.621
  405    HB2  PHE  49           HB2      PHE  49 301.027  -8.619   5.859
  406    HB3  PHE  49           HB3      PHE  49 300.153  -9.990   6.468
  407    HD1  PHE  49           HD1      PHE  49 301.083  -6.630   7.746
  408    HD2  PHE  49           HD2      PHE  49 298.034  -9.501   7.066
  409    HE1  PHE  49           HE1      PHE  49 299.495  -5.147   8.809
  410    HE2  PHE  49           HE2      PHE  49 296.405  -7.996   8.166
  411    HZ   PHE  49           HZ       PHE  49 297.160  -5.837   9.082
  412    H    ARG  50           H        ARG  50 302.037 -11.804   8.341
  413    HA   ARG  50           HA       ARG  50 303.974 -12.341   6.208
  414    HB2  ARG  50           HB2      ARG  50 304.947 -12.691   8.417
  415    HB3  ARG  50           HB3      ARG  50 303.682 -13.822   8.809
  416    HG2  ARG  50           HG2      ARG  50 304.911 -14.398   6.340
  417    HG3  ARG  50           HG3      ARG  50 306.133 -14.227   7.557
  418    HD2  ARG  50           HD2      ARG  50 304.384 -16.392   7.033
  419    HD3  ARG  50           HD3      ARG  50 305.719 -16.306   8.154
  420    HE   ARG  50           HE       ARG  50 303.185 -15.241   9.070
  421   HH11  ARG  50          HH11      ARG  50 305.368 -17.960   9.003
  422   HH12  ARG  50          HH12      ARG  50 304.678 -18.703  10.406
  423   HH21  ARG  50          HH21      ARG  50 302.277 -16.219  10.913
  424   HH22  ARG  50          HH22      ARG  50 302.924 -17.719  11.487
  425    H    PHE  51           H        PHE  51 303.388 -13.861   4.833
  426    HA   PHE  51           HA       PHE  51 300.681 -14.851   5.116
  427    HB2  PHE  51           HB2      PHE  51 300.892 -13.971   2.989
  428    HB3  PHE  51           HB3      PHE  51 302.536 -14.517   2.811
  429    HD1  PHE  51           HD2      PHE  51 299.176 -16.008   3.300
  430    HD2  PHE  51           HD1      PHE  51 302.881 -16.164   1.226
  431    HE1  PHE  51           HE2      PHE  51 298.364 -17.940   2.004
  432    HE2  PHE  51           HE1      PHE  51 302.083 -18.093  -0.075
  433    HZ   PHE  51           HZ       PHE  51 299.820 -18.985   0.313
  434    H    ASP  52           H        ASP  52 300.262 -17.074   4.577
  435    HA   ASP  52           HA       ASP  52 301.350 -18.861   6.341
  436    HB2  ASP  52           HB2      ASP  52 299.383 -19.305   4.752
  437    HB3  ASP  52           HB3      ASP  52 300.593 -19.780   3.567
  438    H    GLY  53           H        GLY  53 303.455 -18.506   6.581
  439    HA2  GLY  53           HA2      GLY  53 305.698 -18.803   6.330
  440    HA3  GLY  53           HA3      GLY  53 305.318 -20.000   5.100
  441    H    GLN  54           H        GLN  54 305.133 -16.285   5.349
  442    HA   GLN  54           HA       GLN  54 307.029 -15.973   3.307
  443    HB2  GLN  54           HB2      GLN  54 304.614 -16.783   2.268
  444    HB3  GLN  54           HB3      GLN  54 304.459 -15.033   2.224
  445    HG2  GLN  54           HG2      GLN  54 305.342 -16.003   0.134
  446    HG3  GLN  54           HG3      GLN  54 306.425 -14.827   0.877
  447   HE21  GLN  54          HE21      GLN  54 305.964 -18.111  -0.043
  448   HE22  GLN  54          HE22      GLN  54 307.551 -18.672   0.346
  449    HA   PRO  55           HA       PRO  55 306.744 -12.507   6.303
  450    HB2  PRO  55           HB2      PRO  55 308.862 -11.342   4.836
  451    HB3  PRO  55           HB3      PRO  55 308.944 -12.131   6.412
  452    HG2  PRO  55           HG2      PRO  55 309.589 -13.185   3.726
  453    HG3  PRO  55           HG3      PRO  55 310.181 -13.711   5.311
  454    HD2  PRO  55           HD2      PRO  55 308.457 -15.167   3.876
  455    HD3  PRO  55           HD3      PRO  55 308.370 -15.109   5.646
  456    H    ILE  56           H        ILE  56 304.904 -12.334   4.109
  457    HA   ILE  56           HA       ILE  56 304.462 -10.857   2.293
  458    HB   ILE  56           HB       ILE  56 303.387  -9.761   4.838
  459   HG12  ILE  56          HG12      ILE  56 302.650 -12.115   3.172
  460   HG13  ILE  56          HG13      ILE  56 302.876 -12.003   4.898
  461   HG21  ILE  56          HG21      ILE  56 301.459  -9.045   3.554
  462   HG22  ILE  56          HG22      ILE  56 302.276  -9.554   2.060
  463   HG23  ILE  56          HG23      ILE  56 302.949  -8.242   3.032
  464   HD11  ILE  56          HD11      ILE  56 300.651 -12.105   4.890
  465   HD12  ILE  56          HD12      ILE  56 300.523 -11.421   3.269
  466   HD13  ILE  56          HD13      ILE  56 300.808 -10.365   4.650
  467    H    ASN  57           H        ASN  57 304.484  -9.153   1.286
  468    HA   ASN  57           HA       ASN  57 306.011  -6.830   2.236
  469    HB2  ASN  57           HB2      ASN  57 305.726  -7.856  -0.552
  470    HB3  ASN  57           HB3      ASN  57 306.728  -6.501  -0.075
  471   HD21  ASN  57          HD21      ASN  57 307.768  -7.725   2.281
  472   HD22  ASN  57          HD22      ASN  57 308.810  -8.996   1.773
  473    H    GLU  58           H        GLU  58 305.229  -4.775   1.643
  474    HA   GLU  58           HA       GLU  58 302.473  -4.455   1.612
  475    HB2  GLU  58           HB2      GLU  58 304.822  -2.737   1.250
  476    HB3  GLU  58           HB3      GLU  58 303.384  -2.154   0.427
  477    HG2  GLU  58           HG2      GLU  58 302.154  -2.357   2.586
  478    HG3  GLU  58           HG3      GLU  58 303.691  -2.740   3.360
  479    H    THR  59           H        THR  59 304.775  -4.639  -1.021
  480    HA   THR  59           HA       THR  59 302.735  -4.176  -2.999
  481    HB   THR  59           HB       THR  59 304.703  -4.597  -4.570
  482    HG1  THR  59           HG1      THR  59 306.304  -5.488  -3.520
  483   HG21  THR  59          HG21      THR  59 304.549  -2.382  -4.527
  484   HG22  THR  59          HG22      THR  59 305.832  -2.425  -3.316
  485   HG23  THR  59          HG23      THR  59 304.140  -2.371  -2.808
  486    H    ASP  60           H        ASP  60 304.241  -6.890  -1.526
  487    HA   ASP  60           HA       ASP  60 303.999  -8.834  -3.511
  488    HB2  ASP  60           HB2      ASP  60 304.069  -8.893  -0.552
  489    HB3  ASP  60           HB3      ASP  60 303.420 -10.321  -1.343
  490    H    THR  61           H        THR  61 302.345  -9.960  -4.397
  491    HA   THR  61           HA       THR  61 299.652  -9.499  -3.297
  492    HB   THR  61           HB       THR  61 298.720  -9.273  -5.383
  493    HG1  THR  61           HG1      THR  61 300.753  -9.941  -7.050
  494   HG21  THR  61          HG21      THR  61 299.972  -7.707  -6.708
  495   HG22  THR  61          HG22      THR  61 301.471  -8.180  -5.893
  496   HG23  THR  61          HG23      THR  61 300.201  -7.354  -4.989
  497    HA   PRO  62           HA       PRO  62 298.651 -13.712  -2.712
  498    HB2  PRO  62           HB2      PRO  62 296.598 -13.235  -4.851
  499    HB3  PRO  62           HB3      PRO  62 296.399 -13.989  -3.269
  500    HG2  PRO  62           HG2      PRO  62 295.612 -11.466  -3.790
  501    HG3  PRO  62           HG3      PRO  62 296.223 -11.960  -2.197
  502    HD2  PRO  62           HD2      PRO  62 297.472 -10.260  -4.240
  503    HD3  PRO  62           HD3      PRO  62 297.832 -10.390  -2.510
  504    H    ALA  63           H        ALA  63 298.476 -12.664  -6.169
  505    HA   ALA  63           HA       ALA  63 299.035 -15.197  -7.309
  506    HB1  ALA  63           HB1      ALA  63 298.114 -13.316  -8.577
  507    HB2  ALA  63           HB2      ALA  63 299.622 -13.887  -9.287
  508    HB3  ALA  63           HB3      ALA  63 299.614 -12.416  -8.301
  509    H    GLN  64           H        GLN  64 300.879 -12.428  -6.408
  510    HA   GLN  64           HA       GLN  64 303.426 -13.245  -7.312
  511    HB2  GLN  64           HB2      GLN  64 302.103 -11.027  -6.122
  512    HB3  GLN  64           HB3      GLN  64 303.477 -11.396  -5.139
  513    HG2  GLN  64           HG2      GLN  64 303.563 -10.965  -8.099
  514    HG3  GLN  64           HG3      GLN  64 303.903  -9.718  -6.901
  515   HE21  GLN  64          HE21      GLN  64 305.739 -10.013  -5.514
  516   HE22  GLN  64          HE22      GLN  64 307.092 -10.944  -6.052
  517    H    LEU  65           H        LEU  65 301.430 -14.107  -4.771
  518    HA   LEU  65           HA       LEU  65 303.611 -15.251  -3.186
  519    HB2  LEU  65           HB2      LEU  65 301.015 -13.943  -2.503
  520    HB3  LEU  65           HB3      LEU  65 301.815 -14.961  -1.346
  521    HG   LEU  65           HG       LEU  65 302.679 -12.331  -2.493
  522   HD11  LEU  65          HD11      LEU  65 302.869 -13.156   0.363
  523   HD12  LEU  65          HD12      LEU  65 301.302 -12.734  -0.326
  524   HD13  LEU  65          HD13      LEU  65 302.619 -11.557  -0.339
  525   HD21  LEU  65          HD21      LEU  65 304.840 -12.710  -1.237
  526   HD22  LEU  65          HD22      LEU  65 304.639 -13.606  -2.744
  527   HD23  LEU  65          HD23      LEU  65 304.405 -14.418  -1.198
  528    H    GLU  66           H        GLU  66 301.361 -16.069  -5.339
  529    HA   GLU  66           HA       GLU  66 300.028 -17.852  -5.789
  530    HB2  GLU  66           HB2      GLU  66 302.222 -19.193  -4.184
  531    HB3  GLU  66           HB3      GLU  66 301.028 -20.060  -5.140
  532    HG2  GLU  66           HG2      GLU  66 302.020 -19.551  -7.097
  533    HG3  GLU  66           HG3      GLU  66 302.535 -17.957  -6.548
  534    H    MET  67           H        MET  67 298.951 -16.408  -3.852
  535    HA   MET  67           HA       MET  67 298.270 -18.077  -1.572
  536    HB2  MET  67           HB2      MET  67 297.402 -15.276  -2.313
  537    HB3  MET  67           HB3      MET  67 297.013 -16.081  -0.813
  538    HG2  MET  67           HG2      MET  67 299.342 -16.174  -0.197
  539    HG3  MET  67           HG3      MET  67 299.817 -15.465  -1.732
  540    HE1  MET  67           HE1      MET  67 297.482 -13.268   1.558
  541    HE2  MET  67           HE2      MET  67 298.240 -14.839   1.797
  542    HE3  MET  67           HE3      MET  67 296.884 -14.678   0.688
  543    H    GLU  68           H        GLU  68 295.763 -18.056  -1.031
  544    HA   GLU  68           HA       GLU  68 294.345 -18.689  -3.547
  545    HB2  GLU  68           HB2      GLU  68 294.879 -20.383  -1.285
  546    HB3  GLU  68           HB3      GLU  68 293.139 -20.172  -1.508
  547    HG2  GLU  68           HG2      GLU  68 293.982 -20.651  -4.058
  548    HG3  GLU  68           HG3      GLU  68 295.101 -21.645  -3.125
  549    H    ASP  69           H        ASP  69 292.003 -19.293  -2.874
  550    HA   ASP  69           HA       ASP  69 290.816 -16.869  -1.872
  551    HB2  ASP  69           HB2      ASP  69 288.813 -17.637  -2.853
  552    HB3  ASP  69           HB3      ASP  69 290.093 -18.089  -3.971
  553    H    GLU  70           H        GLU  70 290.422 -16.656   0.044
  554    HA   GLU  70           HA       GLU  70 289.545 -16.931   2.183
  555    HB2  GLU  70           HB2      GLU  70 289.255 -19.816   1.334
  556    HB3  GLU  70           HB3      GLU  70 288.897 -19.251   2.955
  557    HG2  GLU  70           HG2      GLU  70 286.871 -19.422   1.666
  558    HG3  GLU  70           HG3      GLU  70 287.203 -17.735   2.052
  559    H    ASP  71           H        ASP  71 292.316 -17.967   0.824
  560    HA   ASP  71           HA       ASP  71 293.701 -19.522   2.530
  561    HB2  ASP  71           HB2      ASP  71 294.345 -17.941   0.386
  562    HB3  ASP  71           HB3      ASP  71 295.224 -17.151   1.683
  563    H    THR  72           H        THR  72 295.788 -18.164   3.690
  564    HA   THR  72           HA       THR  72 294.492 -16.400   5.635
  565    HB   THR  72           HB       THR  72 296.166 -18.791   6.333
  566    HG1  THR  72           HG1      THR  72 293.708 -18.160   7.485
  567   HG21  THR  72          HG21      THR  72 296.019 -16.308   7.723
  568   HG22  THR  72          HG22      THR  72 296.875 -17.782   8.172
  569   HG23  THR  72          HG23      THR  72 295.196 -17.554   8.661
  570    H    ILE  73           H        ILE  73 295.504 -14.712   6.048
  571    HA   ILE  73           HA       ILE  73 298.302 -14.373   5.240
  572    HB   ILE  73           HB       ILE  73 295.979 -12.451   5.526
  573   HG12  ILE  73          HG12      ILE  73 296.643 -13.030   3.336
  574   HG13  ILE  73          HG13      ILE  73 297.286 -11.436   3.665
  575   HG21  ILE  73          HG21      ILE  73 298.810 -11.924   6.397
  576   HG22  ILE  73          HG22      ILE  73 297.300 -11.300   7.062
  577   HG23  ILE  73          HG23      ILE  73 297.933 -10.650   5.547
  578   HD11  ILE  73          HD11      ILE  73 299.118 -12.339   2.803
  579   HD12  ILE  73          HD12      ILE  73 298.691 -13.963   3.347
  580   HD13  ILE  73          HD13      ILE  73 299.307 -12.780   4.499
  581    H    ASP  74           H        ASP  74 299.747 -14.114   6.854
  582    HA   ASP  74           HA       ASP  74 298.674 -14.348   9.574
  583    HB2  ASP  74           HB2      ASP  74 301.613 -14.596   9.033
  584    HB3  ASP  74           HB3      ASP  74 300.629 -15.379  10.262
  585    H    VAL  75           H        VAL  75 299.373 -12.954  11.204
  586    HA   VAL  75           HA       VAL  75 300.524 -10.484  10.124
  587    HB   VAL  75           HB       VAL  75 298.182 -10.820  11.919
  588   HG11  VAL  75          HG11      VAL  75 300.137  -8.519  12.133
  589   HG12  VAL  75          HG12      VAL  75 299.699  -9.646  13.428
  590   HG13  VAL  75          HG13      VAL  75 298.502  -8.512  12.792
  591   HG21  VAL  75          HG21      VAL  75 298.837  -8.520  10.133
  592   HG22  VAL  75          HG22      VAL  75 297.269  -9.203  10.557
  593   HG23  VAL  75          HG23      VAL  75 298.337 -10.065   9.450
  594    H    PHE  76           H        PHE  76 302.073  -9.530  11.051
  595    HA   PHE  76           HA       PHE  76 303.034 -10.316  13.677
  596    HB2  PHE  76           HB2      PHE  76 304.687 -10.153  11.197
  597    HB3  PHE  76           HB3      PHE  76 305.362 -10.226  12.792
  598    HD1  PHE  76           HD1      PHE  76 304.168 -12.211  14.223
  599    HD2  PHE  76           HD2      PHE  76 304.886 -12.236  10.003
  600    HE1  PHE  76           HE1      PHE  76 304.169 -14.666  14.236
  601    HE2  PHE  76           HE2      PHE  76 304.886 -14.681  10.043
  602    HZ   PHE  76           HZ       PHE  76 304.529 -15.904  12.143
  603    H    GLN  77           H        GLN  77 303.253  -8.565  14.688
  604    HA   GLN  77           HA       GLN  77 303.157  -6.051  13.265
  605    HB2  GLN  77           HB2      GLN  77 301.912  -7.077  15.515
  606    HB3  GLN  77           HB3      GLN  77 302.939  -5.775  16.115
  607    HG2  GLN  77           HG2      GLN  77 301.807  -4.211  14.741
  608    HG3  GLN  77           HG3      GLN  77 300.999  -5.506  13.830
  609   HE21  GLN  77          HE21      GLN  77 299.543  -6.898  15.117
  610   HE22  GLN  77          HE22      GLN  77 298.591  -6.156  16.352
  611    H    GLN  78           H        GLN  78 304.967  -5.204  12.740
  612    HA   GLN  78           HA       GLN  78 307.044  -4.348  12.762
  613    HB2  GLN  78           HB2      GLN  78 305.893  -3.748  15.262
  614    HB3  GLN  78           HB3      GLN  78 307.575  -4.171  15.557
  615    HG2  GLN  78           HG2      GLN  78 308.377  -2.426  14.272
  616    HG3  GLN  78           HG3      GLN  78 306.868  -2.263  13.374
  617   HE21  GLN  78          HE21      GLN  78 307.215   0.027  13.901
  618   HE22  GLN  78          HE22      GLN  78 306.626   0.624  15.411
  619    H    GLN  79           H        GLN  79 307.849  -6.337  11.957
  620    HA   GLN  79           HA       GLN  79 310.167  -7.236  13.111
  621    HB2  GLN  79           HB2      GLN  79 309.575  -9.505  13.867
  622    HB3  GLN  79           HB3      GLN  79 308.854  -8.261  14.871
  623    HG2  GLN  79           HG2      GLN  79 306.781  -8.920  14.391
  624    HG3  GLN  79           HG3      GLN  79 307.141  -9.110  12.675
  625   HE21  GLN  79          HE21      GLN  79 306.758 -10.673  15.689
  626   HE22  GLN  79          HE22      GLN  79 307.054 -12.287  15.150
  627    H    THR  80           H        THR  80 309.189  -6.561  10.559
  628    HA   THR  80           HA       THR  80 309.474  -9.116   9.113
  629    HB   THR  80           HB       THR  80 308.382  -7.867   7.190
  630    HG1  THR  80           HG1      THR  80 307.850  -5.880   7.482
  631   HG21  THR  80          HG21      THR  80 307.113  -9.477   8.547
  632   HG22  THR  80          HG22      THR  80 306.127  -8.145   7.941
  633   HG23  THR  80          HG23      THR  80 306.647  -8.161   9.626
  634    H    GLY  81           H        GLY  81 309.746  -5.773   7.969
  635    HA2  GLY  81           HA2      GLY  81 311.444  -4.669   6.893
  636    HA3  GLY  81           HA3      GLY  81 312.546  -5.630   7.869
  637    H    GLY  82           H        GLY  82 310.735  -5.528   4.834
  638    HA2  GLY  82           HA2      GLY  82 312.783  -7.263   3.664
  639    HA3  GLY  82           HA3      GLY  82 311.101  -7.735   3.496
  640    H1   GLY   1           HT1      GLY   1 318.646   6.924  15.653
  641    H2   GLY   1           HT2      GLY   1 319.700   5.686  16.117
  642    H3   GLY   1           HT3      GLY   1 318.206   5.307  15.423
  643    HA2  GLY   1           HA3      GLY   1 320.040   6.982  13.878
  644    HA3  GLY   1           HA2      GLY   1 320.419   5.272  14.024
  645    H    SER   2           H        SER   2 318.305   7.636  12.642
  646    HA   SER   2           HA       SER   2 316.970   7.528  10.795
  647    HB2  SER   2           HB2      SER   2 318.641   5.380  10.392
  648    HB3  SER   2           HB3      SER   2 317.046   4.627  10.359
  649    HG   SER   2           HG       SER   2 317.794   5.425   8.297
  650    H    GLU   3           H        GLU   3 316.539   4.513  12.657
  651    HA   GLU   3           HA       GLU   3 314.748   3.772  13.868
  652    HB2  GLU   3           HB2      GLU   3 314.232   6.524  13.710
  653    HB3  GLU   3           HB3      GLU   3 312.738   5.744  13.204
  654    HG2  GLU   3           HG2      GLU   3 313.182   4.277  15.348
  655    HG3  GLU   3           HG3      GLU   3 314.115   5.692  15.834
  656    H    GLU   4           H        GLU   4 313.720   5.329  10.812
  657    HA   GLU   4           HA       GLU   4 311.817   3.214  10.294
  658    HB2  GLU   4           HB2      GLU   4 312.629   5.402   8.394
  659    HB3  GLU   4           HB3      GLU   4 311.112   4.517   8.448
  660    HG2  GLU   4           HG2      GLU   4 310.213   5.984   9.837
  661    HG3  GLU   4           HG3      GLU   4 311.591   5.895  10.932
  662    H    LYS   5           H        LYS   5 312.203   3.285   7.422
  663    HA   LYS   5           HA       LYS   5 313.324   2.255   5.735
  664    HB2  LYS   5           HB2      LYS   5 315.593   2.526   7.671
  665    HB3  LYS   5           HB3      LYS   5 315.791   1.619   6.192
  666    HG2  LYS   5           HG2      LYS   5 316.535   4.059   6.248
  667    HG3  LYS   5           HG3      LYS   5 315.604   3.499   4.859
  668    HD2  LYS   5           HD2      LYS   5 313.931   4.919   5.298
  669    HD3  LYS   5           HD3      LYS   5 313.934   4.535   7.017
  670    HE2  LYS   5           HE2      LYS   5 315.666   6.091   7.456
  671    HE3  LYS   5           HE3      LYS   5 315.996   6.309   5.739
  672    HZ1  LYS   5           HZ1      LYS   5 313.289   6.925   6.567
  673    HZ2  LYS   5           HZ2      LYS   5 314.317   7.762   5.517
  674    HZ3  LYS   5           HZ3      LYS   5 314.478   7.956   7.189
  675    HA   PRO   6           HA       PRO   6 312.569  -1.995   6.697
  676    HB2  PRO   6           HB2      PRO   6 314.077  -2.627   4.238
  677    HB3  PRO   6           HB3      PRO   6 312.382  -2.945   4.614
  678    HG2  PRO   6           HG2      PRO   6 313.073  -1.073   2.839
  679    HG3  PRO   6           HG3      PRO   6 311.707  -0.820   3.943
  680    HD2  PRO   6           HD2      PRO   6 314.516   0.230   4.133
  681    HD3  PRO   6           HD3      PRO   6 312.986   1.085   4.408
  682    H    LYS   7           H        LYS   7 313.664  -3.412   7.959
  683    HA   LYS   7           HA       LYS   7 316.462  -3.113   8.403
  684    HB2  LYS   7           HB2      LYS   7 314.304  -4.439   9.672
  685    HB3  LYS   7           HB3      LYS   7 315.491  -5.679   9.297
  686    HG2  LYS   7           HG2      LYS   7 316.055  -4.953  11.437
  687    HG3  LYS   7           HG3      LYS   7 317.202  -4.127  10.380
  688    HD2  LYS   7           HD2      LYS   7 316.141  -2.073  10.626
  689    HD3  LYS   7           HD3      LYS   7 314.625  -2.809  11.148
  690    HE2  LYS   7           HE2      LYS   7 315.271  -2.302  13.225
  691    HE3  LYS   7           HE3      LYS   7 316.409  -3.640  13.070
  692    HZ1  LYS   7           HZ1      LYS   7 317.776  -1.666  11.910
  693    HZ2  LYS   7           HZ2      LYS   7 317.900  -2.051  13.552
  694    HZ3  LYS   7           HZ3      LYS   7 316.897  -0.783  13.055
  695    H    GLU   8           H        GLU   8 316.820  -3.273   5.989
  696    HA   GLU   8           HA       GLU   8 317.852  -4.352   4.273
  697    HB2  GLU   8           HB2      GLU   8 318.363  -6.070   6.531
  698    HB3  GLU   8           HB3      GLU   8 318.021  -7.059   5.118
  699    HG2  GLU   8           HG2      GLU   8 319.734  -5.584   3.913
  700    HG3  GLU   8           HG3      GLU   8 320.218  -5.068   5.528
  701    H    GLY   9           H        GLY   9 315.913  -3.927   3.264
  702    HA2  GLY   9           HA2      GLY   9 313.935  -5.993   3.010
  703    HA3  GLY   9           HA3      GLY   9 313.953  -4.459   2.218
  704    H    VAL  10           H        VAL  10 314.513  -4.341   0.353
  705    HA   VAL  10           HA       VAL  10 314.936  -4.846  -1.774
  706    HB   VAL  10           HB       VAL  10 317.137  -4.248  -1.021
  707   HG11  VAL  10          HG11      VAL  10 317.500  -5.753   0.786
  708   HG12  VAL  10          HG12      VAL  10 318.771  -6.034  -0.401
  709   HG13  VAL  10          HG13      VAL  10 317.416  -7.153  -0.282
  710   HG21  VAL  10          HG21      VAL  10 316.546  -5.710  -3.289
  711   HG22  VAL  10          HG22      VAL  10 317.995  -6.491  -2.656
  712   HG23  VAL  10          HG23      VAL  10 318.008  -4.762  -3.010
  713    H    LYS  11           H        LYS  11 313.213  -6.351  -1.951
  714    HA   LYS  11           HA       LYS  11 314.102  -9.131  -2.278
  715    HB2  LYS  11           HB2      LYS  11 311.453  -7.855  -1.941
  716    HB3  LYS  11           HB3      LYS  11 311.570  -9.375  -2.817
  717    HG2  LYS  11           HG2      LYS  11 311.397 -10.260  -0.788
  718    HG3  LYS  11           HG3      LYS  11 313.111  -9.951  -0.720
  719    HD2  LYS  11           HD2      LYS  11 311.683  -9.171   1.264
  720    HD3  LYS  11           HD3      LYS  11 312.877  -8.069   0.575
  721    HE2  LYS  11           HE2      LYS  11 311.250  -6.756  -0.464
  722    HE3  LYS  11           HE3      LYS  11 310.030  -8.022  -0.363
  723    HZ1  LYS  11           HZ3      LYS  11 310.178  -7.689   2.108
  724    H    THR  12           H        THR  12 311.700  -7.183  -3.872
  725    HA   THR  12           HA       THR  12 312.768  -7.864  -6.514
  726    HB   THR  12           HB       THR  12 310.584  -7.072  -7.374
  727    HG1  THR  12           HG1      THR  12 309.899  -6.757  -4.643
  728   HG21  THR  12          HG21      THR  12 309.389  -8.934  -6.850
  729   HG22  THR  12          HG22      THR  12 309.829  -8.874  -5.143
  730   HG23  THR  12          HG23      THR  12 310.996  -9.447  -6.335
  731    H    GLU  13           H        GLU  13 310.937  -4.985  -5.540
  732    HA   GLU  13           HA       GLU  13 313.166  -3.221  -5.901
  733    HB2  GLU  13           HB2      GLU  13 310.949  -3.096  -7.958
  734    HB3  GLU  13           HB3      GLU  13 312.306  -1.985  -7.823
  735    HG2  GLU  13           HG2      GLU  13 313.829  -3.902  -8.264
  736    HG3  GLU  13           HG3      GLU  13 312.404  -4.894  -8.573
  737    H    ASN  14           H        ASN  14 310.102  -1.950  -6.897
  738    HA   ASN  14           HA       ASN  14 309.893   0.040  -5.149
  739    HB2  ASN  14           HB2      ASN  14 308.367  -0.541  -7.086
  740    HB3  ASN  14           HB3      ASN  14 307.438  -1.440  -5.894
  741   HD21  ASN  14          HD21      ASN  14 308.351   1.690  -7.026
  742   HD22  ASN  14          HD22      ASN  14 307.293   2.607  -6.015
  743    H    ASP  15           H        ASP  15 310.364  -0.073  -3.097
  744    HA   ASP  15           HA       ASP  15 308.512  -0.737  -1.166
  745    HB2  ASP  15           HB2      ASP  15 310.000  -3.034  -2.098
  746    HB3  ASP  15           HB3      ASP  15 310.363  -2.727  -0.403
  747    H    HIS  16           H        HIS  16 310.434   1.275  -1.865
  748    HA   HIS  16           HA       HIS  16 312.300   2.362  -1.211
  749    HB2  HIS  16           HB2      HIS  16 310.729   2.392   1.329
  750    HB3  HIS  16           HB3      HIS  16 311.834   3.593   0.723
  751    HD1  HIS  16           HD1      HIS  16 308.327   2.467   0.404
  752    HD2  HIS  16           HD2      HIS  16 310.914   5.187  -1.388
  753    HE1  HIS  16           HE1      HIS  16 306.854   4.008  -0.931
  754    HE2  HIS  16           HE2      HIS  16 308.429   5.707  -1.925
  755    H    ILE  17           H        ILE  17 314.219   2.296  -0.471
  756    HA   ILE  17           HA       ILE  17 314.908   0.558   1.779
  757    HB   ILE  17           HB       ILE  17 316.884  -0.279   0.744
  758   HG12  ILE  17          HG12      ILE  17 316.117   1.248  -1.733
  759   HG13  ILE  17          HG13      ILE  17 317.423   1.686  -0.661
  760   HG21  ILE  17          HG21      ILE  17 315.926  -1.915  -0.540
  761   HG22  ILE  17          HG22      ILE  17 314.926  -0.773  -1.444
  762   HG23  ILE  17          HG23      ILE  17 314.487  -1.221   0.210
  763   HD11  ILE  17          HD11      ILE  17 317.824  -0.997  -1.482
  764   HD12  ILE  17          HD12      ILE  17 318.815   0.429  -1.821
  765   HD13  ILE  17          HD13      ILE  17 317.494  -0.014  -2.910
  766    H    ASN  18           H        ASN  18 317.011   1.105   2.681
  767    HA   ASN  18           HA       ASN  18 317.362   3.977   2.585
  768    HB2  ASN  18           HB2      ASN  18 317.338   2.435   4.739
  769    HB3  ASN  18           HB3      ASN  18 319.014   2.179   4.326
  770   HD21  ASN  18          HD21      ASN  18 316.949   5.040   4.179
  771   HD22  ASN  18          HD22      ASN  18 317.990   6.022   5.137
  772    H    LEU  19           H        LEU  19 319.037   4.906   1.486
  773    HA   LEU  19           HA       LEU  19 321.099   3.113   0.454
  774    HB2  LEU  19           HB2      LEU  19 319.443   4.997  -0.919
  775    HB3  LEU  19           HB3      LEU  19 321.120   5.484  -1.085
  776    HG   LEU  19           HG       LEU  19 319.827   2.878  -1.913
  777   HD11  LEU  19          HD11      LEU  19 321.568   4.781  -3.439
  778   HD12  LEU  19          HD12      LEU  19 319.816   4.682  -3.551
  779   HD13  LEU  19          HD13      LEU  19 320.810   3.320  -4.063
  780   HD21  LEU  19          HD21      LEU  19 322.558   2.723  -2.540
  781   HD22  LEU  19          HD22      LEU  19 321.640   1.719  -1.418
  782   HD23  LEU  19          HD23      LEU  19 322.477   3.169  -0.833
  783    H    LYS  20           H        LYS  20 323.063   3.388   1.084
  784    HA   LYS  20           HA       LYS  20 323.720   5.688   2.732
  785    HB2  LYS  20           HB2      LYS  20 324.545   2.966   2.540
  786    HB3  LYS  20           HB3      LYS  20 325.944   3.968   2.382
  787    HG2  LYS  20           HG2      LYS  20 325.547   5.001   4.411
  788    HG3  LYS  20           HG3      LYS  20 323.954   4.347   4.523
  789    HD2  LYS  20           HD2      LYS  20 326.419   3.274   5.472
  790    HD3  LYS  20           HD3      LYS  20 324.774   2.735   5.797
  791    HE2  LYS  20           HE2      LYS  20 324.873   1.086   4.259
  792    HE3  LYS  20           HE3      LYS  20 325.956   1.976   3.190
  793    HZ1  LYS  20           HZ1      LYS  20 326.738  -0.083   4.649
  794    HZ2  LYS  20           HZ2      LYS  20 327.053   1.158   5.755
  795    HZ3  LYS  20           HZ3      LYS  20 327.777   1.184   4.226
  796    H    VAL  21           H        VAL  21 325.217   7.314   2.111
  797    HA   VAL  21           HA       VAL  21 326.557   6.948  -0.477
  798    HB   VAL  21           HB       VAL  21 325.991   9.681   0.594
  799   HG11  VAL  21          HG11      VAL  21 326.148  10.327  -1.665
  800   HG12  VAL  21          HG12      VAL  21 325.919   8.674  -2.237
  801   HG13  VAL  21          HG13      VAL  21 327.418   9.128  -1.427
  802   HG21  VAL  21          HG21      VAL  21 323.817   8.495   0.712
  803   HG22  VAL  21          HG22      VAL  21 323.966   8.109  -1.002
  804   HG23  VAL  21          HG23      VAL  21 323.830   9.791  -0.487
  805    H    ALA  22           H        ALA  22 328.756   7.104  -0.364
  806    HA   ALA  22           HA       ALA  22 329.886   7.861   2.237
  807    HB1  ALA  22           HB1      ALA  22 331.928   6.720   0.773
  808    HB2  ALA  22           HB2      ALA  22 330.493   5.821   0.273
  809    HB3  ALA  22           HB3      ALA  22 330.924   5.917   1.982
  810    H    GLY  23           H        GLY  23 330.198  10.028   2.183
  811    HA2  GLY  23           HA2      GLY  23 331.449  11.268  -0.133
  812    HA3  GLY  23           HA3      GLY  23 330.817  12.101   1.261
  813    H    GLN  24           H        GLN  24 333.176  12.896   0.226
  814    HA   GLN  24           HA       GLN  24 335.520  11.699   1.074
  815    HB2  GLN  24           HB2      GLN  24 335.160  14.666   1.100
  816    HB3  GLN  24           HB3      GLN  24 336.602  13.751   0.709
  817    HG2  GLN  24           HG2      GLN  24 335.180  12.852  -1.261
  818    HG3  GLN  24           HG3      GLN  24 334.189  14.280  -0.956
  819   HE21  GLN  24          HE21      GLN  24 336.491  13.193  -2.894
  820   HE22  GLN  24          HE22      GLN  24 337.370  14.646  -3.215
  821    H    ASP  25           H        ASP  25 333.078  13.028   3.008
  822    HA   ASP  25           HA       ASP  25 334.463  14.141   5.135
  823    HB2  ASP  25           HB2      ASP  25 332.449  13.421   6.506
  824    HB3  ASP  25           HB3      ASP  25 332.110  14.398   5.080
  825    H    GLY  26           H        GLY  26 334.798  10.993   4.060
  826    HA2  GLY  26           HA2      GLY  26 335.925   9.205   4.961
  827    HA3  GLY  26           HA3      GLY  26 336.358  10.245   6.315
  828    H    SER  27           H        SER  27 333.215   9.214   5.059
  829    HA   SER  27           HA       SER  27 332.663   7.389   7.168
  830    HB2  SER  27           HB2      SER  27 331.097   9.970   7.289
  831    HB3  SER  27           HB3      SER  27 331.078   8.637   8.442
  832    HG   SER  27           HG       SER  27 332.547   9.737   9.451
  833    H    VAL  28           H        VAL  28 329.788   8.030   7.101
  834    HA   VAL  28           HA       VAL  28 329.103   7.712   4.302
  835    HB   VAL  28           HB       VAL  28 329.604   5.447   4.864
  836   HG11  VAL  28          HG11      VAL  28 329.476   5.797   7.327
  837   HG12  VAL  28          HG12      VAL  28 328.752   4.287   6.763
  838   HG13  VAL  28          HG13      VAL  28 327.718   5.648   7.202
  839   HG21  VAL  28          HG21      VAL  28 327.548   4.364   4.331
  840   HG22  VAL  28          HG22      VAL  28 327.454   5.961   3.598
  841   HG23  VAL  28          HG23      VAL  28 326.593   5.633   5.105
  842    H    VAL  29           H        VAL  29 326.809   7.718   3.951
  843    HA   VAL  29           HA       VAL  29 325.227   8.742   6.184
  844    HB   VAL  29           HB       VAL  29 323.969  10.053   4.286
  845   HG11  VAL  29          HG11      VAL  29 324.539  11.474   5.887
  846   HG12  VAL  29          HG12      VAL  29 325.893  11.901   4.835
  847   HG13  VAL  29          HG13      VAL  29 326.116  10.729   6.134
  848   HG21  VAL  29          HG21      VAL  29 326.775  10.322   3.271
  849   HG22  VAL  29          HG22      VAL  29 325.266  10.879   2.545
  850   HG23  VAL  29          HG23      VAL  29 325.636   9.160   2.593
  851    H    GLN  30           H        GLN  30 323.017   8.312   5.996
  852    HA   GLN  30           HA       GLN  30 322.511   6.043   4.188
  853    HB2  GLN  30           HB2      GLN  30 322.218   6.427   7.020
  854    HB3  GLN  30           HB3      GLN  30 320.768   5.755   6.306
  855    HG2  GLN  30           HG2      GLN  30 322.252   4.005   5.282
  856    HG3  GLN  30           HG3      GLN  30 323.571   4.662   6.264
  857   HE21  GLN  30          HE21      GLN  30 321.338   2.286   6.120
  858   HE22  GLN  30          HE22      GLN  30 321.159   1.936   7.802
  859    H    PHE  31           H        PHE  31 321.278   6.673   2.622
  860    HA   PHE  31           HA       PHE  31 319.158   8.636   2.916
  861    HB2  PHE  31           HB2      PHE  31 320.414   7.242   0.542
  862    HB3  PHE  31           HB3      PHE  31 319.039   8.274   0.381
  863    HD1  PHE  31           HD2      PHE  31 321.993   8.709   2.574
  864    HD2  PHE  31           HD1      PHE  31 319.830  10.130  -0.802
  865    HE1  PHE  31           HE2      PHE  31 323.467  10.657   2.457
  866    HE2  PHE  31           HE1      PHE  31 321.323  12.081  -0.925
  867    HZ   PHE  31           HZ       PHE  31 323.141  12.344   0.705
  868    H    LYS  32           H        LYS  32 317.056   8.156   1.880
  869    HA   LYS  32           HA       LYS  32 316.447   5.286   1.957
  870    HB2  LYS  32           HB2      LYS  32 315.366   6.193   3.903
  871    HB3  LYS  32           HB3      LYS  32 314.697   7.501   2.964
  872    HG2  LYS  32           HG2      LYS  32 313.664   5.420   1.617
  873    HG3  LYS  32           HG3      LYS  32 313.791   4.713   3.225
  874    HD2  LYS  32           HD2      LYS  32 312.707   7.251   3.635
  875    HD3  LYS  32           HD3      LYS  32 311.897   6.632   2.193
  876    HE2  LYS  32           HE2      LYS  32 312.172   5.004   4.705
  877    HE3  LYS  32           HE3      LYS  32 310.821   6.104   4.439
  878    HZ1  LYS  32           HZ1      LYS  32 311.361   3.523   3.257
  879    HZ2  LYS  32           HZ2      LYS  32 310.846   4.699   2.156
  880    HZ3  LYS  32           HZ3      LYS  32 309.887   4.319   3.496
  881    H    ILE  33           H        ILE  33 316.154   4.672   0.047
  882    HA   ILE  33           HA       ILE  33 314.442   6.154  -1.779
  883    HB   ILE  33           HB       ILE  33 316.831   6.939  -2.110
  884   HG12  ILE  33          HG12      ILE  33 315.296   5.592  -4.349
  885   HG13  ILE  33          HG13      ILE  33 315.181   7.269  -3.834
  886   HG21  ILE  33          HG21      ILE  33 317.584   4.651  -3.720
  887   HG22  ILE  33          HG22      ILE  33 317.408   4.238  -2.014
  888   HG23  ILE  33          HG23      ILE  33 318.495   5.536  -2.496
  889   HD11  ILE  33          HD11      ILE  33 316.911   7.889  -5.084
  890   HD12  ILE  33          HD12      ILE  33 316.642   6.364  -5.929
  891   HD13  ILE  33          HD13      ILE  33 317.861   6.467  -4.658
  892    H    LYS  34           H        LYS  34 313.252   4.863  -2.997
  893    HA   LYS  34           HA       LYS  34 313.039   2.152  -2.503
  894    HB2  LYS  34           HB2      LYS  34 311.189   3.392  -3.374
  895    HB3  LYS  34           HB3      LYS  34 312.081   3.791  -4.818
  896    HG2  LYS  34           HG2      LYS  34 312.127   1.156  -5.081
  897    HG3  LYS  34           HG3      LYS  34 310.690   1.304  -4.083
  898    HD2  LYS  34           HD2      LYS  34 310.233   1.277  -6.537
  899    HD3  LYS  34           HD3      LYS  34 309.605   2.686  -5.693
  900    HE2  LYS  34           HE2      LYS  34 312.120   3.493  -6.516
  901    HE3  LYS  34           HE3      LYS  34 311.546   2.501  -7.849
  902    HZ1  LYS  34           HZ1      LYS  34 310.756   4.571  -8.382
  903    HZ2  LYS  34           HZ2      LYS  34 310.416   4.998  -6.788
  904    HZ3  LYS  34           HZ3      LYS  34 309.416   3.903  -7.597
  905    H    ARG  35           H        ARG  35 313.242   2.551  -5.896
  906    HA   ARG  35           HA       ARG  35 315.918   1.525  -6.129
  907    HB2  ARG  35           HB2      ARG  35 313.629  -0.224  -7.003
  908    HB3  ARG  35           HB3      ARG  35 315.340  -0.579  -7.145
  909    HG2  ARG  35           HG2      ARG  35 314.357  -0.068  -4.413
  910    HG3  ARG  35           HG3      ARG  35 313.780  -1.509  -5.200
  911    HD2  ARG  35           HD2      ARG  35 316.647  -0.751  -4.747
  912    HD3  ARG  35           HD3      ARG  35 315.749  -2.024  -3.927
  913    HE   ARG  35           HE       ARG  35 316.857  -2.111  -6.600
  914   HH11  ARG  35          HH11      ARG  35 314.746  -3.600  -4.253
  915   HH12  ARG  35          HH12      ARG  35 314.771  -5.146  -5.030
  916   HH21  ARG  35          HH21      ARG  35 316.891  -4.145  -7.621
  917   HH22  ARG  35          HH22      ARG  35 315.987  -5.457  -6.940
  918    H    HIS  36           H        HIS  36 312.928   1.264  -8.041
  919    HA   HIS  36           HA       HIS  36 314.041   1.783 -10.525
  920    HB2  HIS  36           HB2      HIS  36 311.962   1.294 -11.195
  921    HB3  HIS  36           HB3      HIS  36 311.482   1.239  -9.505
  922    HD1  HIS  36           HD1      HIS  36 309.472   2.593  -9.085
  923    HD2  HIS  36           HD2      HIS  36 311.785   4.223 -12.127
  924    HE1  HIS  36           HE1      HIS  36 308.243   4.657  -9.833
  925    HE2  HIS  36           HE2      HIS  36 309.730   5.694 -11.579
  926    H    THR  37           H        THR  37 313.449   3.986  -8.007
  927    HA   THR  37           HA       THR  37 313.154   6.369  -9.618
  928    HB   THR  37           HB       THR  37 313.610   5.789  -6.721
  929    HG1  THR  37           HG1      THR  37 311.541   6.254  -7.892
  930   HG21  THR  37          HG21      THR  37 315.138   7.445  -6.584
  931   HG22  THR  37          HG22      THR  37 313.679   8.436  -6.559
  932   HG23  THR  37          HG23      THR  37 314.591   8.242  -8.059
  933    HA   PRO  38           HA       PRO  38 317.220   7.010 -10.976
  934    HB2  PRO  38           HB2      PRO  38 316.440   9.860 -10.753
  935    HB3  PRO  38           HB3      PRO  38 316.965   8.940 -12.183
  936    HG2  PRO  38           HG2      PRO  38 314.390   9.600 -11.903
  937    HG3  PRO  38           HG3      PRO  38 314.830   8.001 -12.498
  938    HD2  PRO  38           HD2      PRO  38 314.045   8.890  -9.761
  939    HD3  PRO  38           HD3      PRO  38 313.426   7.532 -10.721
  940    H    LEU  39           H        LEU  39 319.195   7.615 -10.093
  941    HA   LEU  39           HA       LEU  39 319.149   7.957  -7.281
  942    HB2  LEU  39           HB2      LEU  39 321.303   7.652  -9.304
  943    HB3  LEU  39           HB3      LEU  39 321.711   8.187  -7.678
  944    HG   LEU  39           HG       LEU  39 320.133   5.674  -8.255
  945   HD11  LEU  39          HD11      LEU  39 322.687   5.050  -7.265
  946   HD12  LEU  39          HD12      LEU  39 322.925   6.189  -8.580
  947   HD13  LEU  39          HD13      LEU  39 322.036   4.694  -8.867
  948   HD21  LEU  39          HD21      LEU  39 321.635   5.825  -5.776
  949   HD22  LEU  39          HD22      LEU  39 319.929   5.466  -6.043
  950   HD23  LEU  39          HD23      LEU  39 320.468   7.141  -5.916
  951    H    SER  40           H        SER  40 319.302  10.323  -9.891
  952    HA   SER  40           HA       SER  40 320.708  12.331  -8.644
  953    HB2  SER  40           HB2      SER  40 318.554  12.174 -10.683
  954    HB3  SER  40           HB3      SER  40 318.810  13.747  -9.924
  955    HG   SER  40           HG       SER  40 320.087  13.219 -11.883
  956    H    LYS  41           H        LYS  41 317.790  10.875  -7.640
  957    HA   LYS  41           HA       LYS  41 316.709  13.115  -6.209
  958    HB2  LYS  41           HB2      LYS  41 316.034  10.352  -6.810
  959    HB3  LYS  41           HB3      LYS  41 315.610  10.814  -5.184
  960    HG2  LYS  41           HG2      LYS  41 313.842  11.958  -5.887
  961    HG3  LYS  41           HG3      LYS  41 314.807  12.827  -7.082
  962    HD2  LYS  41           HD2      LYS  41 314.461  10.100  -7.892
  963    HD3  LYS  41           HD3      LYS  41 312.888  10.820  -7.558
  964    HE2  LYS  41           HE2      LYS  41 314.161  12.794  -8.964
  965    HE3  LYS  41           HE3      LYS  41 314.788  11.326  -9.714
  966    HZ1  LYS  41           HZ1      LYS  41 312.711  12.235 -10.727
  967    HZ2  LYS  41           HZ2      LYS  41 311.896  11.827  -9.303
  968    HZ3  LYS  41           HZ3      LYS  41 312.608  10.617 -10.245
  969    H    LEU  42           H        LEU  42 318.896  10.524  -5.811
  970    HA   LEU  42           HA       LEU  42 319.165  10.708  -2.936
  971    HB2  LEU  42           HB2      LEU  42 319.162   8.564  -4.283
  972    HB3  LEU  42           HB3      LEU  42 320.707   9.061  -4.941
  973    HG   LEU  42           HG       LEU  42 320.413   8.870  -1.990
  974   HD11  LEU  42          HD11      LEU  42 319.840   6.748  -2.054
  975   HD12  LEU  42          HD12      LEU  42 321.411   6.431  -2.783
  976   HD13  LEU  42          HD13      LEU  42 319.999   6.684  -3.809
  977   HD21  LEU  42          HD21      LEU  42 322.554   8.815  -4.038
  978   HD22  LEU  42          HD22      LEU  42 322.799   7.868  -2.569
  979   HD23  LEU  42          HD23      LEU  42 322.521   9.608  -2.460
  980    H    MET  43           H        MET  43 320.642  11.807  -5.856
  981    HA   MET  43           HA       MET  43 323.247  12.333  -4.884
  982    HB2  MET  43           HB2      MET  43 321.736  13.324  -7.284
  983    HB3  MET  43           HB3      MET  43 323.403  13.777  -6.958
  984    HG2  MET  43           HG2      MET  43 323.679  11.142  -6.764
  985    HG3  MET  43           HG3      MET  43 322.275  11.181  -7.829
  986    HE1  MET  43           HE1      MET  43 324.110   9.734  -9.382
  987    HE2  MET  43           HE2      MET  43 325.360  10.101  -8.195
  988    HE3  MET  43           HE3      MET  43 325.640  10.443  -9.910
  989    H    LYS  44           H        LYS  44 320.420  14.470  -5.271
  990    HA   LYS  44           HA       LYS  44 321.883  16.799  -4.405
  991    HB2  LYS  44           HB2      LYS  44 320.003  17.048  -5.907
  992    HB3  LYS  44           HB3      LYS  44 318.913  16.416  -4.685
  993    HG2  LYS  44           HG2      LYS  44 319.124  18.989  -5.054
  994    HG3  LYS  44           HG3      LYS  44 318.979  18.343  -3.427
  995    HD2  LYS  44           HD2      LYS  44 320.793  19.558  -2.985
  996    HD3  LYS  44           HD3      LYS  44 321.691  18.380  -3.883
  997    HE2  LYS  44           HE2      LYS  44 322.313  20.406  -4.834
  998    HE3  LYS  44           HE3      LYS  44 321.124  19.740  -5.948
  999    HZ1  LYS  44           HZ1      LYS  44 321.028  22.226  -5.004
 1000    HZ2  LYS  44           HZ2      LYS  44 320.068  21.446  -3.851
 1001    HZ3  LYS  44           HZ3      LYS  44 319.656  21.363  -5.489
 1002    H    ALA  45           H        ALA  45 320.192  14.278  -2.718
 1003    HA   ALA  45           HA       ALA  45 319.523  15.775  -0.402
 1004    HB1  ALA  45           HB1      ALA  45 320.189  13.250   0.537
 1005    HB2  ALA  45           HB2      ALA  45 319.625  12.956  -1.116
 1006    HB3  ALA  45           HB3      ALA  45 318.581  13.790   0.035
 1007    H    TYR  46           H        TYR  46 322.327  13.781  -1.269
 1008    HA   TYR  46           HA       TYR  46 323.827  14.179   1.008
 1009    HB2  TYR  46           HB2      TYR  46 324.290  12.772  -1.206
 1010    HB3  TYR  46           HB3      TYR  46 325.286  14.169  -1.595
 1011    HD1  TYR  46           HD1      TYR  46 324.943  13.414   1.902
 1012    HD2  TYR  46           HD2      TYR  46 327.233  12.568  -1.557
 1013    HE1  TYR  46           HE1      TYR  46 326.687  12.499   3.321
 1014    HE2  TYR  46           HE2      TYR  46 329.016  11.631  -0.144
 1015    HH   TYR  46           HH       TYR  46 328.582  11.133   3.279
 1016    H    CYS  47           H        CYS  47 323.608  16.324  -1.908
 1017    HA   CYS  47           HA       CYS  47 325.587  18.121  -1.144
 1018    HB2  CYS  47           HB2      CYS  47 324.729  18.225  -3.347
 1019    HB3  CYS  47           HB3      CYS  47 323.075  18.212  -2.793
 1020    HG   CYS  47           HG       CYS  47 323.098  20.635  -3.000
 1021    H    GLU  48           H        GLU  48 322.053  18.542  -0.961
 1022    HA   GLU  48           HA       GLU  48 322.000  20.727   0.716
 1023    HB2  GLU  48           HB2      GLU  48 319.946  18.563   1.022
 1024    HB3  GLU  48           HB3      GLU  48 319.726  20.307   1.079
 1025    HG2  GLU  48           HG2      GLU  48 320.178  20.381  -1.377
 1026    HG3  GLU  48           HG3      GLU  48 320.258  18.638  -1.345
 1027    H    ARG  49           H        ARG  49 322.778  17.466   1.332
 1028    HA   ARG  49           HA       ARG  49 322.370  17.342   4.148
 1029    HB2  ARG  49           HB2      ARG  49 323.014  15.650   1.994
 1030    HB3  ARG  49           HB3      ARG  49 324.334  15.534   3.118
 1031    HG2  ARG  49           HG2      ARG  49 322.459  15.132   4.838
 1032    HG3  ARG  49           HG3      ARG  49 321.507  14.742   3.389
 1033    HD2  ARG  49           HD2      ARG  49 322.615  12.756   4.143
 1034    HD3  ARG  49           HD3      ARG  49 323.322  13.267   2.646
 1035    HE   ARG  49           HE       ARG  49 325.287  13.446   3.783
 1036   HH11  ARG  49          HH11      ARG  49 322.701  13.815   6.092
 1037   HH12  ARG  49          HH12      ARG  49 323.762  14.183   7.408
 1038   HH21  ARG  49          HH21      ARG  49 326.688  13.920   5.519
 1039   HH22  ARG  49          HH22      ARG  49 326.023  14.237   7.086
 1040    H    GLN  50           H        GLN  50 325.295  17.312   2.134
 1041    HA   GLN  50           HA       GLN  50 326.990  17.856   4.415
 1042    HB2  GLN  50           HB2      GLN  50 327.591  17.149   1.593
 1043    HB3  GLN  50           HB3      GLN  50 328.814  17.382   2.801
 1044    HG2  GLN  50           HG2      GLN  50 327.742  15.513   4.096
 1045    HG3  GLN  50           HG3      GLN  50 326.725  15.234   2.682
 1046   HE21  GLN  50          HE21      GLN  50 327.897  14.947   0.624
 1047   HE22  GLN  50          HE22      GLN  50 329.356  14.027   0.647
 1048    H    GLY  51           H        GLY  51 325.773  19.456   1.622
 1049    HA2  GLY  51           HA2      GLY  51 325.841  21.821   1.359
 1050    HA3  GLY  51           HA3      GLY  51 327.299  21.856   2.351
 1051    H    LEU  52           H        LEU  52 326.246  20.107  -0.564
 1052    HA   LEU  52           HA       LEU  52 328.789  20.800  -1.870
 1053    HB2  LEU  52           HB2      LEU  52 326.945  18.501  -2.554
 1054    HB3  LEU  52           HB3      LEU  52 328.613  18.740  -3.049
 1055    HG   LEU  52           HG       LEU  52 328.215  18.597  -0.143
 1056   HD11  LEU  52          HD11      LEU  52 328.315  15.907  -1.089
 1057   HD12  LEU  52          HD12      LEU  52 326.848  16.697  -1.666
 1058   HD13  LEU  52          HD13      LEU  52 327.208  16.655   0.063
 1059   HD21  LEU  52          HD21      LEU  52 330.271  17.534  -0.194
 1060   HD22  LEU  52          HD22      LEU  52 330.342  18.733  -1.494
 1061   HD23  LEU  52          HD23      LEU  52 330.067  17.027  -1.874
 1062    H    SER  53           H        SER  53 327.471  19.842  -4.507
 1063    HA   SER  53           HA       SER  53 325.601  22.048  -4.816
 1064    HB2  SER  53           HB2      SER  53 327.136  21.112  -7.160
 1065    HB3  SER  53           HB3      SER  53 326.690  22.730  -6.668
 1066    HG   SER  53           HG       SER  53 328.587  22.954  -5.838
 1067    H    MET  54           H        MET  54 326.195  18.716  -5.026
 1068    HA   MET  54           HA       MET  54 324.653  17.016  -5.405
 1069    HB2  MET  54           HB2      MET  54 322.703  18.391  -5.391
 1070    HB3  MET  54           HB3      MET  54 323.101  19.120  -6.916
 1071    HG2  MET  54           HG2      MET  54 323.024  16.576  -7.666
 1072    HG3  MET  54           HG3      MET  54 321.884  16.521  -6.337
 1073    HE1  MET  54           HE1      MET  54 321.762  19.595  -9.606
 1074    HE2  MET  54           HE2      MET  54 321.978  18.003 -10.333
 1075    HE3  MET  54           HE3      MET  54 323.118  18.579  -9.117
 1076    H    ARG  55           H        ARG  55 325.113  19.169  -8.124
 1077    HA   ARG  55           HA       ARG  55 325.549  16.989  -9.958
 1078    HB2  ARG  55           HB2      ARG  55 326.212  19.189 -11.371
 1079    HB3  ARG  55           HB3      ARG  55 324.550  18.655 -11.149
 1080    HG2  ARG  55           HG2      ARG  55 324.167  20.238  -9.427
 1081    HG3  ARG  55           HG3      ARG  55 325.889  20.608  -9.296
 1082    HD2  ARG  55           HD2      ARG  55 323.906  21.475 -11.348
 1083    HD3  ARG  55           HD3      ARG  55 325.130  22.414 -10.496
 1084    HE   ARG  55           HE       ARG  55 326.692  21.797 -12.087
 1085   HH11  ARG  55          HH11      ARG  55 323.720  20.029 -12.589
 1086   HH12  ARG  55          HH12      ARG  55 324.175  19.472 -14.163
 1087   HH21  ARG  55          HH21      ARG  55 327.287  21.060 -14.156
 1088   HH22  ARG  55          HH22      ARG  55 326.198  20.054 -15.052
 1089    H    GLN  56           H        GLN  56 327.426  19.399  -8.214
 1090    HA   GLN  56           HA       GLN  56 329.819  19.136  -9.599
 1091    HB2  GLN  56           HB2      GLN  56 328.863  20.292  -7.077
 1092    HB3  GLN  56           HB3      GLN  56 330.586  19.919  -7.127
 1093    HG2  GLN  56           HG2      GLN  56 330.809  21.239  -9.178
 1094    HG3  GLN  56           HG3      GLN  56 329.096  21.638  -9.094
 1095   HE21  GLN  56          HE21      GLN  56 331.991  21.725  -7.042
 1096   HE22  GLN  56          HE22      GLN  56 331.668  23.278  -6.357
 1097    H    ILE  57           H        ILE  57 328.528  17.191  -6.903
 1098    HA   ILE  57           HA       ILE  57 331.041  16.018  -6.315
 1099    HB   ILE  57           HB       ILE  57 329.565  14.226  -5.166
 1100   HG12  ILE  57          HG12      ILE  57 327.568  16.033  -6.298
 1101   HG13  ILE  57          HG13      ILE  57 327.376  14.419  -5.643
 1102   HG21  ILE  57          HG21      ILE  57 329.468  15.527  -3.207
 1103   HG22  ILE  57          HG22      ILE  57 329.401  17.032  -4.135
 1104   HG23  ILE  57          HG23      ILE  57 330.882  16.072  -4.116
 1105   HD11  ILE  57          HD11      ILE  57 327.576  16.950  -4.054
 1106   HD12  ILE  57          HD12      ILE  57 327.357  15.323  -3.401
 1107   HD13  ILE  57          HD13      ILE  57 326.089  16.053  -4.393
 1108    H    ARG  58           H        ARG  58 331.061  13.479  -6.270
 1109    HA   ARG  58           HA       ARG  58 330.211  12.499  -8.894
 1110    HB2  ARG  58           HB2      ARG  58 332.792  11.475  -7.956
 1111    HB3  ARG  58           HB3      ARG  58 332.299  11.991  -9.563
 1112    HG2  ARG  58           HG2      ARG  58 332.900  13.957  -7.374
 1113    HG3  ARG  58           HG3      ARG  58 334.148  13.308  -8.428
 1114    HD2  ARG  58           HD2      ARG  58 333.076  14.215 -10.353
 1115    HD3  ARG  58           HD3      ARG  58 331.671  14.690  -9.424
 1116    HE   ARG  58           HE       ARG  58 332.768  16.613  -8.905
 1117   HH11  ARG  58          HH11      ARG  58 335.148  14.219  -9.794
 1118   HH12  ARG  58          HH12      ARG  58 336.481  15.314  -9.656
 1119   HH21  ARG  58          HH21      ARG  58 334.521  18.054  -8.730
 1120   HH22  ARG  58          HH22      ARG  58 336.127  17.490  -9.053
 1121    H    PHE  59           H        PHE  59 328.959  10.768  -8.530
 1122    HA   PHE  59           HA       PHE  59 329.337   9.289  -6.031
 1123    HB2  PHE  59           HB2      PHE  59 327.011   9.392  -7.926
 1124    HB3  PHE  59           HB3      PHE  59 327.145   8.209  -6.663
 1125    HD1  PHE  59           HD1      PHE  59 328.397  11.556  -5.985
 1126    HD2  PHE  59           HD2      PHE  59 325.026   8.968  -5.779
 1127    HE1  PHE  59           HE1      PHE  59 327.315  13.082  -4.391
 1128    HE2  PHE  59           HE2      PHE  59 323.942  10.497  -4.199
 1129    HZ   PHE  59           HZ       PHE  59 325.085  12.564  -3.503
 1130    H    ARG  60           H        ARG  60 329.129   7.069  -5.959
 1131    HA   ARG  60           HA       ARG  60 329.400   5.466  -8.323
 1132    HB2  ARG  60           HB2      ARG  60 331.790   6.282  -7.554
 1133    HB3  ARG  60           HB3      ARG  60 331.565   5.059  -6.311
 1134    HG2  ARG  60           HG2      ARG  60 330.837   3.696  -8.529
 1135    HG3  ARG  60           HG3      ARG  60 332.052   4.778  -9.185
 1136    HD2  ARG  60           HD2      ARG  60 332.474   2.356  -7.853
 1137    HD3  ARG  60           HD3      ARG  60 333.676   3.540  -8.357
 1138    HE   ARG  60           HE       ARG  60 333.289   4.572  -6.086
 1139   HH11  ARG  60          HH11      ARG  60 332.886   1.147  -6.678
 1140   HH12  ARG  60          HH12      ARG  60 333.203   0.707  -5.035
 1141   HH21  ARG  60          HH21      ARG  60 333.708   3.981  -3.934
 1142   HH22  ARG  60          HH22      ARG  60 333.669   2.310  -3.481
 1143    H    PHE  61           H        PHE  61 328.490   3.513  -7.951
 1144    HA   PHE  61           HA       PHE  61 327.582   3.035  -5.220
 1145    HB2  PHE  61           HB2      PHE  61 325.751   2.880  -6.667
 1146    HB3  PHE  61           HB3      PHE  61 326.674   2.070  -7.921
 1147    HD1  PHE  61           HD2      PHE  61 325.773   1.510  -4.360
 1148    HD2  PHE  61           HD1      PHE  61 326.137  -0.139  -8.259
 1149    HE1  PHE  61           HE2      PHE  61 324.955  -0.654  -3.517
 1150    HE2  PHE  61           HE1      PHE  61 325.320  -2.309  -7.429
 1151    HZ   PHE  61           HZ       PHE  61 324.728  -2.569  -5.051
 1152    H    ASP  62           H        ASP  62 327.876   0.925  -4.252
 1153    HA   ASP  62           HA       ASP  62 330.379   0.034  -4.101
 1154    HB2  ASP  62           HB2      ASP  62 328.659  -0.610  -2.567
 1155    HB3  ASP  62           HB3      ASP  62 327.929  -1.600  -3.803
 1156    H    GLY  63           H        GLY  63 331.285   0.059  -6.256
 1157    HA2  GLY  63           HA2      GLY  63 332.415  -1.732  -7.467
 1158    HA3  GLY  63           HA3      GLY  63 330.854  -2.520  -7.629
 1159    H    GLN  64           H        GLN  64 329.527   0.078  -8.316
 1160    HA   GLN  64           HA       GLN  64 330.790   0.632 -10.892
 1161    HB2  GLN  64           HB2      GLN  64 329.137  -0.149 -12.175
 1162    HB3  GLN  64           HB3      GLN  64 328.680  -1.082 -10.753
 1163    HG2  GLN  64           HG2      GLN  64 327.399   1.102 -10.159
 1164    HG3  GLN  64           HG3      GLN  64 327.452   1.373 -11.882
 1165   HE21  GLN  64          HE21      GLN  64 326.827  -1.333  -9.668
 1166   HE22  GLN  64          HE22      GLN  64 325.420  -1.907 -10.489
 1167    HA   PRO  65           HA       PRO  65 329.395   4.790 -10.325
 1168    HB2  PRO  65           HB2      PRO  65 328.852   5.100 -13.148
 1169    HB3  PRO  65           HB3      PRO  65 330.296   5.607 -12.271
 1170    HG2  PRO  65           HG2      PRO  65 330.318   3.661 -14.148
 1171    HG3  PRO  65           HG3      PRO  65 331.384   3.614 -12.726
 1172    HD2  PRO  65           HD2      PRO  65 328.700   2.293 -13.091
 1173    HD3  PRO  65           HD3      PRO  65 330.222   1.566 -12.581
 1174    H    ILE  66           H        ILE  66 327.559   6.356 -10.875
 1175    HA   ILE  66           HA       ILE  66 325.127   4.994 -11.692
 1176    HB   ILE  66           HB       ILE  66 323.863   5.649  -9.922
 1177   HG12  ILE  66          HG12      ILE  66 326.238   7.214  -9.101
 1178   HG13  ILE  66          HG13      ILE  66 324.541   7.641  -9.073
 1179   HG21  ILE  66          HG21      ILE  66 325.637   3.642  -9.846
 1180   HG22  ILE  66          HG22      ILE  66 324.463   3.928  -8.557
 1181   HG23  ILE  66          HG23      ILE  66 326.116   4.516  -8.390
 1182   HD11  ILE  66          HD11      ILE  66 325.845   5.728  -7.157
 1183   HD12  ILE  66          HD12      ILE  66 324.191   6.336  -7.089
 1184   HD13  ILE  66          HD13      ILE  66 325.540   7.435  -6.836
 1185    H    ASN  67           H        ASN  67 326.449   6.623 -13.008
 1186    HA   ASN  67           HA       ASN  67 326.573   9.140 -13.442
 1187    HB2  ASN  67           HB2      ASN  67 324.829   7.792 -15.450
 1188    HB3  ASN  67           HB3      ASN  67 326.099   8.974 -15.727
 1189   HD21  ASN  67          HD21      ASN  67 325.313   5.765 -15.893
 1190   HD22  ASN  67          HD22      ASN  67 326.901   5.090 -15.959
 1191    H    GLU  68           H        GLU  68 324.922   9.573 -11.569
 1192    HA   GLU  68           HA       GLU  68 323.100  10.657 -10.783
 1193    HB2  GLU  68           HB2      GLU  68 322.651  12.338 -13.100
 1194    HB3  GLU  68           HB3      GLU  68 323.142  12.765 -11.468
 1195    HG2  GLU  68           HG2      GLU  68 325.410  12.456 -11.954
 1196    HG3  GLU  68           HG3      GLU  68 325.043  11.591 -13.442
 1197    H    THR  69           H        THR  69 322.537   8.730 -13.497
 1198    HA   THR  69           HA       THR  69 319.655   9.189 -13.210
 1199    HB   THR  69           HB       THR  69 319.334   8.826 -15.538
 1200    HG1  THR  69           HG1      THR  69 322.067   8.100 -15.543
 1201   HG21  THR  69          HG21      THR  69 320.235  11.064 -14.797
 1202   HG22  THR  69          HG22      THR  69 320.386  10.674 -16.513
 1203   HG23  THR  69          HG23      THR  69 321.790  10.541 -15.447
 1204    H    ASP  70           H        ASP  70 322.117   7.093 -12.632
 1205    HA   ASP  70           HA       ASP  70 320.888   4.631 -13.418
 1206    HB2  ASP  70           HB2      ASP  70 323.116   5.131 -11.449
 1207    HB3  ASP  70           HB3      ASP  70 322.735   3.623 -12.205
 1208    H    THR  71           H        THR  71 319.266   3.714 -12.343
 1209    HA   THR  71           HA       THR  71 318.571   4.732  -9.707
 1210    HB   THR  71           HB       THR  71 316.462   3.839 -10.025
 1211    HG1  THR  71           HG1      THR  71 316.416   1.809 -10.505
 1212   HG21  THR  71          HG21      THR  71 315.670   4.384 -12.165
 1213   HG22  THR  71          HG22      THR  71 317.225   4.027 -12.919
 1214   HG23  THR  71          HG23      THR  71 317.047   5.455 -11.895
 1215    HA   PRO  72           HA       PRO  72 320.516   1.594  -7.358
 1216    HB2  PRO  72           HB2      PRO  72 318.010   1.123  -5.878
 1217    HB3  PRO  72           HB3      PRO  72 319.594   1.647  -5.296
 1218    HG2  PRO  72           HG2      PRO  72 317.370   3.277  -5.596
 1219    HG3  PRO  72           HG3      PRO  72 319.042   3.823  -5.428
 1220    HD2  PRO  72           HD2      PRO  72 317.313   3.918  -7.753
 1221    HD3  PRO  72           HD3      PRO  72 318.901   4.658  -7.511
 1222    H    ALA  73           H        ALA  73 317.145   0.928  -8.289
 1223    HA   ALA  73           HA       ALA  73 317.232  -1.855  -8.311
 1224    HB1  ALA  73           HB1      ALA  73 315.110  -1.496  -8.888
 1225    HB2  ALA  73           HB2      ALA  73 315.653  -1.094 -10.518
 1226    HB3  ALA  73           HB3      ALA  73 315.475   0.176  -9.310
 1227    H    GLN  74           H        GLN  74 317.662   0.298 -11.141
 1228    HA   GLN  74           HA       GLN  74 318.334  -1.476 -13.029
 1229    HB2  GLN  74           HB2      GLN  74 318.756   1.287 -12.518
 1230    HB3  GLN  74           HB3      GLN  74 320.070   0.630 -13.455
 1231    HG2  GLN  74           HG2      GLN  74 318.580  -0.099 -15.156
 1232    HG3  GLN  74           HG3      GLN  74 317.177   0.302 -14.165
 1233   HE21  GLN  74          HE21      GLN  74 320.144   2.100 -14.879
 1234   HE22  GLN  74          HE22      GLN  74 319.352   3.482 -15.548
 1235    H    LEU  75           H        LEU  75 320.439  -0.257 -10.478
 1236    HA   LEU  75           HA       LEU  75 322.713  -1.733 -11.502
 1237    HB2  LEU  75           HB2      LEU  75 322.572  -0.203  -8.917
 1238    HB3  LEU  75           HB3      LEU  75 323.986  -0.570  -9.883
 1239    HG   LEU  75           HG       LEU  75 321.913   1.567 -10.323
 1240   HD11  LEU  75          HD11      LEU  75 323.908   2.934 -10.627
 1241   HD12  LEU  75          HD12      LEU  75 324.919   1.512 -10.372
 1242   HD13  LEU  75          HD13      LEU  75 323.901   2.115  -9.065
 1243   HD21  LEU  75          HD21      LEU  75 321.851   0.960 -12.495
 1244   HD22  LEU  75          HD22      LEU  75 323.355   0.044 -12.401
 1245   HD23  LEU  75          HD23      LEU  75 323.400   1.804 -12.541
 1246    H    GLU  76           H        GLU  76 320.169  -2.032  -9.263
 1247    HA   GLU  76           HA       GLU  76 319.396  -3.843  -8.183
 1248    HB2  GLU  76           HB2      GLU  76 322.080  -5.141  -8.644
 1249    HB3  GLU  76           HB3      GLU  76 320.635  -5.932  -8.034
 1250    HG2  GLU  76           HG2      GLU  76 319.618  -4.980 -10.286
 1251    HG3  GLU  76           HG3      GLU  76 321.308  -5.074 -10.784
 1252    H    MET  77           H        MET  77 320.764  -1.588  -6.992
 1253    HA   MET  77           HA       MET  77 322.413  -2.189  -4.848
 1254    HB2  MET  77           HB2      MET  77 320.233  -0.127  -5.141
 1255    HB3  MET  77           HB3      MET  77 321.363  -0.136  -3.788
 1256    HG2  MET  77           HG2      MET  77 323.091  -0.296  -5.824
 1257    HG3  MET  77           HG3      MET  77 321.784   0.560  -6.624
 1258    HE1  MET  77           HE1      MET  77 322.000   3.171  -6.742
 1259    HE2  MET  77           HE2      MET  77 323.460   2.267  -7.168
 1260    HE3  MET  77           HE3      MET  77 323.582   3.723  -6.181
 1261    H    GLU  78           H        GLU  78 321.476  -1.841  -2.394
 1262    HA   GLU  78           HA       GLU  78 319.042  -3.360  -2.027
 1263    HB2  GLU  78           HB2      GLU  78 321.766  -4.214  -1.048
 1264    HB3  GLU  78           HB3      GLU  78 320.274  -4.797  -0.338
 1265    HG2  GLU  78           HG2      GLU  78 319.928  -6.255  -1.985
 1266    HG3  GLU  78           HG3      GLU  78 320.346  -5.084  -3.230
 1267    H    ASP  79           H        ASP  79 318.532  -3.422   0.377
 1268    HA   ASP  79           HA       ASP  79 318.473  -0.837   1.407
 1269    HB2  ASP  79           HB2      ASP  79 317.531  -3.413   2.222
 1270    HB3  ASP  79           HB3      ASP  79 318.262  -2.609   3.607
 1271    H    GLU  80           H        GLU  80 319.928   0.386   2.322
 1272    HA   GLU  80           HA       GLU  80 321.614   1.075   3.703
 1273    HB2  GLU  80           HB2      GLU  80 322.288  -1.798   4.272
 1274    HB3  GLU  80           HB3      GLU  80 322.736  -0.374   5.199
 1275    HG2  GLU  80           HG2      GLU  80 320.267   0.012   5.577
 1276    HG3  GLU  80           HG3      GLU  80 320.017  -1.600   4.913
 1277    H    ASP  81           H        ASP  81 321.870  -0.331   0.799
 1278    HA   ASP  81           HA       ASP  81 324.607  -0.909   0.573
 1279    HB2  ASP  81           HB2      ASP  81 322.379  -0.563  -1.235
 1280    HB3  ASP  81           HB3      ASP  81 323.801   0.247  -1.873
 1281    H    THR  82           H        THR  82 326.196   0.497  -0.476
 1282    HA   THR  82           HA       THR  82 325.807   3.289   0.413
 1283    HB   THR  82           HB       THR  82 328.496   1.997   0.012
 1284    HG1  THR  82           HG1      THR  82 327.311   0.818   1.586
 1285   HG21  THR  82          HG21      THR  82 328.467   4.432   0.155
 1286   HG22  THR  82          HG22      THR  82 329.237   3.705   1.571
 1287   HG23  THR  82          HG23      THR  82 327.586   4.323   1.686
 1288    H    ILE  83           H        ILE  83 326.900   4.977  -0.807
 1289    HA   ILE  83           HA       ILE  83 327.644   4.326  -3.566
 1290    HB   ILE  83           HB       ILE  83 325.599   6.380  -2.712
 1291   HG12  ILE  83          HG12      ILE  83 325.409   4.166  -4.760
 1292   HG13  ILE  83          HG13      ILE  83 324.845   4.030  -3.097
 1293   HG21  ILE  83          HG21      ILE  83 325.561   7.210  -4.995
 1294   HG22  ILE  83          HG22      ILE  83 326.776   6.031  -5.481
 1295   HG23  ILE  83          HG23      ILE  83 327.206   7.334  -4.377
 1296   HD11  ILE  83          HD11      ILE  83 323.301   5.894  -3.497
 1297   HD12  ILE  83          HD12      ILE  83 323.004   4.516  -4.555
 1298   HD13  ILE  83          HD13      ILE  83 323.831   5.942  -5.179
 1299    H    ASP  84           H        ASP  84 329.776   4.887  -3.291
 1300    HA   ASP  84           HA       ASP  84 330.664   6.933  -1.635
 1301    HB2  ASP  84           HB2      ASP  84 331.802   4.946  -3.327
 1302    HB3  ASP  84           HB3      ASP  84 332.658   6.468  -3.540
 1303    H    VAL  85           H        VAL  85 330.850   8.926  -1.771
 1304    HA   VAL  85           HA       VAL  85 330.646  10.444  -4.304
 1305    HB   VAL  85           HB       VAL  85 330.265  11.316  -1.440
 1306   HG11  VAL  85          HG11      VAL  85 330.262  12.926  -3.970
 1307   HG12  VAL  85          HG12      VAL  85 331.164  13.219  -2.485
 1308   HG13  VAL  85          HG13      VAL  85 329.416  13.470  -2.516
 1309   HG21  VAL  85          HG21      VAL  85 328.188  10.710  -1.675
 1310   HG22  VAL  85          HG22      VAL  85 328.493  10.183  -3.330
 1311   HG23  VAL  85          HG23      VAL  85 328.020  11.851  -3.005
 1312    H    PHE  86           H        PHE  86 332.470  11.567  -4.992
 1313    HA   PHE  86           HA       PHE  86 334.513  12.197  -3.032
 1314    HB2  PHE  86           HB2      PHE  86 334.915  10.317  -5.336
 1315    HB3  PHE  86           HB3      PHE  86 336.232  11.370  -4.825
 1316    HD1  PHE  86           HD2      PHE  86 337.012  11.237  -2.425
 1317    HD2  PHE  86           HD1      PHE  86 334.452   8.333  -4.191
 1318    HE1  PHE  86           HE2      PHE  86 337.611   9.638  -0.653
 1319    HE2  PHE  86           HE1      PHE  86 335.045   6.729  -2.423
 1320    HZ   PHE  86           HZ       PHE  86 336.627   7.380  -0.651
 1321    H    GLN  87           H        GLN  87 334.449  14.257  -3.290
 1322    HA   GLN  87           HA       GLN  87 335.070  15.382  -5.907
 1323    HB2  GLN  87           HB2      GLN  87 332.528  15.206  -5.369
 1324    HB3  GLN  87           HB3      GLN  87 332.813  16.624  -4.380
 1325    HG2  GLN  87           HG2      GLN  87 333.998  16.950  -6.986
 1326    HG3  GLN  87           HG3      GLN  87 332.310  16.501  -7.114
 1327   HE21  GLN  87          HE21      GLN  87 330.895  17.715  -5.355
 1328   HE22  GLN  87          HE22      GLN  87 331.158  19.424  -5.319
 1329    H    GLN  88           H        GLN  88 336.771  16.636  -5.646
 1330    HA   GLN  88           HA       GLN  88 337.720  17.585  -3.191
 1331    HB2  GLN  88           HB2      GLN  88 338.299  18.519  -5.997
 1332    HB3  GLN  88           HB3      GLN  88 339.193  19.055  -4.583
 1333    HG2  GLN  88           HG2      GLN  88 339.003  16.151  -4.839
 1334    HG3  GLN  88           HG3      GLN  88 339.854  16.940  -6.167
 1335   HE21  GLN  88          HE21      GLN  88 341.319  18.819  -5.220
 1336   HE22  GLN  88          HE22      GLN  88 342.384  18.297  -3.964
 1337    H    GLN  89           H        GLN  89 336.788  19.048  -1.919
 1338    HA   GLN  89           HA       GLN  89 335.272  21.233  -3.166
 1339    HB2  GLN  89           HB2      GLN  89 334.226  21.516  -0.935
 1340    HB3  GLN  89           HB3      GLN  89 333.953  19.922  -1.625
 1341    HG2  GLN  89           HG2      GLN  89 334.847  18.947   0.143
 1342    HG3  GLN  89           HG3      GLN  89 336.331  19.880  -0.039
 1343   HE21  GLN  89          HE21      GLN  89 333.576  19.351   1.827
 1344   HE22  GLN  89          HE22      GLN  89 333.747  20.685   2.912
 1345    H    THR  90           H        THR  90 335.664  23.365  -2.656
 1346    HA   THR  90           HA       THR  90 337.358  24.288  -0.624
 1347    HB   THR  90           HB       THR  90 339.215  23.309  -1.716
 1348    HG1  THR  90           HG1      THR  90 339.154  25.969  -2.685
 1349   HG21  THR  90          HG21      THR  90 337.800  24.010  -4.177
 1350   HG22  THR  90          HG22      THR  90 338.907  22.680  -3.835
 1351   HG23  THR  90          HG23      THR  90 339.543  24.279  -4.221
 1352    H1   THR   2           HT1      THR   2 324.840  13.331  10.008
 1353    H2   THR   2           HT2      THR   2 323.392  13.194   9.097
 1354    H3   THR   2           HT3      THR   2 324.620  12.005   8.945
 1355    HA   THR   2           HA       THR   2 322.643  11.412  10.308
 1356    HB   THR   2           HB       THR   2 324.208  10.448  12.109
 1357    HG1  THR   2           HG1      THR   2 326.041  11.439  12.235
 1358   HG21  THR   2          HG21      THR   2 323.820   8.979  10.367
 1359   HG22  THR   2          HG22      THR   2 325.576   9.151  10.364
 1360   HG23  THR   2          HG23      THR   2 324.602  10.022   9.179
 1361    H    VAL   3           H        VAL   3 322.422  14.173  10.591
 1362    HA   VAL   3           HA       VAL   3 322.443  14.516  13.520
 1363    HB   VAL   3           HB       VAL   3 322.467  16.724  11.459
 1364   HG11  VAL   3          HG11      VAL   3 322.936  18.184  13.327
 1365   HG12  VAL   3          HG12      VAL   3 322.952  16.812  14.434
 1366   HG13  VAL   3          HG13      VAL   3 321.451  17.285  13.637
 1367   HG21  VAL   3          HG21      VAL   3 324.832  16.336  13.155
 1368   HG22  VAL   3          HG22      VAL   3 324.715  16.757  11.447
 1369   HG23  VAL   3          HG23      VAL   3 324.567  15.074  11.953
 1370    H    GLY   4           H        GLY   4 320.613  15.005  10.541
 1371    HA2  GLY   4           HA2      GLY   4 318.185  15.308  12.200
 1372    HA3  GLY   4           HA3      GLY   4 318.439  16.262  10.746
 1373    H    ASP   5           H        ASP   5 316.400  15.396  10.011
 1374    HA   ASP   5           HA       ASP   5 315.821  12.700   9.653
 1375    HB2  ASP   5           HB2      ASP   5 314.658  15.164   8.925
 1376    HB3  ASP   5           HB3      ASP   5 314.802  14.235   7.436
 1377    H    GLU   6           H        GLU   6 315.405  11.981   7.138
 1378    HA   GLU   6           HA       GLU   6 318.117  11.810   6.067
 1379    HB2  GLU   6           HB2      GLU   6 316.723   9.736   6.545
 1380    HB3  GLU   6           HB3      GLU   6 315.728  10.197   5.173
 1381    HG2  GLU   6           HG2      GLU   6 317.914   8.560   5.069
 1382    HG3  GLU   6           HG3      GLU   6 317.205   9.412   3.695
 1383    H    ILE   7           H        ILE   7 315.085  13.271   5.390
 1384    HA   ILE   7           HA       ILE   7 314.394  14.660   3.721
 1385    HB   ILE   7           HB       ILE   7 317.230  14.575   2.692
 1386   HG12  ILE   7          HG12      ILE   7 316.347  16.831   4.391
 1387   HG13  ILE   7          HG13      ILE   7 316.595  15.302   5.227
 1388   HG21  ILE   7          HG21      ILE   7 315.750  15.566   1.110
 1389   HG22  ILE   7          HG22      ILE   7 316.637  16.872   1.896
 1390   HG23  ILE   7          HG23      ILE   7 314.969  16.535   2.359
 1391   HD11  ILE   7          HD11      ILE   7 318.870  15.202   4.474
 1392   HD12  ILE   7          HD12      ILE   7 318.577  16.769   5.230
 1393   HD13  ILE   7          HD13      ILE   7 318.641  16.635   3.473
 1394    H    VAL   8           H        VAL   8 313.492  14.463   1.712
 1395    HA   VAL   8           HA       VAL   8 312.641  13.360  -0.078
 1396    HB   VAL   8           HB       VAL   8 314.841  14.153  -0.975
 1397   HG11  VAL   8          HG11      VAL   8 316.510  12.938   0.073
 1398   HG12  VAL   8          HG12      VAL   8 316.438  12.195  -1.523
 1399   HG13  VAL   8          HG13      VAL   8 315.675  11.401  -0.147
 1400   HG21  VAL   8          HG21      VAL   8 312.985  12.979  -2.282
 1401   HG22  VAL   8          HG22      VAL   8 314.047  11.571  -2.277
 1402   HG23  VAL   8          HG23      VAL   8 314.580  13.074  -3.030
 1403    H    ASP   9           H        ASP   9 312.307  11.246  -1.169
 1404    HA   ASP   9           HA       ASP   9 313.221   8.892   0.236
 1405    HB2  ASP   9           HB2      ASP   9 310.294   9.658   0.267
 1406    HB3  ASP   9           HB3      ASP   9 310.938   8.102   0.781
 1407    H    LEU  10           H        LEU  10 310.532   9.885  -1.910
 1408    HA   LEU  10           HA       LEU  10 311.591   8.650  -4.208
 1409    HB2  LEU  10           HB2      LEU  10 310.983   6.680  -2.648
 1410    HB3  LEU  10           HB3      LEU  10 309.322   7.061  -3.059
 1411    HG   LEU  10           HG       LEU  10 310.046   6.810  -5.502
 1412   HD11  LEU  10          HD11      LEU  10 312.414   6.898  -5.260
 1413   HD12  LEU  10          HD12      LEU  10 311.993   5.267  -5.786
 1414   HD13  LEU  10          HD13      LEU  10 312.398   5.575  -4.101
 1415   HD21  LEU  10          HD21      LEU  10 308.653   5.125  -4.844
 1416   HD22  LEU  10          HD22      LEU  10 309.679   4.661  -3.487
 1417   HD23  LEU  10          HD23      LEU  10 310.127   4.209  -5.122
 1418    H    THR  11           H        THR  11 309.931   8.424  -5.967
 1419    HA   THR  11           HA       THR  11 308.561  10.724  -6.465
 1420    HB   THR  11           HB       THR  11 307.019   8.784  -7.749
 1421    HG1  THR  11           HG1      THR  11 308.481   7.221  -8.387
 1422   HG21  THR  11          HG21      THR  11 309.442  10.332  -8.526
 1423   HG22  THR  11          HG22      THR  11 307.783  10.465  -9.109
 1424   HG23  THR  11          HG23      THR  11 308.789   9.107  -9.614
 1425    H    CYS  12           H        CYS  12 306.763  11.668  -5.745
 1426    HA   CYS  12           HA       CYS  12 304.948  10.085  -4.060
 1427    HB2  CYS  12           HB2      CYS  12 306.209  12.531  -3.591
 1428    HB3  CYS  12           HB3      CYS  12 304.538  12.959  -3.943
 1429    HG   CYS  12           HG       CYS  12 304.005  12.299  -1.659
 1430    H    GLU  13           H        GLU  13 303.365   9.308  -5.333
 1431    HA   GLU  13           HA       GLU  13 301.471  11.137  -6.450
 1432    HB2  GLU  13           HB2      GLU  13 301.608  10.072  -8.768
 1433    HB3  GLU  13           HB3      GLU  13 302.853  11.241  -8.351
 1434    HG2  GLU  13           HG2      GLU  13 304.104   9.025  -7.569
 1435    HG3  GLU  13           HG3      GLU  13 303.055   8.326  -8.801
 1436    H    SER  14           H        SER  14 302.569   7.752  -6.718
 1437    HA   SER  14           HA       SER  14 301.478   5.775  -6.457
 1438    HB2  SER  14           HB2      SER  14 300.233   7.592  -4.503
 1439    HB3  SER  14           HB3      SER  14 299.247   6.194  -4.930
 1440    HG   SER  14           HG       SER  14 301.093   4.888  -4.420
 1441    H    LEU  15           H        LEU  15 299.204   4.707  -6.687
 1442    HA   LEU  15           HA       LEU  15 297.704   6.117  -8.794
 1443    HB2  LEU  15           HB2      LEU  15 299.289   3.964  -9.259
 1444    HB3  LEU  15           HB3      LEU  15 297.765   3.169  -8.912
 1445    HG   LEU  15           HG       LEU  15 297.572   5.402 -10.820
 1446   HD11  LEU  15          HD11      LEU  15 299.037   2.875 -11.564
 1447   HD12  LEU  15          HD12      LEU  15 299.728   4.496 -11.498
 1448   HD13  LEU  15          HD13      LEU  15 298.483   4.116 -12.688
 1449   HD21  LEU  15          HD21      LEU  15 295.636   4.114 -10.475
 1450   HD22  LEU  15          HD22      LEU  15 296.524   2.595 -10.598
 1451   HD23  LEU  15          HD23      LEU  15 296.270   3.587 -12.034
 1452    H    GLU  16           H        GLU  16 297.566   3.427  -6.467
 1453    HA   GLU  16           HA       GLU  16 295.900   2.643  -5.137
 1454    HB2  GLU  16           HB2      GLU  16 295.087   5.491  -5.546
 1455    HB3  GLU  16           HB3      GLU  16 293.970   4.393  -4.748
 1456    HG2  GLU  16           HG2      GLU  16 295.027   4.806  -2.853
 1457    HG3  GLU  16           HG3      GLU  16 296.425   3.956  -3.507
 1458    HA   PRO  17           HA       PRO  17 293.174   1.840  -8.838
 1459    HB2  PRO  17           HB2      PRO  17 294.160  -0.495  -9.676
 1460    HB3  PRO  17           HB3      PRO  17 294.937   1.031 -10.115
 1461    HG2  PRO  17           HG2      PRO  17 295.714  -0.958  -8.023
 1462    HG3  PRO  17           HG3      PRO  17 296.744  -0.044  -9.138
 1463    HD2  PRO  17           HD2      PRO  17 296.273   0.632  -6.492
 1464    HD3  PRO  17           HD3      PRO  17 296.838   1.756  -7.743
 1465    H    VAL  18           H        VAL  18 291.777  -0.155  -9.220
 1466    HA   VAL  18           HA       VAL  18 290.594  -0.942  -6.758
 1467    HB   VAL  18           HB       VAL  18 290.024  -2.313  -9.375
 1468   HG11  VAL  18          HG11      VAL  18 288.047  -1.417  -7.309
 1469   HG12  VAL  18          HG12      VAL  18 288.962  -2.910  -7.097
 1470   HG13  VAL  18          HG13      VAL  18 287.907  -2.713  -8.496
 1471   HG21  VAL  18          HG21      VAL  18 288.301  -0.422  -9.665
 1472   HG22  VAL  18          HG22      VAL  18 289.977  -0.101 -10.108
 1473   HG23  VAL  18          HG23      VAL  18 289.341   0.495  -8.575
 1474    H    VAL  19           H        VAL  19 290.283  -3.806  -8.300
 1475    HA   VAL  19           HA       VAL  19 291.193  -5.876  -8.039
 1476    HB   VAL  19           HB       VAL  19 293.803  -4.398  -7.609
 1477   HG11  VAL  19          HG11      VAL  19 293.399  -7.170  -8.737
 1478   HG12  VAL  19          HG12      VAL  19 293.878  -6.843  -7.074
 1479   HG13  VAL  19          HG13      VAL  19 294.928  -6.369  -8.402
 1480   HG21  VAL  19          HG21      VAL  19 293.386  -5.455 -10.267
 1481   HG22  VAL  19          HG22      VAL  19 293.882  -3.842  -9.752
 1482   HG23  VAL  19          HG23      VAL  19 292.170  -4.254  -9.831
 1483    H    VAL  20           H        VAL  20 289.942  -4.666  -5.817
 1484    HA   VAL  20           HA       VAL  20 290.940  -6.299  -3.695
 1485    HB   VAL  20           HB       VAL  20 290.935  -3.956  -2.247
 1486   HG11  VAL  20          HG11      VAL  20 292.454  -5.606  -1.681
 1487   HG12  VAL  20          HG12      VAL  20 293.485  -4.320  -2.309
 1488   HG13  VAL  20          HG13      VAL  20 293.099  -5.712  -3.319
 1489   HG21  VAL  20          HG21      VAL  20 291.144  -2.922  -4.679
 1490   HG22  VAL  20          HG22      VAL  20 292.843  -3.327  -4.436
 1491   HG23  VAL  20          HG23      VAL  20 292.021  -2.254  -3.304
 1492    H    ASP  21           H        ASP  21 289.725  -5.769  -1.555
 1493    HA   ASP  21           HA       ASP  21 287.417  -4.315  -1.334
 1494    HB2  ASP  21           HB2      ASP  21 287.022  -6.365  -3.250
 1495    HB3  ASP  21           HB3      ASP  21 286.115  -6.829  -1.816
 1496    H    LEU  22           H        LEU  22 287.362  -4.266   0.834
 1497    HA   LEU  22           HA       LEU  22 288.161  -6.539   2.421
 1498    HB2  LEU  22           HB2      LEU  22 288.845  -4.615   3.464
 1499    HB3  LEU  22           HB3      LEU  22 287.449  -3.700   2.942
 1500    HG   LEU  22           HG       LEU  22 286.119  -4.488   4.728
 1501   HD11  LEU  22          HD11      LEU  22 287.715  -6.220   6.248
 1502   HD12  LEU  22          HD12      LEU  22 287.800  -6.805   4.585
 1503   HD13  LEU  22          HD13      LEU  22 286.236  -6.603   5.370
 1504   HD21  LEU  22          HD21      LEU  22 287.174  -3.055   6.057
 1505   HD22  LEU  22          HD22      LEU  22 288.711  -3.368   5.254
 1506   HD23  LEU  22          HD23      LEU  22 288.203  -4.379   6.610
 1507    H    THR  23           H        THR  23 286.894  -8.051   3.286
 1508    HA   THR  23           HA       THR  23 284.096  -8.086   2.668
 1509    HB   THR  23           HB       THR  23 284.102 -10.286   3.774
 1510    HG1  THR  23           HG1      THR  23 286.833  -9.776   4.327
 1511   HG21  THR  23          HG21      THR  23 286.640 -10.497   2.326
 1512   HG22  THR  23          HG22      THR  23 285.327  -9.729   1.433
 1513   HG23  THR  23          HG23      THR  23 285.116 -11.352   2.090
 1514    H    HIS  24           H        HIS  24 285.006  -9.267   5.832
 1515    HA   HIS  24           HA       HIS  24 284.405  -7.112   7.456
 1516    HB2  HIS  24           HB2      HIS  24 282.042  -7.637   8.112
 1517    HB3  HIS  24           HB3      HIS  24 282.208  -6.984   6.487
 1518    HD1  HIS  24           HD1      HIS  24 281.917  -8.716   4.501
 1519    HD2  HIS  24           HD2      HIS  24 280.909 -10.138   8.273
 1520    HE1  HIS  24           HE1      HIS  24 280.590 -10.812   4.096
 1521    HE2  HIS  24           HE2      HIS  24 280.071 -11.705   6.394
 1522    H    ASN  25           H        ASN  25 283.875  -7.730   9.698
 1523    HA   ASN  25           HA       ASN  25 284.267  -8.955  11.569
 1524    HB2  ASN  25           HB2      ASN  25 282.521 -10.407  10.106
 1525    HB3  ASN  25           HB3      ASN  25 283.844 -11.562  10.238
 1526   HD21  ASN  25          HD21      ASN  25 283.845 -12.809  11.957
 1527   HD22  ASN  25          HD22      ASN  25 283.028 -12.492  13.446
 1528    H    ASP  26           H        ASP  26 285.763 -10.375  12.629
 1529    HA   ASP  26           HA       ASP  26 288.237 -10.683  11.105
 1530    HB2  ASP  26           HB2      ASP  26 289.268 -11.055  13.370
 1531    HB3  ASP  26           HB3      ASP  26 288.512  -9.478  13.167
  Start of MODEL   10
    1    H1   GLY   1           HT1      GLY   1 286.377 -17.649 -16.708
    2    H2   GLY   1           HT2      GLY   1 287.183 -16.171 -16.547
    3    H3   GLY   1           HT3      GLY   1 285.492 -16.220 -16.509
    4    HA2  GLY   1           HA3      GLY   1 285.523 -17.462 -14.451
    5    HA3  GLY   1           HA2      GLY   1 287.280 -17.473 -14.497
    6    H    THR   2           H        THR   2 285.087 -16.266 -12.689
    7    HA   THR   2           HA       THR   2 285.829 -13.449 -12.781
    8    HB   THR   2           HB       THR   2 283.497 -13.862 -12.426
    9    HG1  THR   2           HG1      THR   2 283.227 -12.626 -10.671
   10   HG21  THR   2          HG21      THR   2 282.750 -15.666 -11.399
   11   HG22  THR   2          HG22      THR   2 283.334 -15.011  -9.869
   12   HG23  THR   2          HG23      THR   2 284.375 -16.056 -10.835
   13    H    GLU   3           H        GLU   3 288.037 -14.866 -12.244
   14    HA   GLU   3           HA       GLU   3 288.619 -15.568  -9.631
   15    HB2  GLU   3           HB2      GLU   3 290.039 -15.798 -11.765
   16    HB3  GLU   3           HB3      GLU   3 290.627 -14.186 -11.380
   17    HG2  GLU   3           HG2      GLU   3 290.890 -15.548  -9.000
   18    HG3  GLU   3           HG3      GLU   3 291.317 -16.751 -10.215
   19    H    ASN   4           H        ASN   4 288.078 -12.422 -10.927
   20    HA   ASN   4           HA       ASN   4 289.511 -11.064  -8.821
   21    HB2  ASN   4           HB2      ASN   4 289.048  -9.072  -9.923
   22    HB3  ASN   4           HB3      ASN   4 289.124 -10.228 -11.248
   23   HD21  ASN   4          HD21      ASN   4 286.505 -11.378 -10.641
   24   HD22  ASN   4          HD22      ASN   4 285.343 -10.211 -11.156
   25    H    ASP   5           H        ASP   5 287.477 -12.866  -7.888
   26    HA   ASP   5           HA       ASP   5 285.401 -11.070  -6.847
   27    HB2  ASP   5           HB2      ASP   5 285.394 -13.795  -7.638
   28    HB3  ASP   5           HB3      ASP   5 285.185 -13.786  -5.889
   29    H    HIS   6           H        HIS   6 284.977 -12.508  -4.368
   30    HA   HIS   6           HA       HIS   6 287.296 -11.435  -2.990
   31    HB2  HIS   6           HB2      HIS   6 284.612 -12.253  -1.900
   32    HB3  HIS   6           HB3      HIS   6 285.966 -11.775  -0.975
   33    HD1  HIS   6           HD1      HIS   6 283.688 -10.290  -3.572
   34    HD2  HIS   6           HD2      HIS   6 286.192  -9.201  -0.443
   35    HE1  HIS   6           HE1      HIS   6 283.322  -7.822  -3.265
   36    HE2  HIS   6           HE2      HIS   6 285.056  -7.152  -1.566
   37    H    ILE   7           H        ILE   7 287.813 -12.421  -0.981
   38    HA   ILE   7           HA       ILE   7 287.518 -15.194  -0.505
   39    HB   ILE   7           HB       ILE   7 289.592 -16.083  -1.027
   40   HG12  ILE   7          HG12      ILE   7 290.697 -13.284  -0.954
   41   HG13  ILE   7          HG13      ILE   7 290.986 -14.564   0.219
   42   HG21  ILE   7          HG21      ILE   7 289.302 -13.932  -3.096
   43   HG22  ILE   7          HG22      ILE   7 288.594 -15.550  -3.132
   44   HG23  ILE   7          HG23      ILE   7 290.342 -15.347  -3.242
   45   HD11  ILE   7          HD11      ILE   7 292.894 -14.793  -0.946
   46   HD12  ILE   7          HD12      ILE   7 292.211 -14.081  -2.412
   47   HD13  ILE   7          HD13      ILE   7 291.868 -15.764  -2.006
   48    H    ASN   8           H        ASN   8 288.102 -15.654   1.612
   49    HA   ASN   8           HA       ASN   8 288.495 -13.270   3.195
   50    HB2  ASN   8           HB2      ASN   8 287.208 -15.768   3.573
   51    HB3  ASN   8           HB3      ASN   8 288.484 -15.671   4.781
   52   HD21  ASN   8          HD21      ASN   8 288.590 -13.515   5.931
   53   HD22  ASN   8          HD22      ASN   8 287.080 -12.831   6.418
   54    H    LEU   9           H        LEU   9 290.349 -12.777   4.368
   55    HA   LEU   9           HA       LEU   9 292.585 -14.643   4.127
   56    HB2  LEU   9           HB2      LEU   9 292.436 -11.698   3.871
   57    HB3  LEU   9           HB3      LEU   9 293.836 -12.344   4.583
   58    HG   LEU   9           HG       LEU   9 294.708 -12.681   2.566
   59   HD11  LEU   9          HD11      LEU   9 292.301 -14.404   1.983
   60   HD12  LEU   9          HD12      LEU   9 293.811 -14.948   2.711
   61   HD13  LEU   9          HD13      LEU   9 293.793 -14.370   1.043
   62   HD21  LEU   9          HD21      LEU   9 292.113 -11.491   1.853
   63   HD22  LEU   9          HD22      LEU   9 293.023 -12.265   0.555
   64   HD23  LEU   9          HD23      LEU   9 293.753 -10.950   1.486
   65    H    LYS  10           H        LYS  10 293.676 -15.150   5.893
   66    HA   LYS  10           HA       LYS  10 292.604 -14.168   8.436
   67    HB2  LYS  10           HB2      LYS  10 294.116 -16.548   7.520
   68    HB3  LYS  10           HB3      LYS  10 294.333 -16.064   9.162
   69    HG2  LYS  10           HG2      LYS  10 292.141 -16.555   9.727
   70    HG3  LYS  10           HG3      LYS  10 291.592 -16.435   8.051
   71    HD2  LYS  10           HD2      LYS  10 291.638 -18.753   8.711
   72    HD3  LYS  10           HD3      LYS  10 292.896 -18.447   7.511
   73    HE2  LYS  10           HE2      LYS  10 294.128 -19.635   9.014
   74    HE3  LYS  10           HE3      LYS  10 294.354 -18.018   9.690
   75    HZ1  LYS  10           HZ1      LYS  10 293.664 -19.027  11.560
   76    HZ2  LYS  10           HZ2      LYS  10 292.877 -20.284  10.746
   77    HZ3  LYS  10           HZ3      LYS  10 292.116 -18.784  10.922
   78    H    VAL  11           H        VAL  11 293.696 -12.320   9.061
   79    HA   VAL  11           HA       VAL  11 296.515 -12.185   8.382
   80    HB   VAL  11           HB       VAL  11 295.516 -10.155   7.871
   81   HG11  VAL  11          HG11      VAL  11 294.330  -9.682  10.559
   82   HG12  VAL  11          HG12      VAL  11 293.467 -10.654   9.372
   83   HG13  VAL  11          HG13      VAL  11 293.906  -8.993   8.990
   84   HG21  VAL  11          HG21      VAL  11 296.489  -8.523   9.443
   85   HG22  VAL  11          HG22      VAL  11 297.587  -9.818   8.964
   86   HG23  VAL  11          HG23      VAL  11 296.824  -9.852  10.554
   87    H    ALA  12           H        ALA  12 297.829 -13.081   9.646
   88    HA   ALA  12           HA       ALA  12 297.272 -13.531  12.481
   89    HB1  ALA  12           HB1      ALA  12 299.699 -14.712  12.004
   90    HB2  ALA  12           HB2      ALA  12 298.858 -14.889  10.463
   91    HB3  ALA  12           HB3      ALA  12 298.126 -15.515  11.943
   92    H    GLY  13           H        GLY  13 298.323 -12.550  14.134
   93    HA2  GLY  13           HA2      GLY  13 300.075 -10.347  13.367
   94    HA3  GLY  13           HA3      GLY  13 299.267 -10.542  14.910
   95    H    GLN  14           H        GLN  14 301.791  -9.777  14.939
   96    HA   GLN  14           HA       GLN  14 303.728 -11.828  15.017
   97    HB2  GLN  14           HB2      GLN  14 303.600  -9.076  16.231
   98    HB3  GLN  14           HB3      GLN  14 305.020 -10.110  16.351
   99    HG2  GLN  14           HG2      GLN  14 304.004  -9.807  13.633
  100    HG3  GLN  14           HG3      GLN  14 304.522  -8.294  14.377
  101   HE21  GLN  14          HE21      GLN  14 305.766 -11.583  14.761
  102   HE22  GLN  14          HE22      GLN  14 307.370 -11.229  14.224
  103    H    ASP  15           H        ASP  15 301.201 -11.012  17.143
  104    HA   ASP  15           HA       ASP  15 302.507 -12.233  19.457
  105    HB2  ASP  15           HB2      ASP  15 300.159 -10.466  19.053
  106    HB3  ASP  15           HB3      ASP  15 300.058 -11.614  20.385
  107    H    GLY  16           H        GLY  16 300.882 -13.338  16.833
  108    HA2  GLY  16           HA2      GLY  16 300.290 -15.600  16.530
  109    HA3  GLY  16           HA3      GLY  16 300.058 -15.750  18.265
  110    H    SER  17           H        SER  17 298.617 -12.957  17.026
  111    HA   SER  17           HA       SER  17 295.989 -14.245  17.118
  112    HB2  SER  17           HB2      SER  17 296.843 -12.130  18.575
  113    HB3  SER  17           HB3      SER  17 296.168 -11.289  17.179
  114    HG   SER  17           HG       SER  17 294.575 -11.615  18.753
  115    H    VAL  18           H        VAL  18 295.166 -14.669  15.200
  116    HA   VAL  18           HA       VAL  18 295.827 -12.962  12.898
  117    HB   VAL  18           HB       VAL  18 296.237 -15.033  12.075
  118   HG11  VAL  18          HG11      VAL  18 296.099 -16.442  13.866
  119   HG12  VAL  18          HG12      VAL  18 294.834 -17.085  12.818
  120   HG13  VAL  18          HG13      VAL  18 294.406 -16.058  14.186
  121   HG21  VAL  18          HG21      VAL  18 294.302 -16.027  10.909
  122   HG22  VAL  18          HG22      VAL  18 294.451 -14.283  10.694
  123   HG23  VAL  18          HG23      VAL  18 293.244 -14.936  11.801
  124    H    VAL  19           H        VAL  19 293.944 -12.616  11.330
  125    HA   VAL  19           HA       VAL  19 291.332 -12.493  12.634
  126    HB   VAL  19           HB       VAL  19 292.562 -10.072  11.366
  127   HG11  VAL  19          HG11      VAL  19 290.060 -10.322  11.299
  128   HG12  VAL  19          HG12      VAL  19 290.650  -8.875  12.116
  129   HG13  VAL  19          HG13      VAL  19 290.085 -10.253  13.061
  130   HG21  VAL  19          HG21      VAL  19 292.163 -10.673  14.283
  131   HG22  VAL  19          HG22      VAL  19 292.769  -9.158  13.612
  132   HG23  VAL  19          HG23      VAL  19 293.711 -10.639  13.442
  133    H    GLN  20           H        GLN  20 289.570 -12.296  11.142
  134    HA   GLN  20           HA       GLN  20 290.336 -13.213   8.486
  135    HB2  GLN  20           HB2      GLN  20 287.634 -13.168   9.829
  136    HB3  GLN  20           HB3      GLN  20 287.968 -13.854   8.243
  137    HG2  GLN  20           HG2      GLN  20 289.761 -14.884  10.259
  138    HG3  GLN  20           HG3      GLN  20 288.069 -15.168  10.675
  139   HE21  GLN  20          HE21      GLN  20 290.214 -17.013   9.869
  140   HE22  GLN  20          HE22      GLN  20 289.608 -17.867   8.496
  141    H    PHE  21           H        PHE  21 290.029 -12.211   6.662
  142    HA   PHE  21           HA       PHE  21 288.283  -9.919   6.427
  143    HB2  PHE  21           HB2      PHE  21 291.264  -9.688   6.007
  144    HB3  PHE  21           HB3      PHE  21 290.084  -8.486   5.502
  145    HD1  PHE  21           HD2      PHE  21 288.641  -7.422   7.322
  146    HD2  PHE  21           HD1      PHE  21 292.171  -9.650   8.130
  147    HE1  PHE  21           HE2      PHE  21 288.794  -6.361   9.534
  148    HE2  PHE  21           HE1      PHE  21 292.333  -8.585  10.348
  149    HZ   PHE  21           HZ       PHE  21 290.642  -6.944  11.053
  150    H    LYS  22           H        LYS  22 287.241 -10.404   4.608
  151    HA   LYS  22           HA       LYS  22 288.758 -11.649   2.471
  152    HB2  LYS  22           HB2      LYS  22 287.076 -12.936   1.968
  153    HB3  LYS  22           HB3      LYS  22 286.287 -12.384   3.427
  154    HG2  LYS  22           HG2      LYS  22 285.386 -10.596   2.047
  155    HG3  LYS  22           HG3      LYS  22 286.048 -11.422   0.686
  156    HD2  LYS  22           HD2      LYS  22 284.679 -13.325   2.274
  157    HD3  LYS  22           HD3      LYS  22 283.587 -11.965   1.990
  158    HE2  LYS  22           HE2      LYS  22 283.724 -12.244  -0.337
  159    HE3  LYS  22           HE3      LYS  22 285.117 -13.318  -0.188
  160    HZ1  LYS  22           HZ1      LYS  22 282.679 -14.172   1.146
  161    HZ2  LYS  22           HZ2      LYS  22 283.819 -15.081   0.290
  162    HZ3  LYS  22           HZ3      LYS  22 282.645 -14.196  -0.546
  163    H    ILE  23           H        ILE  23 289.164 -10.772   0.645
  164    HA   ILE  23           HA       ILE  23 287.931  -8.226   0.000
  165    HB   ILE  23           HB       ILE  23 289.689  -7.310   1.146
  166   HG12  ILE  23          HG12      ILE  23 290.530  -7.746  -1.673
  167   HG13  ILE  23          HG13      ILE  23 290.213  -6.249  -0.818
  168   HG21  ILE  23          HG21      ILE  23 291.941  -8.357   1.324
  169   HG22  ILE  23          HG22      ILE  23 291.330  -9.719   0.390
  170   HG23  ILE  23          HG23      ILE  23 290.631  -9.345   1.966
  171   HD11  ILE  23          HD11      ILE  23 292.378  -6.735   0.454
  172   HD12  ILE  23          HD12      ILE  23 292.484  -6.169  -1.216
  173   HD13  ILE  23          HD13      ILE  23 292.709  -7.879  -0.850
  174    H    LYS  24           H        LYS  24 287.760  -7.864  -2.109
  175    HA   LYS  24           HA       LYS  24 287.757  -9.846  -4.012
  176    HB2  LYS  24           HB2      LYS  24 288.029  -6.898  -4.226
  177    HB3  LYS  24           HB3      LYS  24 288.110  -7.905  -5.673
  178    HG2  LYS  24           HG2      LYS  24 285.905  -8.242  -3.708
  179    HG3  LYS  24           HG3      LYS  24 285.817  -6.996  -4.938
  180    HD2  LYS  24           HD2      LYS  24 286.593  -9.595  -5.972
  181    HD3  LYS  24           HD3      LYS  24 285.013  -9.615  -5.185
  182    HE2  LYS  24           HE2      LYS  24 284.646  -7.439  -6.592
  183    HE3  LYS  24           HE3      LYS  24 285.944  -8.123  -7.565
  184    HZ1  LYS  24           HZ1      LYS  24 283.449  -8.679  -8.064
  185    HZ2  LYS  24           HZ2      LYS  24 283.687  -9.848  -6.866
  186    HZ3  LYS  24           HZ3      LYS  24 284.653  -9.853  -8.254
  187    H    ARG  25           H        ARG  25 289.309 -10.985  -5.097
  188    HA   ARG  25           HA       ARG  25 291.901 -11.026  -4.332
  189    HB2  ARG  25           HB2      ARG  25 290.920 -11.744  -7.086
  190    HB3  ARG  25           HB3      ARG  25 292.366 -12.333  -6.297
  191    HG2  ARG  25           HG2      ARG  25 290.661 -13.120  -4.464
  192    HG3  ARG  25           HG3      ARG  25 289.544 -13.066  -5.824
  193    HD2  ARG  25           HD2      ARG  25 290.515 -15.287  -5.585
  194    HD3  ARG  25           HD3      ARG  25 291.015 -14.539  -7.101
  195    HE   ARG  25           HE       ARG  25 292.928 -14.017  -5.094
  196   HH11  ARG  25          HH11      ARG  25 291.744 -16.610  -7.108
  197   HH12  ARG  25          HH12      ARG  25 293.252 -17.462  -7.113
  198   HH21  ARG  25          HH21      ARG  25 294.912 -15.136  -5.100
  199   HH22  ARG  25          HH22      ARG  25 295.050 -16.625  -5.973
  200    H    HIS  26           H        HIS  26 290.683  -9.278  -7.207
  201    HA   HIS  26           HA       HIS  26 293.322  -8.223  -7.684
  202    HB2  HIS  26           HB2      HIS  26 290.663  -7.544  -8.956
  203    HB3  HIS  26           HB3      HIS  26 292.216  -6.880  -9.459
  204    HD1  HIS  26           HD1      HIS  26 292.506  -7.933 -11.705
  205    HD2  HIS  26           HD2      HIS  26 291.498 -10.704  -8.778
  206    HE1  HIS  26           HE1      HIS  26 292.713 -10.182 -12.810
  207    HE2  HIS  26           HE2      HIS  26 292.000 -11.837 -11.049
  208    H    THR  27           H        THR  27 292.253  -7.655  -5.082
  209    HA   THR  27           HA       THR  27 292.015  -4.737  -5.247
  210    HB   THR  27           HB       THR  27 291.126  -6.517  -2.984
  211    HG1  THR  27           HG1      THR  27 289.861  -6.827  -4.805
  212   HG21  THR  27          HG21      THR  27 291.719  -4.070  -2.516
  213   HG22  THR  27          HG22      THR  27 290.142  -4.662  -1.989
  214   HG23  THR  27          HG23      THR  27 290.272  -3.690  -3.454
  215    HA   PRO  28           HA       PRO  28 295.949  -4.695  -3.272
  216    HB2  PRO  28           HB2      PRO  28 295.230  -2.114  -2.098
  217    HB3  PRO  28           HB3      PRO  28 296.472  -2.488  -3.290
  218    HG2  PRO  28           HG2      PRO  28 294.213  -1.112  -3.890
  219    HG3  PRO  28           HG3      PRO  28 295.075  -2.126  -5.061
  220    HD2  PRO  28           HD2      PRO  28 292.574  -2.676  -3.540
  221    HD3  PRO  28           HD3      PRO  28 293.030  -3.155  -5.189
  222    H    LEU  29           H        LEU  29 296.404  -5.779  -1.523
  223    HA   LEU  29           HA       LEU  29 294.679  -6.348   0.562
  224    HB2  LEU  29           HB2      LEU  29 297.690  -6.364   0.414
  225    HB3  LEU  29           HB3      LEU  29 296.812  -6.974   1.807
  226    HG   LEU  29           HG       LEU  29 296.223  -7.997  -0.949
  227   HD11  LEU  29          HD11      LEU  29 297.854  -9.885   0.212
  228   HD12  LEU  29          HD12      LEU  29 298.676  -8.357   0.539
  229   HD13  LEU  29          HD13      LEU  29 298.274  -8.806  -1.119
  230   HD21  LEU  29          HD21      LEU  29 295.544  -8.722   1.825
  231   HD22  LEU  29          HD22      LEU  29 295.932 -10.065   0.740
  232   HD23  LEU  29          HD23      LEU  29 294.640  -8.940   0.317
  233    H    SER  30           H        SER  30 296.410  -3.441  -0.031
  234    HA   SER  30           HA       SER  30 296.978  -2.452   2.459
  235    HB2  SER  30           HB2      SER  30 296.525  -0.190   1.463
  236    HB3  SER  30           HB3      SER  30 297.578  -1.197   0.473
  237    HG   SER  30           HG       SER  30 296.153  -0.599  -0.991
  238    H    LYS  31           H        LYS  31 293.900  -3.273   1.176
  239    HA   LYS  31           HA       LYS  31 292.452  -1.521   2.973
  240    HB2  LYS  31           HB2      LYS  31 291.849  -2.316   0.534
  241    HB3  LYS  31           HB3      LYS  31 291.108  -3.652   1.403
  242    HG2  LYS  31           HG2      LYS  31 289.522  -2.317   2.370
  243    HG3  LYS  31           HG3      LYS  31 290.519  -0.863   2.253
  244    HD2  LYS  31           HD2      LYS  31 289.682  -2.170  -0.276
  245    HD3  LYS  31           HD3      LYS  31 288.457  -1.279   0.631
  246    HE2  LYS  31           HE2      LYS  31 290.742   0.350   0.589
  247    HE3  LYS  31           HE3      LYS  31 290.581  -0.302  -1.042
  248    HZ1  LYS  31           HZ1      LYS  31 289.374   1.808  -0.686
  249    HZ2  LYS  31           HZ2      LYS  31 288.382   1.031   0.443
  250    HZ3  LYS  31           HZ3      LYS  31 288.365   0.541  -1.176
  251    H    LEU  32           H        LEU  32 293.096  -4.980   2.493
  252    HA   LEU  32           HA       LEU  32 291.500  -5.989   4.557
  253    HB2  LEU  32           HB2      LEU  32 292.341  -7.435   2.879
  254    HB3  LEU  32           HB3      LEU  32 293.977  -6.898   3.135
  255    HG   LEU  32           HG       LEU  32 292.572  -8.469   5.275
  256   HD11  LEU  32          HD11      LEU  32 293.506  -9.371   2.623
  257   HD12  LEU  32          HD12      LEU  32 292.205  -9.983   3.642
  258   HD13  LEU  32          HD13      LEU  32 293.884 -10.379   4.019
  259   HD21  LEU  32          HD21      LEU  32 295.007  -7.300   5.228
  260   HD22  LEU  32          HD22      LEU  32 295.392  -8.876   4.536
  261   HD23  LEU  32          HD23      LEU  32 294.636  -8.768   6.143
  262    H    MET  33           H        MET  33 294.892  -4.962   4.448
  263    HA   MET  33           HA       MET  33 295.429  -5.527   7.153
  264    HB2  MET  33           HB2      MET  33 297.022  -3.488   5.706
  265    HB3  MET  33           HB3      MET  33 297.527  -4.772   6.730
  266    HG2  MET  33           HG2      MET  33 297.929  -6.143   5.064
  267    HG3  MET  33           HG3      MET  33 296.370  -5.830   4.325
  268    HE1  MET  33           HE1      MET  33 299.955  -5.814   3.751
  269    HE2  MET  33           HE2      MET  33 299.971  -4.442   4.862
  270    HE3  MET  33           HE3      MET  33 300.416  -4.214   3.162
  271    H    LYS  34           H        LYS  34 294.077  -2.848   5.436
  272    HA   LYS  34           HA       LYS  34 294.459  -0.868   7.438
  273    HB2  LYS  34           HB2      LYS  34 292.747  -1.162   5.020
  274    HB3  LYS  34           HB3      LYS  34 292.209  -0.012   6.236
  275    HG2  LYS  34           HG2      LYS  34 294.971   0.023   5.075
  276    HG3  LYS  34           HG3      LYS  34 293.624   0.913   4.376
  277    HD2  LYS  34           HD2      LYS  34 293.368   1.776   6.860
  278    HD3  LYS  34           HD3      LYS  34 295.080   1.355   6.930
  279    HE2  LYS  34           HE2      LYS  34 294.574   2.773   4.505
  280    HE3  LYS  34           HE3      LYS  34 293.886   3.682   5.850
  281    HZ1  LYS  34           HZ1      LYS  34 296.114   3.338   6.967
  282    HZ2  LYS  34           HZ2      LYS  34 296.085   4.412   5.661
  283    HZ3  LYS  34           HZ3      LYS  34 296.697   2.849   5.456
  284    H    ALA  35           H        ALA  35 292.294  -3.512   6.965
  285    HA   ALA  35           HA       ALA  35 290.329  -2.695   8.897
  286    HB1  ALA  35           HB1      ALA  35 290.787  -5.475   7.822
  287    HB2  ALA  35           HB2      ALA  35 289.998  -4.221   6.864
  288    HB3  ALA  35           HB3      ALA  35 289.280  -4.753   8.389
  289    H    TYR  36           H        TYR  36 293.063  -4.935   8.741
  290    HA   TYR  36           HA       TYR  36 292.926  -6.010  11.396
  291    HB2  TYR  36           HB2      TYR  36 294.307  -6.873   9.444
  292    HB3  TYR  36           HB3      TYR  36 295.385  -5.514   9.688
  293    HD1  TYR  36           HD2      TYR  36 293.717  -7.903  11.998
  294    HD2  TYR  36           HD1      TYR  36 297.383  -6.220  10.626
  295    HE1  TYR  36           HE2      TYR  36 294.959  -9.225  13.647
  296    HE2  TYR  36           HE1      TYR  36 298.628  -7.519  12.253
  297    HH   TYR  36           HH       TYR  36 298.172  -8.628  14.469
  298    H    CYS  37           H        CYS  37 294.438  -3.155   9.944
  299    HA   CYS  37           HA       CYS  37 295.784  -2.319  12.321
  300    HB2  CYS  37           HB2      CYS  37 295.143  -1.091   9.664
  301    HB3  CYS  37           HB3      CYS  37 295.675  -0.045  10.976
  302    HG   CYS  37           HG       CYS  37 297.947  -1.213  10.977
  303    H    GLU  38           H        GLU  38 292.698  -1.850  10.830
  304    HA   GLU  38           HA       GLU  38 291.709   0.094  12.722
  305    HB2  GLU  38           HB2      GLU  38 291.057  -0.202  10.275
  306    HB3  GLU  38           HB3      GLU  38 290.045  -1.514  10.872
  307    HG2  GLU  38           HG2      GLU  38 289.484   1.205  10.812
  308    HG3  GLU  38           HG3      GLU  38 288.545  -0.099  11.494
  309    H    ARG  39           H        ARG  39 291.956  -3.323  12.378
  310    HA   ARG  39           HA       ARG  39 289.862  -4.020  14.214
  311    HB2  ARG  39           HB2      ARG  39 290.027  -5.935  13.040
  312    HB3  ARG  39           HB3      ARG  39 291.345  -5.245  12.133
  313    HG2  ARG  39           HG2      ARG  39 292.400  -7.060  12.899
  314    HG3  ARG  39           HG3      ARG  39 292.695  -6.058  14.275
  315    HD2  ARG  39           HD2      ARG  39 290.364  -6.996  15.043
  316    HD3  ARG  39           HD3      ARG  39 290.777  -8.271  13.912
  317    HE   ARG  39           HE       ARG  39 292.842  -7.692  15.822
  318   HH11  ARG  39          HH11      ARG  39 289.971  -9.562  15.183
  319   HH12  ARG  39          HH12      ARG  39 290.364 -10.792  16.337
  320   HH21  ARG  39          HH21      ARG  39 293.366  -9.308  17.337
  321   HH22  ARG  39          HH22      ARG  39 292.292 -10.649  17.559
  322    H    GLN  40           H        GLN  40 293.382  -4.272  14.041
  323    HA   GLN  40           HA       GLN  40 293.595  -5.114  16.757
  324    HB2  GLN  40           HB2      GLN  40 295.554  -4.608  14.552
  325    HB3  GLN  40           HB3      GLN  40 296.112  -4.864  16.200
  326    HG2  GLN  40           HG2      GLN  40 294.400  -6.941  15.873
  327    HG3  GLN  40           HG3      GLN  40 295.057  -6.754  14.250
  328   HE21  GLN  40          HE21      GLN  40 295.398  -8.653  16.671
  329   HE22  GLN  40          HE22      GLN  40 297.110  -8.868  16.755
  330    H    GLY  41           H        GLY  41 294.586  -2.274  14.872
  331    HA2  GLY  41           HA2      GLY  41 294.307  -0.073  15.923
  332    HA3  GLY  41           HA3      GLY  41 294.930  -0.795  17.402
  333    H    LEU  42           H        LEU  42 296.192  -1.472  14.205
  334    HA   LEU  42           HA       LEU  42 298.811  -0.525  15.047
  335    HB2  LEU  42           HB2      LEU  42 297.832  -2.182  12.740
  336    HB3  LEU  42           HB3      LEU  42 299.462  -1.523  12.739
  337    HG   LEU  42           HG       LEU  42 298.555  -3.111  15.099
  338   HD11  LEU  42          HD11      LEU  42 298.612  -4.116  12.406
  339   HD12  LEU  42          HD12      LEU  42 298.174  -4.941  13.901
  340   HD13  LEU  42          HD13      LEU  42 299.859  -4.892  13.382
  341   HD21  LEU  42          HD21      LEU  42 300.736  -3.136  15.594
  342   HD22  LEU  42          HD22      LEU  42 300.866  -1.818  14.427
  343   HD23  LEU  42          HD23      LEU  42 301.209  -3.477  13.930
  344    H    SER  43           H        SER  43 300.103   0.355  13.028
  345    HA   SER  43           HA       SER  43 298.692   2.790  12.216
  346    HB2  SER  43           HB2      SER  43 301.054   2.620  13.405
  347    HB3  SER  43           HB3      SER  43 301.616   2.353  11.758
  348    HG   SER  43           HG       SER  43 301.276   4.384  11.323
  349    H    MET  44           H        MET  44 299.922  -0.155  10.993
  350    HA   MET  44           HA       MET  44 299.747  -1.144   8.947
  351    HB2  MET  44           HB2      MET  44 297.815   0.691   8.723
  352    HB3  MET  44           HB3      MET  44 298.922   1.305   7.497
  353    HG2  MET  44           HG2      MET  44 298.974  -1.255   6.825
  354    HG3  MET  44           HG3      MET  44 297.381  -1.220   7.578
  355    HE1  MET  44           HE1      MET  44 296.533  -1.907   4.667
  356    HE2  MET  44           HE2      MET  44 298.292  -1.999   4.783
  357    HE3  MET  44           HE3      MET  44 297.538  -1.051   3.501
  358    H    ARG  45           H        ARG  45 301.515   1.646   9.672
  359    HA   ARG  45           HA       ARG  45 303.263   1.388   7.341
  360    HB2  ARG  45           HB2      ARG  45 302.231   3.602   8.686
  361    HB3  ARG  45           HB3      ARG  45 303.928   3.549   9.123
  362    HG2  ARG  45           HG2      ARG  45 303.479   3.116   6.286
  363    HG3  ARG  45           HG3      ARG  45 302.853   4.667   6.852
  364    HD2  ARG  45           HD2      ARG  45 305.384   4.248   8.048
  365    HD3  ARG  45           HD3      ARG  45 305.538   3.915   6.325
  366    HE   ARG  45           HE       ARG  45 305.189   6.144   5.886
  367   HH11  ARG  45          HH11      ARG  45 304.376   5.488   9.217
  368   HH12  ARG  45          HH12      ARG  45 304.214   7.160   9.636
  369   HH21  ARG  45          HH21      ARG  45 304.977   8.343   6.437
  370   HH22  ARG  45          HH22      ARG  45 304.555   8.781   8.059
  371    H    GLN  46           H        GLN  46 303.057   1.376  10.813
  372    HA   GLN  46           HA       GLN  46 305.841   0.657  11.244
  373    HB2  GLN  46           HB2      GLN  46 304.164   2.072  12.728
  374    HB3  GLN  46           HB3      GLN  46 303.727   0.491  13.357
  375    HG2  GLN  46           HG2      GLN  46 306.613   1.127  13.214
  376    HG3  GLN  46           HG3      GLN  46 305.659   2.007  14.408
  377   HE21  GLN  46          HE21      GLN  46 303.999   0.377  15.497
  378   HE22  GLN  46          HE22      GLN  46 304.753  -1.030  16.156
  379    H    ILE  47           H        ILE  47 303.223  -0.833  10.155
  380    HA   ILE  47           HA       ILE  47 303.855  -3.499  11.250
  381    HB   ILE  47           HB       ILE  47 301.728  -2.553  12.044
  382   HG12  ILE  47          HG12      ILE  47 301.670  -4.931  11.922
  383   HG13  ILE  47          HG13      ILE  47 300.158  -4.282  11.221
  384   HG21  ILE  47          HG21      ILE  47 299.943  -2.093  10.565
  385   HG22  ILE  47          HG22      ILE  47 300.916  -2.589   9.175
  386   HG23  ILE  47          HG23      ILE  47 301.363  -1.156  10.104
  387   HD11  ILE  47          HD11      ILE  47 300.513  -5.905   9.858
  388   HD12  ILE  47          HD12      ILE  47 302.293  -5.800   9.959
  389   HD13  ILE  47          HD13      ILE  47 301.384  -4.605   9.023
  390    H    ARG  48           H        ARG  48 304.215  -5.027   9.766
  391    HA   ARG  48           HA       ARG  48 303.655  -4.427   6.936
  392    HB2  ARG  48           HB2      ARG  48 306.092  -5.589   8.246
  393    HB3  ARG  48           HB3      ARG  48 305.667  -6.036   6.600
  394    HG2  ARG  48           HG2      ARG  48 306.067  -3.216   7.550
  395    HG3  ARG  48           HG3      ARG  48 307.283  -4.185   6.714
  396    HD2  ARG  48           HD2      ARG  48 306.353  -3.803   4.736
  397    HD3  ARG  48           HD3      ARG  48 304.749  -4.206   5.323
  398    HE   ARG  48           HE       ARG  48 305.013  -1.773   6.319
  399   HH11  ARG  48          HH11      ARG  48 305.836  -2.949   3.133
  400   HH12  ARG  48          HH12      ARG  48 305.587  -1.416   2.370
  401   HH21  ARG  48          HH21      ARG  48 304.685   0.241   5.311
  402   HH22  ARG  48          HH22      ARG  48 304.933   0.393   3.604
  403    H    PHE  49           H        PHE  49 302.215  -5.819   6.128
  404    HA   PHE  49           HA       PHE  49 301.614  -8.208   7.642
  405    HB2  PHE  49           HB2      PHE  49 300.364  -6.994   5.167
  406    HB3  PHE  49           HB3      PHE  49 299.856  -8.512   5.835
  407    HD1  PHE  49           HD2      PHE  49 300.779  -5.311   7.524
  408    HD2  PHE  49           HD1      PHE  49 297.791  -8.214   6.675
  409    HE1  PHE  49           HE2      PHE  49 299.268  -4.138   8.965
  410    HE2  PHE  49           HE1      PHE  49 296.257  -7.016   8.201
  411    HZ   PHE  49           HZ       PHE  49 297.047  -4.982   9.358
  412    H    ARG  50           H        ARG  50 302.436 -10.208   7.070
  413    HA   ARG  50           HA       ARG  50 303.575 -10.402   4.376
  414    HB2  ARG  50           HB2      ARG  50 305.068 -10.796   6.411
  415    HB3  ARG  50           HB3      ARG  50 304.232 -12.309   6.588
  416    HG2  ARG  50           HG2      ARG  50 304.943 -12.131   3.958
  417    HG3  ARG  50           HG3      ARG  50 306.330 -11.499   4.796
  418    HD2  ARG  50           HD2      ARG  50 305.028 -14.076   5.593
  419    HD3  ARG  50           HD3      ARG  50 306.235 -13.994   4.333
  420    HE   ARG  50           HE       ARG  50 307.489 -12.753   6.337
  421   HH11  ARG  50          HH11      ARG  50 305.757 -15.782   6.219
  422   HH12  ARG  50          HH12      ARG  50 306.721 -16.523   7.451
  423   HH21  ARG  50          HH21      ARG  50 308.754 -13.726   7.960
  424   HH22  ARG  50          HH22      ARG  50 308.421 -15.357   8.440
  425    H    PHE  51           H        PHE  51 302.894 -12.065   3.138
  426    HA   PHE  51           HA       PHE  51 300.452 -13.333   4.052
  427    HB2  PHE  51           HB2      PHE  51 299.979 -12.661   1.930
  428    HB3  PHE  51           HB3      PHE  51 301.646 -12.706   1.431
  429    HD1  PHE  51           HD2      PHE  51 299.040 -15.134   2.474
  430    HD2  PHE  51           HD1      PHE  51 302.084 -14.153  -0.310
  431    HE1  PHE  51           HE2      PHE  51 298.564 -17.208   1.234
  432    HE2  PHE  51           HE1      PHE  51 301.621 -16.216  -1.564
  433    HZ   PHE  51           HZ       PHE  51 299.856 -17.749  -0.792
  434    H    ASP  52           H        ASP  52 300.205 -15.636   3.738
  435    HA   ASP  52           HA       ASP  52 301.864 -17.125   5.273
  436    HB2  ASP  52           HB2      ASP  52 299.706 -17.900   4.049
  437    HB3  ASP  52           HB3      ASP  52 300.802 -18.428   2.778
  438    H    GLY  53           H        GLY  53 303.920 -16.638   5.134
  439    HA2  GLY  53           HA2      GLY  53 306.081 -16.593   4.456
  440    HA3  GLY  53           HA3      GLY  53 305.672 -17.997   3.500
  441    H    GLN  54           H        GLN  54 304.959 -14.409   3.292
  442    HA   GLN  54           HA       GLN  54 306.488 -14.159   0.927
  443    HB2  GLN  54           HB2      GLN  54 304.110 -15.409   0.399
  444    HB3  GLN  54           HB3      GLN  54 303.675 -13.720   0.184
  445    HG2  GLN  54           HG2      GLN  54 304.449 -13.901  -1.880
  446    HG3  GLN  54           HG3      GLN  54 306.065 -13.947  -1.172
  447   HE21  GLN  54          HE21      GLN  54 304.448 -15.330  -3.468
  448   HE22  GLN  54          HE22      GLN  54 304.975 -16.971  -3.351
  449    HA   PRO  55           HA       PRO  55 306.243 -10.234   3.172
  450    HB2  PRO  55           HB2      PRO  55 307.448  -9.057   0.848
  451    HB3  PRO  55           HB3      PRO  55 308.191  -9.379   2.412
  452    HG2  PRO  55           HG2      PRO  55 308.293 -10.964  -0.078
  453    HG3  PRO  55           HG3      PRO  55 309.428 -10.930   1.281
  454    HD2  PRO  55           HD2      PRO  55 307.809 -13.018   0.819
  455    HD3  PRO  55           HD3      PRO  55 308.217 -12.514   2.470
  456    H    ILE  56           H        ILE  56 304.872  -8.463   2.984
  457    HA   ILE  56           HA       ILE  56 303.124  -8.503   0.617
  458    HB   ILE  56           HB       ILE  56 302.470  -7.944   3.468
  459   HG12  ILE  56          HG12      ILE  56 302.016 -10.143   1.579
  460   HG13  ILE  56          HG13      ILE  56 302.204 -10.173   3.314
  461   HG21  ILE  56          HG21      ILE  56 301.339  -6.253   2.241
  462   HG22  ILE  56          HG22      ILE  56 300.171  -7.469   2.767
  463   HG23  ILE  56          HG23      ILE  56 300.730  -7.440   1.083
  464   HD11  ILE  56          HD11      ILE  56 299.924  -9.504   3.634
  465   HD12  ILE  56          HD12      ILE  56 300.009 -10.923   2.585
  466   HD13  ILE  56          HD13      ILE  56 299.708  -9.336   1.889
  467    H    ASN  57           H        ASN  57 302.149  -6.691  -0.022
  468    HA   ASN  57           HA       ASN  57 303.341  -4.114   0.731
  469    HB2  ASN  57           HB2      ASN  57 303.205  -5.445  -1.871
  470    HB3  ASN  57           HB3      ASN  57 302.758  -3.746  -1.888
  471   HD21  ASN  57          HD21      ASN  57 305.245  -5.699  -0.238
  472   HD22  ASN  57          HD22      ASN  57 306.565  -4.677  -0.675
  473    H    GLU  58           H        GLU  58 301.974  -2.278   0.363
  474    HA   GLU  58           HA       GLU  58 299.343  -2.617   1.173
  475    HB2  GLU  58           HB2      GLU  58 301.003  -0.417   0.156
  476    HB3  GLU  58           HB3      GLU  58 299.284  -0.213  -0.136
  477    HG2  GLU  58           HG2      GLU  58 298.896  -0.618   2.287
  478    HG3  GLU  58           HG3      GLU  58 300.643  -0.613   2.514
  479    H    THR  59           H        THR  59 300.708  -2.399  -2.069
  480    HA   THR  59           HA       THR  59 298.080  -2.432  -3.268
  481    HB   THR  59           HB       THR  59 299.306  -2.303  -5.407
  482    HG1  THR  59           HG1      THR  59 301.636  -2.158  -3.802
  483   HG21  THR  59          HG21      THR  59 300.773  -0.223  -4.117
  484   HG22  THR  59          HG22      THR  59 299.166  -0.353  -3.395
  485   HG23  THR  59          HG23      THR  59 299.339  -0.112  -5.137
  486    H    ASP  60           H        ASP  60 300.441  -4.750  -2.374
  487    HA   ASP  60           HA       ASP  60 300.033  -6.751  -4.270
  488    HB2  ASP  60           HB2      ASP  60 300.812  -6.784  -1.383
  489    HB3  ASP  60           HB3      ASP  60 300.416  -8.304  -2.170
  490    H    THR  61           H        THR  61 298.414  -8.151  -4.691
  491    HA   THR  61           HA       THR  61 296.109  -8.131  -2.866
  492    HB   THR  61           HB       THR  61 294.610  -8.076  -4.597
  493    HG1  THR  61           HG1      THR  61 295.021  -9.597  -5.997
  494   HG21  THR  61          HG21      THR  61 296.958  -6.637  -5.805
  495   HG22  THR  61          HG22      THR  61 295.792  -5.954  -4.670
  496   HG23  THR  61          HG23      THR  61 295.268  -6.446  -6.285
  497    HA   PRO  62           HA       PRO  62 296.176 -12.471  -2.141
  498    HB2  PRO  62           HB2      PRO  62 293.457 -12.346  -3.451
  499    HB3  PRO  62           HB3      PRO  62 293.940 -13.208  -1.985
  500    HG2  PRO  62           HG2      PRO  62 292.650 -10.918  -1.792
  501    HG3  PRO  62           HG3      PRO  62 294.033 -11.240  -0.727
  502    HD2  PRO  62           HD2      PRO  62 293.848  -9.445  -3.096
  503    HD3  PRO  62           HD3      PRO  62 294.826  -9.278  -1.625
  504    H    ALA  63           H        ALA  63 294.732 -11.493  -5.324
  505    HA   ALA  63           HA       ALA  63 295.323 -13.893  -6.704
  506    HB1  ALA  63           HB1      ALA  63 294.784 -12.669  -8.636
  507    HB2  ALA  63           HB2      ALA  63 295.280 -11.141  -7.887
  508    HB3  ALA  63           HB3      ALA  63 293.793 -11.945  -7.367
  509    H    GLN  64           H        GLN  64 296.843 -10.822  -6.298
  510    HA   GLN  64           HA       GLN  64 299.100 -11.174  -7.950
  511    HB2  GLN  64           HB2      GLN  64 297.851  -9.226  -6.301
  512    HB3  GLN  64           HB3      GLN  64 299.503  -9.349  -5.797
  513    HG2  GLN  64           HG2      GLN  64 298.648  -8.948  -8.634
  514    HG3  GLN  64           HG3      GLN  64 299.027  -7.626  -7.533
  515   HE21  GLN  64          HE21      GLN  64 301.193  -7.497  -6.696
  516   HE22  GLN  64          HE22      GLN  64 302.513  -8.125  -7.618
  517    H    LEU  65           H        LEU  65 298.154 -12.406  -4.998
  518    HA   LEU  65           HA       LEU  65 300.882 -13.122  -4.202
  519    HB2  LEU  65           HB2      LEU  65 298.400 -12.433  -2.679
  520    HB3  LEU  65           HB3      LEU  65 299.730 -13.242  -1.909
  521    HG   LEU  65           HG       LEU  65 299.627 -10.481  -3.088
  522   HD11  LEU  65          HD11      LEU  65 300.069  -9.711  -0.959
  523   HD12  LEU  65          HD12      LEU  65 300.707 -11.263  -0.414
  524   HD13  LEU  65          HD13      LEU  65 298.975 -11.065  -0.674
  525   HD21  LEU  65          HD21      LEU  65 301.663 -11.346  -3.915
  526   HD22  LEU  65          HD22      LEU  65 302.044 -12.121  -2.375
  527   HD23  LEU  65          HD23      LEU  65 302.070 -10.361  -2.509
  528    H    GLU  66           H        GLU  66 298.360 -14.335  -5.736
  529    HA   GLU  66           HA       GLU  66 297.332 -16.349  -5.994
  530    HB2  GLU  66           HB2      GLU  66 300.143 -17.095  -5.195
  531    HB3  GLU  66           HB3      GLU  66 298.949 -18.328  -5.575
  532    HG2  GLU  66           HG2      GLU  66 298.905 -16.387  -7.645
  533    HG3  GLU  66           HG3      GLU  66 300.582 -16.838  -7.342
  534    H    MET  67           H        MET  67 296.447 -15.245  -3.826
  535    HA   MET  67           HA       MET  67 296.707 -17.038  -1.547
  536    HB2  MET  67           HB2      MET  67 295.351 -14.372  -1.933
  537    HB3  MET  67           HB3      MET  67 295.300 -15.271  -0.426
  538    HG2  MET  67           HG2      MET  67 297.820 -15.223  -0.453
  539    HG3  MET  67           HG3      MET  67 297.708 -14.071  -1.778
  540    HE1  MET  67           HE1      MET  67 295.648 -14.609   1.516
  541    HE2  MET  67           HE2      MET  67 296.375 -13.386   2.553
  542    HE3  MET  67           HE3      MET  67 297.336 -14.741   1.982
  543    H    GLU  68           H        GLU  68 294.473 -17.373  -0.354
  544    HA   GLU  68           HA       GLU  68 292.475 -18.173  -2.377
  545    HB2  GLU  68           HB2      GLU  68 293.918 -19.855  -0.562
  546    HB3  GLU  68           HB3      GLU  68 292.199 -19.867  -0.149
  547    HG2  GLU  68           HG2      GLU  68 291.611 -20.882  -2.107
  548    HG3  GLU  68           HG3      GLU  68 292.970 -20.210  -3.006
  549    H    ASP  69           H        ASP  69 290.562 -19.160  -0.995
  550    HA   ASP  69           HA       ASP  69 289.519 -16.922   0.498
  551    HB2  ASP  69           HB2      ASP  69 287.421 -17.740   0.032
  552    HB3  ASP  69           HB3      ASP  69 288.338 -18.234  -1.382
  553    H    GLU  70           H        GLU  70 289.683 -16.826   2.424
  554    HA   GLU  70           HA       GLU  70 289.529 -17.312   4.726
  555    HB2  GLU  70           HB2      GLU  70 288.469 -19.606   3.764
  556    HB3  GLU  70           HB3      GLU  70 289.991 -20.223   4.392
  557    HG2  GLU  70           HG2      GLU  70 289.061 -18.607   6.423
  558    HG3  GLU  70           HG3      GLU  70 287.602 -19.373   5.796
  559    H    ASP  71           H        ASP  71 291.851 -17.810   2.479
  560    HA   ASP  71           HA       ASP  71 293.985 -19.056   3.529
  561    HB2  ASP  71           HB2      ASP  71 293.604 -17.408   1.405
  562    HB3  ASP  71           HB3      ASP  71 294.643 -16.416   2.414
  563    H    THR  72           H        THR  72 296.050 -17.294   3.993
  564    HA   THR  72           HA       THR  72 295.231 -15.828   6.384
  565    HB   THR  72           HB       THR  72 297.364 -17.938   6.332
  566    HG1  THR  72           HG1      THR  72 295.616 -18.955   6.963
  567   HG21  THR  72          HG21      THR  72 297.327 -15.546   7.872
  568   HG22  THR  72          HG22      THR  72 298.476 -16.883   7.925
  569   HG23  THR  72          HG23      THR  72 297.027 -16.924   8.930
  570    H    ILE  73           H        ILE  73 296.085 -14.016   6.606
  571    HA   ILE  73           HA       ILE  73 298.385 -13.204   4.980
  572    HB   ILE  73           HB       ILE  73 296.044 -11.685   6.134
  573   HG12  ILE  73          HG12      ILE  73 296.019 -12.039   3.812
  574   HG13  ILE  73          HG13      ILE  73 296.542 -10.390   4.072
  575   HG21  ILE  73          HG21      ILE  73 297.925  -9.692   5.513
  576   HG22  ILE  73          HG22      ILE  73 298.838 -10.845   6.480
  577   HG23  ILE  73          HG23      ILE  73 297.366 -10.126   7.130
  578   HD11  ILE  73          HD11      ILE  73 298.090 -12.674   3.125
  579   HD12  ILE  73          HD12      ILE  73 298.879 -11.389   4.045
  580   HD13  ILE  73          HD13      ILE  73 298.038 -11.009   2.538
  581    H    ASP  74           H        ASP  74 300.212 -12.957   6.058
  582    HA   ASP  74           HA       ASP  74 300.157 -13.441   8.939
  583    HB2  ASP  74           HB2      ASP  74 302.637 -13.301   7.179
  584    HB3  ASP  74           HB3      ASP  74 302.497 -13.972   8.804
  585    H    VAL  75           H        VAL  75 301.200 -12.008  10.389
  586    HA   VAL  75           HA       VAL  75 301.697  -9.386   9.191
  587    HB   VAL  75           HB       VAL  75 299.892  -9.984  11.478
  588   HG11  VAL  75          HG11      VAL  75 300.256  -7.455  12.077
  589   HG12  VAL  75          HG12      VAL  75 301.858  -7.707  11.397
  590   HG13  VAL  75          HG13      VAL  75 301.326  -8.671  12.779
  591   HG21  VAL  75          HG21      VAL  75 299.858  -7.618   9.652
  592   HG22  VAL  75          HG22      VAL  75 298.516  -8.483  10.388
  593   HG23  VAL  75          HG23      VAL  75 299.391  -9.204   9.044
  594    H    PHE  76           H        PHE  76 303.286  -8.314   9.747
  595    HA   PHE  76           HA       PHE  76 304.925  -9.015  12.040
  596    HB2  PHE  76           HB2      PHE  76 305.990  -8.619   9.264
  597    HB3  PHE  76           HB3      PHE  76 306.964  -8.876  10.685
  598    HD1  PHE  76           HD1      PHE  76 306.378 -11.022  12.046
  599    HD2  PHE  76           HD2      PHE  76 305.555 -10.559   7.867
  600    HE1  PHE  76           HE1      PHE  76 306.295 -13.461  11.790
  601    HE2  PHE  76           HE2      PHE  76 305.470 -13.001   7.645
  602    HZ   PHE  76           HZ       PHE  76 305.840 -14.451   9.587
  603    H    GLN  77           H        GLN  77 305.710  -7.212  12.946
  604    HA   GLN  77           HA       GLN  77 304.744  -4.721  11.800
  605    HB2  GLN  77           HB2      GLN  77 304.999  -5.724  14.445
  606    HB3  GLN  77           HB3      GLN  77 305.969  -4.259  14.321
  607    HG2  GLN  77           HG2      GLN  77 304.158  -2.931  14.000
  608    HG3  GLN  77           HG3      GLN  77 303.242  -4.194  13.172
  609   HE21  GLN  77          HE21      GLN  77 303.362  -2.379  15.885
  610   HE22  GLN  77          HE22      GLN  77 302.492  -3.402  16.971
  611    H    GLN  78           H        GLN  78 306.116  -3.795  10.422
  612    HA   GLN  78           HA       GLN  78 307.995  -2.977   9.467
  613    HB2  GLN  78           HB2      GLN  78 307.954  -2.124  12.140
  614    HB3  GLN  78           HB3      GLN  78 309.616  -2.608  11.826
  615    HG2  GLN  78           HG2      GLN  78 308.252  -0.910   9.815
  616    HG3  GLN  78           HG3      GLN  78 308.754  -0.167  11.334
  617   HE21  GLN  78          HE21      GLN  78 309.957  -2.204   8.703
  618   HE22  GLN  78          HE22      GLN  78 311.564  -1.572   8.710
  619    H    GLN  79           H        GLN  79 308.388  -5.122   8.598
  620    HA   GLN  79           HA       GLN  79 311.034  -5.932   8.825
  621    HB2  GLN  79           HB2      GLN  79 309.763  -6.826  11.012
  622    HB3  GLN  79           HB3      GLN  79 309.509  -8.150   9.900
  623    HG2  GLN  79           HG2      GLN  79 311.960  -8.191   9.477
  624    HG3  GLN  79           HG3      GLN  79 312.133  -7.026  10.791
  625   HE21  GLN  79          HE21      GLN  79 310.205  -8.030  12.533
  626   HE22  GLN  79          HE22      GLN  79 310.738  -9.562  13.126
  627    H    THR  80           H        THR  80 310.201  -5.535   6.562
  628    HA   THR  80           HA       THR  80 309.862  -8.101   5.305
  629    HB   THR  80           HB       THR  80 307.846  -7.485   4.032
  630    HG1  THR  80           HG1      THR  80 307.042  -5.558   4.139
  631   HG21  THR  80          HG21      THR  80 307.331  -7.214   6.983
  632   HG22  THR  80          HG22      THR  80 307.542  -8.741   6.124
  633   HG23  THR  80          HG23      THR  80 306.175  -7.693   5.740
  634    H    GLY  81           H        GLY  81 308.931  -4.938   4.019
  635    HA2  GLY  81           HA2      GLY  81 309.795  -3.683   2.311
  636    HA3  GLY  81           HA3      GLY  81 311.368  -4.156   2.929
  637    H    GLY  82           H        GLY  82 309.142  -6.589   1.805
  638    HA2  GLY  82           HA2      GLY  82 309.076  -7.805  -0.163
  639    HA3  GLY  82           HA3      GLY  82 310.164  -6.629  -0.881
  640    H1   GLY   1           HT1      GLY   1 311.228   2.465   9.838
  641    H2   GLY   1           HT2      GLY   1 310.032   2.351  11.029
  642    H3   GLY   1           HT3      GLY   1 311.627   1.919  11.389
  643    HA2  GLY   1           HA3      GLY   1 311.117   4.076  12.330
  644    HA3  GLY   1           HA2      GLY   1 312.359   4.194  11.092
  645    H    SER   2           H        SER   2 308.803   3.988  10.970
  646    HA   SER   2           HA       SER   2 307.246   5.273   9.923
  647    HB2  SER   2           HB2      SER   2 308.686   6.988  11.459
  648    HB3  SER   2           HB3      SER   2 308.915   7.712   9.867
  649    HG   SER   2           HG       SER   2 306.967   8.296  11.227
  650    H    GLU   3           H        GLU   3 307.551   4.101   7.965
  651    HA   GLU   3           HA       GLU   3 307.855   3.913   5.722
  652    HB2  GLU   3           HB2      GLU   3 307.089   6.517   6.164
  653    HB3  GLU   3           HB3      GLU   3 308.560   6.717   5.226
  654    HG2  GLU   3           HG2      GLU   3 307.613   5.162   3.530
  655    HG3  GLU   3           HG3      GLU   3 306.103   5.170   4.441
  656    H    GLU   4           H        GLU   4 309.920   2.862   6.643
  657    HA   GLU   4           HA       GLU   4 312.318   4.325   5.818
  658    HB2  GLU   4           HB2      GLU   4 313.593   2.553   6.970
  659    HB3  GLU   4           HB3      GLU   4 312.421   3.325   8.041
  660    HG2  GLU   4           HG2      GLU   4 310.950   1.459   7.905
  661    HG3  GLU   4           HG3      GLU   4 311.905   0.730   6.615
  662    H    LYS   5           H        LYS   5 313.850   1.973   5.410
  663    HA   LYS   5           HA       LYS   5 312.865   1.104   2.795
  664    HB2  LYS   5           HB2      LYS   5 315.032   1.154   1.933
  665    HB3  LYS   5           HB3      LYS   5 314.945   2.600   2.927
  666    HG2  LYS   5           HG2      LYS   5 316.281   0.005   3.594
  667    HG3  LYS   5           HG3      LYS   5 317.054   1.575   3.330
  668    HD2  LYS   5           HD2      LYS   5 315.106   0.933   5.518
  669    HD3  LYS   5           HD3      LYS   5 316.842   0.976   5.738
  670    HE2  LYS   5           HE2      LYS   5 316.812   3.358   4.979
  671    HE3  LYS   5           HE3      LYS   5 315.056   3.281   4.980
  672    HZ1  LYS   5           HZ1      LYS   5 316.909   3.365   7.230
  673    HZ2  LYS   5           HZ2      LYS   5 315.518   2.426   7.424
  674    HZ3  LYS   5           HZ3      LYS   5 315.381   4.071   7.059
  675    HA   PRO   6           HA       PRO   6 313.030  -3.145   3.906
  676    HB2  PRO   6           HB2      PRO   6 314.658  -3.700   1.514
  677    HB3  PRO   6           HB3      PRO   6 313.032  -4.260   1.899
  678    HG2  PRO   6           HG2      PRO   6 313.523  -2.412  -0.009
  679    HG3  PRO   6           HG3      PRO   6 312.041  -2.399   0.964
  680    HD2  PRO   6           HD2      PRO   6 314.473  -0.666   1.202
  681    HD3  PRO   6           HD3      PRO   6 312.764  -0.273   1.462
  682    H    LYS   7           H        LYS   7 314.422  -3.821   5.562
  683    HA   LYS   7           HA       LYS   7 317.182  -3.239   5.583
  684    HB2  LYS   7           HB2      LYS   7 315.387  -5.106   7.088
  685    HB3  LYS   7           HB3      LYS   7 317.124  -5.355   7.195
  686    HG2  LYS   7           HG2      LYS   7 316.525  -4.023   9.043
  687    HG3  LYS   7           HG3      LYS   7 317.314  -2.943   7.891
  688    HD2  LYS   7           HD2      LYS   7 315.477  -1.690   8.471
  689    HD3  LYS   7           HD3      LYS   7 314.859  -2.547   7.058
  690    HE2  LYS   7           HE2      LYS   7 314.523  -3.935   9.632
  691    HE3  LYS   7           HE3      LYS   7 313.599  -2.444   9.450
  692    HZ1  LYS   7           HZ1      LYS   7 312.659  -4.740   8.645
  693    HZ2  LYS   7           HZ2      LYS   7 313.544  -4.375   7.251
  694    HZ3  LYS   7           HZ3      LYS   7 312.339  -3.317   7.787
  695    H    GLU   8           H        GLU   8 317.728  -3.768   3.410
  696    HA   GLU   8           HA       GLU   8 318.674  -5.071   1.802
  697    HB2  GLU   8           HB2      GLU   8 318.946  -6.749   4.238
  698    HB3  GLU   8           HB3      GLU   8 319.083  -7.586   2.698
  699    HG2  GLU   8           HG2      GLU   8 321.193  -6.953   2.577
  700    HG3  GLU   8           HG3      GLU   8 320.662  -5.275   2.484
  701    H    GLY   9           H        GLY   9 316.290  -4.728   1.074
  702    HA2  GLY   9           HA2      GLY   9 314.989  -7.345   0.831
  703    HA3  GLY   9           HA3      GLY   9 314.097  -5.842   0.893
  704    H    VAL  10           H        VAL  10 317.040  -6.040  -0.753
  705    HA   VAL  10           HA       VAL  10 315.997  -5.199  -3.228
  706    HB   VAL  10           HB       VAL  10 318.267  -4.666  -2.594
  707   HG11  VAL  10          HG11      VAL  10 319.352  -7.361  -3.025
  708   HG12  VAL  10          HG12      VAL  10 318.384  -7.167  -1.560
  709   HG13  VAL  10          HG13      VAL  10 319.790  -6.134  -1.835
  710   HG21  VAL  10          HG21      VAL  10 317.613  -5.097  -5.045
  711   HG22  VAL  10          HG22      VAL  10 318.569  -6.571  -4.894
  712   HG23  VAL  10          HG23      VAL  10 319.330  -4.998  -4.652
  713    H    LYS  11           H        LYS  11 314.340  -6.845  -3.641
  714    HA   LYS  11           HA       LYS  11 315.007  -9.561  -4.078
  715    HB2  LYS  11           HB2      LYS  11 312.680  -7.987  -4.210
  716    HB3  LYS  11           HB3      LYS  11 312.862  -8.817  -5.756
  717    HG2  LYS  11           HG2      LYS  11 311.914 -10.492  -4.652
  718    HG3  LYS  11           HG3      LYS  11 313.538 -10.804  -4.137
  719    HD2  LYS  11           HD2      LYS  11 311.214  -9.841  -2.600
  720    HD3  LYS  11           HD3      LYS  11 312.539 -10.898  -2.135
  721    HE2  LYS  11           HE2      LYS  11 313.268  -9.182  -0.925
  722    HE3  LYS  11           HE3      LYS  11 313.800  -8.502  -2.451
  723    HZ1  LYS  11           HZ3      LYS  11 311.042  -8.001  -1.742
  724    H    THR  12           H        THR  12 313.980  -7.220  -6.570
  725    HA   THR  12           HA       THR  12 315.959  -8.367  -8.384
  726    HB   THR  12           HB       THR  12 314.609  -7.492 -10.172
  727    HG1  THR  12           HG1      THR  12 313.028  -6.230  -8.183
  728   HG21  THR  12          HG21      THR  12 313.748  -9.535  -9.142
  729   HG22  THR  12          HG22      THR  12 312.463  -8.533  -9.822
  730   HG23  THR  12          HG23      THR  12 312.736  -8.558  -8.075
  731    H    GLU  13           H        GLU  13 314.587  -5.103  -8.718
  732    HA   GLU  13           HA       GLU  13 317.122  -3.941  -7.821
  733    HB2  GLU  13           HB2      GLU  13 315.578  -3.302 -10.350
  734    HB3  GLU  13           HB3      GLU  13 316.857  -2.283  -9.702
  735    HG2  GLU  13           HG2      GLU  13 318.140  -3.457 -11.117
  736    HG3  GLU  13           HG3      GLU  13 318.150  -4.634  -9.804
  737    H    ASN  14           H        ASN  14 314.243  -2.491  -9.286
  738    HA   ASN  14           HA       ASN  14 313.679  -0.338  -7.987
  739    HB2  ASN  14           HB2      ASN  14 312.160  -2.305  -9.258
  740    HB3  ASN  14           HB3      ASN  14 311.239  -1.784  -7.855
  741   HD21  ASN  14          HD21      ASN  14 309.689  -0.821  -9.181
  742   HD22  ASN  14          HD22      ASN  14 309.992   0.665 -10.007
  743    H    ASP  15           H        ASP  15 313.476  -3.428  -6.275
  744    HA   ASP  15           HA       ASP  15 311.995  -2.540  -4.061
  745    HB2  ASP  15           HB2      ASP  15 313.955  -4.761  -4.499
  746    HB3  ASP  15           HB3      ASP  15 313.385  -4.413  -2.871
  747    H    HIS  16           H        HIS  16 313.011  -0.353  -3.988
  748    HA   HIS  16           HA       HIS  16 315.176   0.815  -3.523
  749    HB2  HIS  16           HB2      HIS  16 313.256   0.861  -1.195
  750    HB3  HIS  16           HB3      HIS  16 314.338   2.128  -1.728
  751    HD1  HIS  16           HD1      HIS  16 311.309   0.263  -3.069
  752    HD2  HIS  16           HD2      HIS  16 313.194   3.962  -3.319
  753    HE1  HIS  16           HE1      HIS  16 309.790   1.696  -4.471
  754    HE2  HIS  16           HE2      HIS  16 310.984   3.906  -4.671
  755    H    ILE  17           H        ILE  17 316.924   1.026  -2.230
  756    HA   ILE  17           HA       ILE  17 317.274  -0.761   0.072
  757    HB   ILE  17           HB       ILE  17 319.398  -1.490  -0.519
  758   HG12  ILE  17          HG12      ILE  17 319.493   0.854  -2.397
  759   HG13  ILE  17          HG13      ILE  17 320.527   0.531  -1.036
  760   HG21  ILE  17          HG21      ILE  17 318.993  -1.693  -3.298
  761   HG22  ILE  17          HG22      ILE  17 317.401  -1.734  -2.540
  762   HG23  ILE  17          HG23      ILE  17 318.641  -2.886  -2.048
  763   HD11  ILE  17          HD11      ILE  17 320.555  -1.038  -3.598
  764   HD12  ILE  17          HD12      ILE  17 321.650  -1.212  -2.233
  765   HD13  ILE  17          HD13      ILE  17 321.675   0.274  -3.185
  766    H    ASN  18           H        ASN  18 319.108   0.066   1.489
  767    HA   ASN  18           HA       ASN  18 318.934   2.956   1.606
  768    HB2  ASN  18           HB2      ASN  18 319.354   0.819   3.465
  769    HB3  ASN  18           HB3      ASN  18 320.795   1.816   3.480
  770   HD21  ASN  18          HD21      ASN  18 319.145   1.533   5.646
  771   HD22  ASN  18          HD22      ASN  18 318.396   3.052   5.990
  772    H    LEU  19           H        LEU  19 320.743   4.269   1.193
  773    HA   LEU  19           HA       LEU  19 323.112   2.900   0.182
  774    HB2  LEU  19           HB2      LEU  19 321.465   4.836  -1.230
  775    HB3  LEU  19           HB3      LEU  19 323.107   5.430  -1.060
  776    HG   LEU  19           HG       LEU  19 322.248   2.799  -2.302
  777   HD11  LEU  19          HD11      LEU  19 322.004   4.731  -3.770
  778   HD12  LEU  19          HD12      LEU  19 323.256   3.624  -4.320
  779   HD13  LEU  19          HD13      LEU  19 323.695   5.128  -3.511
  780   HD21  LEU  19          HD21      LEU  19 324.435   2.129  -2.552
  781   HD22  LEU  19          HD22      LEU  19 324.414   2.762  -0.899
  782   HD23  LEU  19          HD23      LEU  19 325.087   3.734  -2.205
  783    H    LYS  20           H        LYS  20 325.081   4.135   0.364
  784    HA   LYS  20           HA       LYS  20 324.982   6.035   2.629
  785    HB2  LYS  20           HB2      LYS  20 326.155   3.462   2.550
  786    HB3  LYS  20           HB3      LYS  20 327.455   4.595   2.588
  787    HG2  LYS  20           HG2      LYS  20 326.663   5.545   4.562
  788    HG3  LYS  20           HG3      LYS  20 325.165   4.699   4.450
  789    HD2  LYS  20           HD2      LYS  20 327.626   3.897   5.677
  790    HD3  LYS  20           HD3      LYS  20 326.021   3.188   5.834
  791    HE2  LYS  20           HE2      LYS  20 326.493   1.518   4.412
  792    HE3  LYS  20           HE3      LYS  20 327.432   2.548   3.332
  793    HZ1  LYS  20           HZ1      LYS  20 328.522   0.684   4.845
  794    HZ2  LYS  20           HZ2      LYS  20 328.606   1.978   5.931
  795    HZ3  LYS  20           HZ3      LYS  20 329.343   2.100   4.414
  796    H    VAL  21           H        VAL  21 326.199   7.906   2.231
  797    HA   VAL  21           HA       VAL  21 328.073   7.766  -0.026
  798    HB   VAL  21           HB       VAL  21 326.844  10.378   0.776
  799   HG11  VAL  21          HG11      VAL  21 327.446  11.032  -1.398
  800   HG12  VAL  21          HG12      VAL  21 327.573   9.362  -1.961
  801   HG13  VAL  21          HG13      VAL  21 328.786  10.017  -0.858
  802   HG21  VAL  21          HG21      VAL  21 325.024  10.043  -0.842
  803   HG22  VAL  21          HG22      VAL  21 324.923   8.861   0.468
  804   HG23  VAL  21          HG23      VAL  21 325.559   8.380  -1.104
  805    H    ALA  22           H        ALA  22 330.109   8.140   0.497
  806    HA   ALA  22           HA       ALA  22 330.675   9.195   3.166
  807    HB1  ALA  22           HB1      ALA  22 332.161   7.550   3.234
  808    HB2  ALA  22           HB2      ALA  22 333.049   8.313   1.910
  809    HB3  ALA  22           HB3      ALA  22 331.793   7.118   1.561
  810    H    GLY  23           H        GLY  23 331.341  11.225   3.399
  811    HA2  GLY  23           HA2      GLY  23 332.369  12.614   1.005
  812    HA3  GLY  23           HA3      GLY  23 331.443  13.389   2.261
  813    H    GLN  24           H        GLN  24 333.681  14.604   1.550
  814    HA   GLN  24           HA       GLN  24 336.085  13.848   2.725
  815    HB2  GLN  24           HB2      GLN  24 335.186  16.693   2.514
  816    HB3  GLN  24           HB3      GLN  24 336.816  16.063   2.404
  817    HG2  GLN  24           HG2      GLN  24 335.902  14.817   0.318
  818    HG3  GLN  24           HG3      GLN  24 334.642  16.052   0.371
  819   HE21  GLN  24          HE21      GLN  24 337.368  15.321  -1.135
  820   HE22  GLN  24          HE22      GLN  24 338.022  16.894  -1.423
  821    H    ASP  25           H        ASP  25 333.212  14.677   4.270
  822    HA   ASP  25           HA       ASP  25 334.154  16.081   6.516
  823    HB2  ASP  25           HB2      ASP  25 331.745  15.777   5.758
  824    HB3  ASP  25           HB3      ASP  25 331.806  14.198   6.532
  825    H    GLY  26           H        GLY  26 334.882  12.949   5.590
  826    HA2  GLY  26           HA2      GLY  26 336.124  11.345   6.692
  827    HA3  GLY  26           HA3      GLY  26 336.128  12.387   8.111
  828    H    SER  27           H        SER  27 333.506  10.896   6.252
  829    HA   SER  27           HA       SER  27 332.852   8.937   8.170
  830    HB2  SER  27           HB2      SER  27 331.217   9.910   9.461
  831    HB3  SER  27           HB3      SER  27 332.219  11.330   9.167
  832    HG   SER  27           HG       SER  27 329.779  11.332   8.726
  833    H    VAL  28           H        VAL  28 329.973   9.173   7.743
  834    HA   VAL  28           HA       VAL  28 329.679   8.947   4.868
  835    HB   VAL  28           HB       VAL  28 330.455   6.750   5.369
  836   HG11  VAL  28          HG11      VAL  28 329.989   6.908   7.817
  837   HG12  VAL  28          HG12      VAL  28 329.594   5.347   7.093
  838   HG13  VAL  28          HG13      VAL  28 328.308   6.496   7.466
  839   HG21  VAL  28          HG21      VAL  28 328.638   5.387   4.583
  840   HG22  VAL  28          HG22      VAL  28 328.437   6.983   3.865
  841   HG23  VAL  28          HG23      VAL  28 327.435   6.503   5.239
  842    H    VAL  29           H        VAL  29 327.467   8.575   4.242
  843    HA   VAL  29           HA       VAL  29 325.488   9.283   6.277
  844    HB   VAL  29           HB       VAL  29 324.284  10.392   4.187
  845   HG11  VAL  29          HG11      VAL  29 326.089  12.355   5.268
  846   HG12  VAL  29          HG12      VAL  29 325.487  11.264   6.520
  847   HG13  VAL  29          HG13      VAL  29 324.353  12.152   5.507
  848   HG21  VAL  29          HG21      VAL  29 326.248   9.899   2.741
  849   HG22  VAL  29          HG22      VAL  29 327.153  11.096   3.670
  850   HG23  VAL  29          HG23      VAL  29 325.721  11.578   2.756
  851    H    GLN  30           H        GLN  30 323.407   8.482   5.807
  852    HA   GLN  30           HA       GLN  30 323.542   6.213   3.943
  853    HB2  GLN  30           HB2      GLN  30 322.855   6.423   6.708
  854    HB3  GLN  30           HB3      GLN  30 321.598   5.588   5.817
  855    HG2  GLN  30           HG2      GLN  30 323.449   4.124   4.909
  856    HG3  GLN  30           HG3      GLN  30 324.507   4.882   6.107
  857   HE21  GLN  30          HE21      GLN  30 324.826   3.520   7.709
  858   HE22  GLN  30          HE22      GLN  30 323.625   2.545   8.478
  859    H    PHE  31           H        PHE  31 322.464   6.600   2.241
  860    HA   PHE  31           HA       PHE  31 319.990   8.122   2.178
  861    HB2  PHE  31           HB2      PHE  31 321.798   6.964   0.024
  862    HB3  PHE  31           HB3      PHE  31 320.327   7.799  -0.322
  863    HD1  PHE  31           HD1      PHE  31 322.907   8.630   2.214
  864    HD2  PHE  31           HD2      PHE  31 320.962   9.752  -1.397
  865    HE1  PHE  31           HE1      PHE  31 324.080  10.779   2.251
  866    HE2  PHE  31           HE2      PHE  31 322.152  11.898  -1.362
  867    HZ   PHE  31           HZ       PHE  31 323.712  12.419   0.459
  868    H    LYS  32           H        LYS  32 318.301   7.161   0.647
  869    HA   LYS  32           HA       LYS  32 318.252   4.245   0.701
  870    HB2  LYS  32           HB2      LYS  32 316.826   4.446   2.497
  871    HB3  LYS  32           HB3      LYS  32 316.249   6.013   1.994
  872    HG2  LYS  32           HG2      LYS  32 315.256   4.468   0.001
  873    HG3  LYS  32           HG3      LYS  32 315.246   3.338   1.346
  874    HD2  LYS  32           HD2      LYS  32 314.019   6.091   1.386
  875    HD3  LYS  32           HD3      LYS  32 313.131   4.590   1.120
  876    HE2  LYS  32           HE2      LYS  32 313.532   3.841   3.308
  877    HE3  LYS  32           HE3      LYS  32 314.811   5.023   3.571
  878    HZ1  LYS  32           HZ1      LYS  32 312.721   6.609   3.066
  879    HZ2  LYS  32           HZ2      LYS  32 313.189   6.135   4.620
  880    HZ3  LYS  32           HZ3      LYS  32 311.942   5.314   3.826
  881    H    ILE  33           H        ILE  33 318.302   3.816  -1.352
  882    HA   ILE  33           HA       ILE  33 316.569   5.366  -3.130
  883    HB   ILE  33           HB       ILE  33 318.819   6.165  -3.358
  884   HG12  ILE  33          HG12      ILE  33 318.851   4.531  -5.775
  885   HG13  ILE  33          HG13      ILE  33 317.260   5.152  -5.445
  886   HG21  ILE  33          HG21      ILE  33 320.534   4.877  -2.969
  887   HG22  ILE  33          HG22      ILE  33 320.187   3.925  -4.412
  888   HG23  ILE  33          HG23      ILE  33 319.482   3.472  -2.860
  889   HD11  ILE  33          HD11      ILE  33 318.584   7.406  -5.124
  890   HD12  ILE  33          HD12      ILE  33 318.069   6.840  -6.715
  891   HD13  ILE  33          HD13      ILE  33 319.734   6.589  -6.184
  892    H    LYS  34           H        LYS  34 315.386   4.334  -4.490
  893    HA   LYS  34           HA       LYS  34 314.494   1.831  -4.349
  894    HB2  LYS  34           HB2      LYS  34 313.437   3.485  -5.674
  895    HB3  LYS  34           HB3      LYS  34 314.813   3.500  -6.748
  896    HG2  LYS  34           HG2      LYS  34 314.231   1.575  -7.795
  897    HG3  LYS  34           HG3      LYS  34 313.351   0.961  -6.408
  898    HD2  LYS  34           HD2      LYS  34 311.626   1.498  -7.833
  899    HD3  LYS  34           HD3      LYS  34 311.765   2.959  -6.871
  900    HE2  LYS  34           HE2      LYS  34 313.510   2.987  -9.194
  901    HE3  LYS  34           HE3      LYS  34 311.809   2.813  -9.625
  902    HZ1  LYS  34           HZ1      LYS  34 311.449   4.761  -8.041
  903    HZ2  LYS  34           HZ2      LYS  34 312.154   5.096  -9.541
  904    HZ3  LYS  34           HZ3      LYS  34 313.118   5.015  -8.154
  905    H    ARG  35           H        ARG  35 316.862   2.744  -6.829
  906    HA   ARG  35           HA       ARG  35 318.769   0.939  -6.881
  907    HB2  ARG  35           HB2      ARG  35 316.239  -0.527  -7.387
  908    HB3  ARG  35           HB3      ARG  35 317.557  -0.927  -8.428
  909    HG2  ARG  35           HG2      ARG  35 317.477  -1.212  -5.450
  910    HG3  ARG  35           HG3      ARG  35 317.488  -2.485  -6.638
  911    HD2  ARG  35           HD2      ARG  35 319.655  -2.411  -5.795
  912    HD3  ARG  35           HD3      ARG  35 319.715  -1.657  -7.380
  913    HE   ARG  35           HE       ARG  35 320.888  -0.143  -6.098
  914   HH11  ARG  35          HH11      ARG  35 317.802  -0.666  -4.491
  915   HH12  ARG  35          HH12      ARG  35 317.917   0.798  -3.600
  916   HH21  ARG  35          HH21      ARG  35 321.001   1.722  -4.836
  917   HH22  ARG  35          HH22      ARG  35 319.703   2.112  -3.777
  918    H    HIS  36           H        HIS  36 316.132   0.770  -9.214
  919    HA   HIS  36           HA       HIS  36 317.791   1.324 -11.463
  920    HB2  HIS  36           HB2      HIS  36 316.125   0.258 -12.488
  921    HB3  HIS  36           HB3      HIS  36 315.265   0.181 -10.956
  922    HD1  HIS  36           HD1      HIS  36 313.177   1.602 -10.729
  923    HD2  HIS  36           HD2      HIS  36 315.335   2.389 -14.184
  924    HE1  HIS  36           HE1      HIS  36 311.683   3.069 -12.123
  925    HE2  HIS  36           HE2      HIS  36 312.957   3.423 -14.273
  926    H    THR  37           H        THR  37 317.186   3.451  -9.265
  927    HA   THR  37           HA       THR  37 316.294   5.553 -11.104
  928    HB   THR  37           HB       THR  37 316.531   5.949  -8.149
  929    HG1  THR  37           HG1      THR  37 314.426   4.788  -9.646
  930   HG21  THR  37          HG21      THR  37 316.129   7.759 -10.042
  931   HG22  THR  37          HG22      THR  37 315.283   7.812  -8.482
  932   HG23  THR  37          HG23      THR  37 314.469   7.157  -9.903
  933    HA   PRO  38           HA       PRO  38 320.250   7.165 -11.901
  934    HB2  PRO  38           HB2      PRO  38 319.287   9.730 -12.357
  935    HB3  PRO  38           HB3      PRO  38 319.407   8.448 -13.565
  936    HG2  PRO  38           HG2      PRO  38 317.060   9.281 -11.890
  937    HG3  PRO  38           HG3      PRO  38 317.104   8.791 -13.584
  938    HD2  PRO  38           HD2      PRO  38 316.227   7.155 -11.758
  939    HD3  PRO  38           HD3      PRO  38 317.285   6.561 -13.042
  940    H    LEU  39           H        LEU  39 321.385   7.183 -10.028
  941    HA   LEU  39           HA       LEU  39 321.189   8.241  -7.673
  942    HB2  LEU  39           HB2      LEU  39 323.571   8.332  -9.477
  943    HB3  LEU  39           HB3      LEU  39 323.660   8.710  -7.764
  944    HG   LEU  39           HG       LEU  39 322.565   6.108  -8.814
  945   HD11  LEU  39          HD11      LEU  39 325.024   5.610  -7.633
  946   HD12  LEU  39          HD12      LEU  39 325.300   7.002  -8.676
  947   HD13  LEU  39          HD13      LEU  39 324.632   5.517  -9.349
  948   HD21  LEU  39          HD21      LEU  39 323.587   5.737  -6.284
  949   HD22  LEU  39          HD22      LEU  39 321.886   5.974  -6.686
  950   HD23  LEU  39          HD23      LEU  39 322.874   7.349  -6.194
  951    H    SER  40           H        SER  40 321.245  10.475 -10.434
  952    HA   SER  40           HA       SER  40 322.332  12.711  -9.395
  953    HB2  SER  40           HB2      SER  40 319.673  12.940 -10.743
  954    HB3  SER  40           HB3      SER  40 321.141  13.886 -10.991
  955    HG   SER  40           HG       SER  40 320.343  11.521 -12.153
  956    H    LYS  41           H        LYS  41 319.441  11.152  -8.159
  957    HA   LYS  41           HA       LYS  41 318.498  13.467  -6.783
  958    HB2  LYS  41           HB2      LYS  41 317.664  10.736  -6.114
  959    HB3  LYS  41           HB3      LYS  41 316.733  12.176  -6.294
  960    HG2  LYS  41           HG2      LYS  41 316.294  11.838  -8.443
  961    HG3  LYS  41           HG3      LYS  41 317.913  11.230  -8.773
  962    HD2  LYS  41           HD2      LYS  41 316.251   9.585  -7.052
  963    HD3  LYS  41           HD3      LYS  41 315.712   9.674  -8.724
  964    HE2  LYS  41           HE2      LYS  41 317.221   7.762  -8.150
  965    HE3  LYS  41           HE3      LYS  41 317.760   8.774  -9.481
  966    HZ1  LYS  41           HZ1      LYS  41 318.709   9.260  -6.734
  967    HZ2  LYS  41           HZ2      LYS  41 319.442   9.659  -8.199
  968    HZ3  LYS  41           HZ3      LYS  41 319.420   8.057  -7.683
  969    H    LEU  42           H        LEU  42 320.405  10.685  -6.315
  970    HA   LEU  42           HA       LEU  42 320.668  10.716  -3.464
  971    HB2  LEU  42           HB2      LEU  42 321.054   8.794  -5.161
  972    HB3  LEU  42           HB3      LEU  42 322.616   9.534  -5.432
  973    HG   LEU  42           HG       LEU  42 321.824   8.761  -2.645
  974   HD11  LEU  42          HD11      LEU  42 321.527   6.920  -4.510
  975   HD12  LEU  42          HD12      LEU  42 322.212   6.567  -2.924
  976   HD13  LEU  42          HD13      LEU  42 323.275   6.814  -4.310
  977   HD21  LEU  42          HD21      LEU  42 323.871  10.089  -3.088
  978   HD22  LEU  42          HD22      LEU  42 324.457   8.775  -4.110
  979   HD23  LEU  42          HD23      LEU  42 324.203   8.506  -2.386
  980    H    MET  43           H        MET  43 322.395  11.906  -6.240
  981    HA   MET  43           HA       MET  43 324.711  12.865  -5.007
  982    HB2  MET  43           HB2      MET  43 323.319  13.693  -7.543
  983    HB3  MET  43           HB3      MET  43 324.895  14.309  -7.063
  984    HG2  MET  43           HG2      MET  43 324.736  11.408  -6.963
  985    HG3  MET  43           HG3      MET  43 324.414  12.064  -8.567
  986    HE1  MET  43           HE1      MET  43 328.068  10.874  -8.882
  987    HE2  MET  43           HE2      MET  43 326.470  10.906  -9.623
  988    HE3  MET  43           HE3      MET  43 326.697  10.122  -8.059
  989    H    LYS  44           H        LYS  44 321.564  14.418  -5.446
  990    HA   LYS  44           HA       LYS  44 322.586  16.980  -4.575
  991    HB2  LYS  44           HB2      LYS  44 320.827  16.838  -6.263
  992    HB3  LYS  44           HB3      LYS  44 319.742  16.167  -5.060
  993    HG2  LYS  44           HG2      LYS  44 319.688  18.708  -5.639
  994    HG3  LYS  44           HG3      LYS  44 319.469  18.171  -3.983
  995    HD2  LYS  44           HD2      LYS  44 321.068  19.635  -3.502
  996    HD3  LYS  44           HD3      LYS  44 322.186  18.523  -4.215
  997    HE2  LYS  44           HE2      LYS  44 322.674  20.433  -5.373
  998    HE3  LYS  44           HE3      LYS  44 321.513  19.649  -6.437
  999    HZ1  LYS  44           HZ1      LYS  44 320.882  21.906  -6.263
 1000    HZ2  LYS  44           HZ2      LYS  44 321.020  21.902  -4.577
 1001    HZ3  LYS  44           HZ3      LYS  44 319.774  21.037  -5.324
 1002    H    ALA  45           H        ALA  45 321.182  14.225  -3.016
 1003    HA   ALA  45           HA       ALA  45 320.067  15.587  -0.781
 1004    HB1  ALA  45           HB1      ALA  45 320.568  12.844  -1.485
 1005    HB2  ALA  45           HB2      ALA  45 319.441  13.502  -0.299
 1006    HB3  ALA  45           HB3      ALA  45 321.111  13.155   0.171
 1007    H    TYR  46           H        TYR  46 323.160  13.909  -1.225
 1008    HA   TYR  46           HA       TYR  46 324.380  14.644   1.117
 1009    HB2  TYR  46           HB2      TYR  46 325.223  13.226  -1.001
 1010    HB3  TYR  46           HB3      TYR  46 326.089  14.721  -1.326
 1011    HD1  TYR  46           HD2      TYR  46 325.399  13.794   2.107
 1012    HD2  TYR  46           HD1      TYR  46 328.256  13.554  -1.010
 1013    HE1  TYR  46           HE2      TYR  46 327.065  13.097   3.729
 1014    HE2  TYR  46           HE1      TYR  46 329.960  12.852   0.609
 1015    HH   TYR  46           HH       TYR  46 329.275  11.760   3.648
 1016    H    CYS  47           H        CYS  47 324.026  16.586  -1.890
 1017    HA   CYS  47           HA       CYS  47 325.704  18.687  -1.141
 1018    HB2  CYS  47           HB2      CYS  47 325.086  18.823  -3.351
 1019    HB3  CYS  47           HB3      CYS  47 323.506  18.142  -3.059
 1020    HG   CYS  47           HG       CYS  47 324.189  21.161  -2.808
 1021    H    GLU  48           H        GLU  48 322.150  18.604  -1.227
 1022    HA   GLU  48           HA       GLU  48 321.663  20.871   0.241
 1023    HB2  GLU  48           HB2      GLU  48 319.928  18.437   0.506
 1024    HB3  GLU  48           HB3      GLU  48 319.446  20.129   0.524
 1025    HG2  GLU  48           HG2      GLU  48 320.247  20.205  -1.911
 1026    HG3  GLU  48           HG3      GLU  48 320.294  18.466  -1.799
 1027    H    ARG  49           H        ARG  49 322.989  17.925   1.217
 1028    HA   ARG  49           HA       ARG  49 322.339  17.977   4.003
 1029    HB2  ARG  49           HB2      ARG  49 323.484  16.226   2.072
 1030    HB3  ARG  49           HB3      ARG  49 324.613  16.400   3.384
 1031    HG2  ARG  49           HG2      ARG  49 322.712  15.788   4.905
 1032    HG3  ARG  49           HG3      ARG  49 321.827  15.351   3.430
 1033    HD2  ARG  49           HD2      ARG  49 322.983  13.409   4.231
 1034    HD3  ARG  49           HD3      ARG  49 323.729  13.942   2.755
 1035    HE   ARG  49           HE       ARG  49 325.645  14.217   3.955
 1036   HH11  ARG  49          HH11      ARG  49 322.969  14.440   6.176
 1037   HH12  ARG  49          HH12      ARG  49 323.975  14.750   7.550
 1038   HH21  ARG  49          HH21      ARG  49 326.972  14.615   5.759
 1039   HH22  ARG  49          HH22      ARG  49 326.247  14.847   7.315
 1040    H    GLN  50           H        GLN  50 325.316  18.403   2.087
 1041    HA   GLN  50           HA       GLN  50 326.660  19.626   4.390
 1042    HB2  GLN  50           HB2      GLN  50 328.009  18.811   1.879
 1043    HB3  GLN  50           HB3      GLN  50 328.693  18.943   3.464
 1044    HG2  GLN  50           HG2      GLN  50 327.400  16.950   4.132
 1045    HG3  GLN  50           HG3      GLN  50 326.836  16.815   2.470
 1046   HE21  GLN  50          HE21      GLN  50 327.999  15.688   1.104
 1047   HE22  GLN  50          HE22      GLN  50 329.633  15.189   1.328
 1048    H    GLY  51           H        GLY  51 325.078  20.595   1.630
 1049    HA2  GLY  51           HA2      GLY  51 324.934  22.720   0.698
 1050    HA3  GLY  51           HA3      GLY  51 326.256  23.232   1.746
 1051    H    LEU  52           H        LEU  52 326.070  20.574  -0.571
 1052    HA   LEU  52           HA       LEU  52 328.512  21.553  -1.877
 1053    HB2  LEU  52           HB2      LEU  52 327.201  18.871  -2.265
 1054    HB3  LEU  52           HB3      LEU  52 328.849  19.346  -2.627
 1055    HG   LEU  52           HG       LEU  52 328.095  19.626   0.189
 1056   HD11  LEU  52          HD11      LEU  52 327.144  17.364  -0.939
 1057   HD12  LEU  52          HD12      LEU  52 327.691  17.504   0.733
 1058   HD13  LEU  52          HD13      LEU  52 328.778  16.867  -0.501
 1059   HD21  LEU  52          HD21      LEU  52 330.294  19.165   0.518
 1060   HD22  LEU  52          HD22      LEU  52 330.315  19.896  -1.103
 1061   HD23  LEU  52          HD23      LEU  52 330.401  18.132  -0.914
 1062    H    SER  53           H        SER  53 328.494  22.145  -4.022
 1063    HA   SER  53           HA       SER  53 326.259  22.992  -5.302
 1064    HB2  SER  53           HB2      SER  53 328.129  21.750  -7.200
 1065    HB3  SER  53           HB3      SER  53 327.599  23.425  -7.063
 1066    HG   SER  53           HG       SER  53 329.346  23.855  -5.994
 1067    H    MET  54           H        MET  54 327.237  19.691  -4.953
 1068    HA   MET  54           HA       MET  54 325.949  17.783  -5.160
 1069    HB2  MET  54           HB2      MET  54 323.809  18.842  -5.159
 1070    HB3  MET  54           HB3      MET  54 324.060  19.549  -6.720
 1071    HG2  MET  54           HG2      MET  54 324.143  16.614  -6.505
 1072    HG3  MET  54           HG3      MET  54 322.586  17.416  -6.410
 1073    HE1  MET  54           HE1      MET  54 322.977  19.681  -9.628
 1074    HE2  MET  54           HE2      MET  54 322.732  19.751  -7.883
 1075    HE3  MET  54           HE3      MET  54 321.569  18.906  -8.902
 1076    H    ARG  55           H        ARG  55 326.495  19.823  -7.894
 1077    HA   ARG  55           HA       ARG  55 326.957  17.560  -9.662
 1078    HB2  ARG  55           HB2      ARG  55 327.490  19.812 -11.127
 1079    HB3  ARG  55           HB3      ARG  55 325.909  19.046 -11.010
 1080    HG2  ARG  55           HG2      ARG  55 325.243  20.555  -9.255
 1081    HG3  ARG  55           HG3      ARG  55 326.865  21.252  -9.195
 1082    HD2  ARG  55           HD2      ARG  55 324.755  21.555 -11.300
 1083    HD3  ARG  55           HD3      ARG  55 325.662  22.800 -10.442
 1084    HE   ARG  55           HE       ARG  55 326.484  21.356 -12.806
 1085   HH11  ARG  55          HH11      ARG  55 327.505  23.327 -10.111
 1086   HH12  ARG  55          HH12      ARG  55 328.958  23.857 -10.889
 1087   HH21  ARG  55          HH21      ARG  55 328.396  22.051 -13.828
 1088   HH22  ARG  55          HH22      ARG  55 329.464  23.133 -12.998
 1089    H    GLN  56           H        GLN  56 328.633  19.947  -7.773
 1090    HA   GLN  56           HA       GLN  56 331.111  19.744  -9.167
 1091    HB2  GLN  56           HB2      GLN  56 329.994  21.188  -6.848
 1092    HB3  GLN  56           HB3      GLN  56 331.735  20.911  -6.821
 1093    HG2  GLN  56           HG2      GLN  56 331.984  22.023  -8.952
 1094    HG3  GLN  56           HG3      GLN  56 330.238  22.226  -9.078
 1095   HE21  GLN  56          HE21      GLN  56 332.565  22.742  -6.451
 1096   HE22  GLN  56          HE22      GLN  56 332.132  24.389  -6.159
 1097    H    ILE  57           H        ILE  57 329.635  18.101  -6.434
 1098    HA   ILE  57           HA       ILE  57 332.109  17.129  -5.409
 1099    HB   ILE  57           HB       ILE  57 330.665  15.338  -4.288
 1100   HG12  ILE  57          HG12      ILE  57 328.649  16.856  -5.766
 1101   HG13  ILE  57          HG13      ILE  57 328.568  15.237  -5.082
 1102   HG21  ILE  57          HG21      ILE  57 330.218  16.711  -2.455
 1103   HG22  ILE  57          HG22      ILE  57 330.061  18.144  -3.478
 1104   HG23  ILE  57          HG23      ILE  57 331.641  17.396  -3.249
 1105   HD11  ILE  57          HD11      ILE  57 328.148  17.839  -3.672
 1106   HD12  ILE  57          HD12      ILE  57 328.261  16.276  -2.858
 1107   HD13  ILE  57          HD13      ILE  57 326.945  16.585  -3.997
 1108    H    ARG  58           H        ARG  58 332.491  14.708  -5.261
 1109    HA   ARG  58           HA       ARG  58 331.991  13.545  -7.904
 1110    HB2  ARG  58           HB2      ARG  58 334.447  13.119  -6.240
 1111    HB3  ARG  58           HB3      ARG  58 334.193  12.686  -7.927
 1112    HG2  ARG  58           HG2      ARG  58 334.066  15.518  -6.981
 1113    HG3  ARG  58           HG3      ARG  58 335.580  14.750  -7.444
 1114    HD2  ARG  58           HD2      ARG  58 334.518  16.014  -9.252
 1115    HD3  ARG  58           HD3      ARG  58 334.750  14.316  -9.642
 1116    HE   ARG  58           HE       ARG  58 332.172  15.527  -8.913
 1117   HH11  ARG  58          HH11      ARG  58 334.047  13.168 -10.692
 1118   HH12  ARG  58          HH12      ARG  58 332.671  12.528 -11.521
 1119   HH21  ARG  58          HH21      ARG  58 330.374  14.678 -10.007
 1120   HH22  ARG  58          HH22      ARG  58 330.591  13.381 -11.135
 1121    H    PHE  59           H        PHE  59 331.003  11.565  -7.816
 1122    HA   PHE  59           HA       PHE  59 331.009  10.232  -5.194
 1123    HB2  PHE  59           HB2      PHE  59 328.969  10.174  -7.402
 1124    HB3  PHE  59           HB3      PHE  59 329.012   8.977  -6.147
 1125    HD1  PHE  59           HD2      PHE  59 329.871  12.410  -5.293
 1126    HD2  PHE  59           HD1      PHE  59 326.748   9.537  -5.542
 1127    HE1  PHE  59           HE2      PHE  59 328.463  13.822  -3.864
 1128    HE2  PHE  59           HE1      PHE  59 325.331  10.951  -4.126
 1129    HZ   PHE  59           HZ       PHE  59 326.190  13.102  -3.277
 1130    H    ARG  60           H        ARG  60 331.166   7.964  -5.139
 1131    HA   ARG  60           HA       ARG  60 331.826   6.514  -7.526
 1132    HB2  ARG  60           HB2      ARG  60 333.984   7.644  -6.600
 1133    HB3  ARG  60           HB3      ARG  60 333.869   6.422  -5.341
 1134    HG2  ARG  60           HG2      ARG  60 333.499   4.979  -7.640
 1135    HG3  ARG  60           HG3      ARG  60 334.719   6.165  -8.091
 1136    HD2  ARG  60           HD2      ARG  60 335.473   3.935  -7.080
 1137    HD3  ARG  60           HD3      ARG  60 336.219   5.412  -6.492
 1138    HE   ARG  60           HE       ARG  60 333.943   4.506  -4.966
 1139   HH11  ARG  60          HH11      ARG  60 337.408   4.334  -5.357
 1140   HH12  ARG  60          HH12      ARG  60 337.694   3.858  -3.717
 1141   HH21  ARG  60          HH21      ARG  60 334.320   3.879  -2.809
 1142   HH22  ARG  60          HH22      ARG  60 335.942   3.599  -2.271
 1143    H    PHE  61           H        PHE  61 331.182   4.432  -7.289
 1144    HA   PHE  61           HA       PHE  61 330.199   3.720  -4.637
 1145    HB2  PHE  61           HB2      PHE  61 328.499   3.480  -6.274
 1146    HB3  PHE  61           HB3      PHE  61 329.548   2.628  -7.387
 1147    HD1  PHE  61           HD2      PHE  61 328.188   2.381  -3.956
 1148    HD2  PHE  61           HD1      PHE  61 329.381   0.311  -7.472
 1149    HE1  PHE  61           HE2      PHE  61 327.402   0.260  -2.976
 1150    HE2  PHE  61           HE1      PHE  61 328.592  -1.810  -6.506
 1151    HZ   PHE  61           HZ       PHE  61 327.600  -1.837  -4.251
 1152    H    ASP  62           H        ASP  62 330.751   1.609  -3.736
 1153    HA   ASP  62           HA       ASP  62 333.360   1.159  -3.443
 1154    HB2  ASP  62           HB2      ASP  62 331.034  -0.704  -3.253
 1155    HB3  ASP  62           HB3      ASP  62 332.663  -1.307  -2.960
 1156    H    GLY  63           H        GLY  63 334.367   1.457  -5.558
 1157    HA2  GLY  63           HA2      GLY  63 335.921  -0.033  -6.735
 1158    HA3  GLY  63           HA3      GLY  63 334.564  -1.117  -6.993
 1159    H    GLN  64           H        GLN  64 332.700   0.952  -7.689
 1160    HA   GLN  64           HA       GLN  64 333.786   1.715 -10.321
 1161    HB2  GLN  64           HB2      GLN  64 332.130   0.618 -11.293
 1162    HB3  GLN  64           HB3      GLN  64 331.630   0.037  -9.712
 1163    HG2  GLN  64           HG2      GLN  64 330.607   2.612  -9.924
 1164    HG3  GLN  64           HG3      GLN  64 330.325   1.873 -11.474
 1165   HE21  GLN  64          HE21      GLN  64 329.911  -0.707 -10.735
 1166   HE22  GLN  64          HE22      GLN  64 328.499  -0.787  -9.765
 1167    HA   PRO  65           HA       PRO  65 332.424   5.882  -9.489
 1168    HB2  PRO  65           HB2      PRO  65 332.571   6.425 -12.313
 1169    HB3  PRO  65           HB3      PRO  65 333.786   6.810 -11.096
 1170    HG2  PRO  65           HG2      PRO  65 334.181   5.022 -13.100
 1171    HG3  PRO  65           HG3      PRO  65 334.944   4.855 -11.503
 1172    HD2  PRO  65           HD2      PRO  65 332.401   3.585 -12.505
 1173    HD3  PRO  65           HD3      PRO  65 333.791   2.824 -11.737
 1174    H    ILE  66           H        ILE  66 330.343   6.756  -9.355
 1175    HA   ILE  66           HA       ILE  66 328.407   5.608 -11.225
 1176    HB   ILE  66           HB       ILE  66 326.710   5.931  -9.728
 1177   HG12  ILE  66          HG12      ILE  66 328.660   7.664  -8.330
 1178   HG13  ILE  66          HG13      ILE  66 326.932   7.840  -8.537
 1179   HG21  ILE  66          HG21      ILE  66 327.234   4.183  -8.348
 1180   HG22  ILE  66          HG22      ILE  66 328.797   4.869  -7.899
 1181   HG23  ILE  66          HG23      ILE  66 328.598   4.088  -9.471
 1182   HD11  ILE  66          HD11      ILE  66 326.551   6.167  -6.814
 1183   HD12  ILE  66          HD12      ILE  66 327.490   7.530  -6.219
 1184   HD13  ILE  66          HD13      ILE  66 328.293   5.999  -6.595
 1185    H    ASN  67           H        ASN  67 329.086   7.104 -12.678
 1186    HA   ASN  67           HA       ASN  67 328.910   9.824 -12.759
 1187    HB2  ASN  67           HB2      ASN  67 327.647   8.352 -15.015
 1188    HB3  ASN  67           HB3      ASN  67 328.719   9.741 -15.073
 1189   HD21  ASN  67          HD21      ASN  67 330.499   9.208 -16.093
 1190   HD22  ASN  67          HD22      ASN  67 331.397   7.748 -15.884
 1191    H    GLU  68           H        GLU  68 327.160   9.845 -11.033
 1192    HA   GLU  68           HA       GLU  68 324.983  10.123 -10.294
 1193    HB2  GLU  68           HB2      GLU  68 325.282  12.335 -10.567
 1194    HB3  GLU  68           HB3      GLU  68 325.863  12.156 -12.213
 1195    HG2  GLU  68           HG2      GLU  68 323.240  11.632 -12.537
 1196    HG3  GLU  68           HG3      GLU  68 323.184  12.763 -11.211
 1197    H    THR  69           H        THR  69 324.719  10.469 -13.746
 1198    HA   THR  69           HA       THR  69 322.055   9.766 -14.034
 1199    HB   THR  69           HB       THR  69 322.414   9.403 -16.332
 1200    HG1  THR  69           HG1      THR  69 325.170   9.055 -15.725
 1201   HG21  THR  69          HG21      THR  69 324.691  11.187 -16.123
 1202   HG22  THR  69          HG22      THR  69 323.365  11.630 -15.039
 1203   HG23  THR  69          HG23      THR  69 323.076  11.475 -16.778
 1204    H    ASP  70           H        ASP  70 324.751   7.697 -13.353
 1205    HA   ASP  70           HA       ASP  70 323.530   5.232 -14.092
 1206    HB2  ASP  70           HB2      ASP  70 325.833   5.976 -12.319
 1207    HB3  ASP  70           HB3      ASP  70 325.294   4.325 -12.489
 1208    H    THR  71           H        THR  71 322.082   4.095 -12.991
 1209    HA   THR  71           HA       THR  71 321.274   5.083 -10.365
 1210    HB   THR  71           HB       THR  71 319.256   3.980 -10.632
 1211    HG1  THR  71           HG1      THR  71 319.741   1.923 -11.044
 1212   HG21  THR  71          HG21      THR  71 319.473   5.689 -12.437
 1213   HG22  THR  71          HG22      THR  71 318.373   4.376 -12.835
 1214   HG23  THR  71          HG23      THR  71 319.992   4.407 -13.525
 1215    HA   PRO  72           HA       PRO  72 323.546   2.176  -8.060
 1216    HB2  PRO  72           HB2      PRO  72 321.003   1.312  -6.804
 1217    HB3  PRO  72           HB3      PRO  72 322.510   1.839  -6.050
 1218    HG2  PRO  72           HG2      PRO  72 320.310   3.407  -6.221
 1219    HG3  PRO  72           HG3      PRO  72 321.956   4.055  -6.210
 1220    HD2  PRO  72           HD2      PRO  72 320.001   3.901  -8.393
 1221    HD3  PRO  72           HD3      PRO  72 321.430   4.939  -8.220
 1222    H    ALA  73           H        ALA  73 320.340   0.706  -8.710
 1223    HA   ALA  73           HA       ALA  73 321.139  -1.923  -8.894
 1224    HB1  ALA  73           HB1      ALA  73 319.207  -1.758 -10.868
 1225    HB2  ALA  73           HB2      ALA  73 318.838  -0.410  -9.800
 1226    HB3  ALA  73           HB3      ALA  73 318.928  -2.048  -9.151
 1227    H    GLN  74           H        GLN  74 320.904   0.385 -11.605
 1228    HA   GLN  74           HA       GLN  74 321.714  -1.178 -13.659
 1229    HB2  GLN  74           HB2      GLN  74 321.779   1.621 -13.019
 1230    HB3  GLN  74           HB3      GLN  74 322.968   1.159 -14.199
 1231    HG2  GLN  74           HG2      GLN  74 321.301   0.286 -15.650
 1232    HG3  GLN  74           HG3      GLN  74 320.055   0.491 -14.418
 1233   HE21  GLN  74          HE21      GLN  74 322.388   2.296 -16.367
 1234   HE22  GLN  74          HE22      GLN  74 321.423   3.721 -16.525
 1235    H    LEU  75           H        LEU  75 323.633   0.263 -11.124
 1236    HA   LEU  75           HA       LEU  75 326.124  -0.599 -12.291
 1237    HB2  LEU  75           HB2      LEU  75 325.524   0.753  -9.655
 1238    HB3  LEU  75           HB3      LEU  75 327.101   0.623 -10.408
 1239    HG   LEU  75           HG       LEU  75 324.821   2.449 -11.082
 1240   HD11  LEU  75          HD11      LEU  75 327.724   3.024 -11.382
 1241   HD12  LEU  75          HD12      LEU  75 327.010   2.920  -9.773
 1242   HD13  LEU  75          HD13      LEU  75 326.397   4.096 -10.932
 1243   HD21  LEU  75          HD21      LEU  75 326.612   1.157 -13.074
 1244   HD22  LEU  75          HD22      LEU  75 326.240   2.872 -13.258
 1245   HD23  LEU  75          HD23      LEU  75 324.933   1.684 -13.225
 1246    H    GLU  76           H        GLU  76 323.854  -1.461  -9.791
 1247    HA   GLU  76           HA       GLU  76 323.466  -3.590  -9.049
 1248    HB2  GLU  76           HB2      GLU  76 326.409  -4.152  -9.405
 1249    HB3  GLU  76           HB3      GLU  76 325.178  -5.305  -8.919
 1250    HG2  GLU  76           HG2      GLU  76 324.166  -4.277 -11.254
 1251    HG3  GLU  76           HG3      GLU  76 325.900  -4.367 -11.568
 1252    H    MET  77           H        MET  77 323.620  -1.422  -7.536
 1253    HA   MET  77           HA       MET  77 325.405  -1.725  -5.306
 1254    HB2  MET  77           HB2      MET  77 322.986   0.009  -5.810
 1255    HB3  MET  77           HB3      MET  77 323.949   0.130  -4.340
 1256    HG2  MET  77           HG2      MET  77 325.860   0.253  -6.278
 1257    HG3  MET  77           HG3      MET  77 324.509   1.063  -7.056
 1258    HE1  MET  77           HE1      MET  77 324.824   3.845  -6.909
 1259    HE2  MET  77           HE2      MET  77 326.202   2.824  -7.329
 1260    HE3  MET  77           HE3      MET  77 326.405   4.151  -6.180
 1261    H    GLU  78           H        GLU  78 324.519  -1.932  -3.033
 1262    HA   GLU  78           HA       GLU  78 322.067  -3.435  -2.789
 1263    HB2  GLU  78           HB2      GLU  78 324.659  -4.566  -1.848
 1264    HB3  GLU  78           HB3      GLU  78 323.092  -5.205  -1.481
 1265    HG2  GLU  78           HG2      GLU  78 322.942  -6.294  -3.393
 1266    HG3  GLU  78           HG3      GLU  78 323.483  -4.902  -4.317
 1267    H    ASP  79           H        ASP  79 321.108  -3.097  -1.038
 1268    HA   ASP  79           HA       ASP  79 320.959  -1.134   0.575
 1269    HB2  ASP  79           HB2      ASP  79 320.318  -3.865   0.937
 1270    HB3  ASP  79           HB3      ASP  79 320.962  -3.284   2.468
 1271    H    GLU  80           H        GLU  80 321.945   0.025   2.130
 1272    HA   GLU  80           HA       GLU  80 323.494   0.767   3.628
 1273    HB2  GLU  80           HB2      GLU  80 324.772  -1.936   3.761
 1274    HB3  GLU  80           HB3      GLU  80 324.658  -0.702   5.002
 1275    HG2  GLU  80           HG2      GLU  80 322.245  -1.096   5.172
 1276    HG3  GLU  80           HG3      GLU  80 322.385  -2.368   3.965
 1277    H    ASP  81           H        ASP  81 324.123  -0.247   0.607
 1278    HA   ASP  81           HA       ASP  81 326.849  -0.364   0.291
 1279    HB2  ASP  81           HB2      ASP  81 325.988   1.170  -1.871
 1280    HB3  ASP  81           HB3      ASP  81 326.076  -0.579  -1.820
 1281    H    THR  82           H        THR  82 328.325   1.297  -0.387
 1282    HA   THR  82           HA       THR  82 327.655   3.951   0.721
 1283    HB   THR  82           HB       THR  82 330.466   2.862   0.651
 1284    HG1  THR  82           HG1      THR  82 329.459   1.547   2.089
 1285   HG21  THR  82          HG21      THR  82 329.190   5.106   2.200
 1286   HG22  THR  82          HG22      THR  82 330.283   5.291   0.819
 1287   HG23  THR  82          HG23      THR  82 330.872   4.590   2.332
 1288    H    ILE  83           H        ILE  83 328.798   5.775  -0.304
 1289    HA   ILE  83           HA       ILE  83 329.900   5.243  -2.937
 1290    HB   ILE  83           HB       ILE  83 327.437   6.872  -2.348
 1291   HG12  ILE  83          HG12      ILE  83 327.981   4.934  -4.588
 1292   HG13  ILE  83          HG13      ILE  83 327.424   4.410  -3.006
 1293   HG21  ILE  83          HG21      ILE  83 327.581   7.967  -4.464
 1294   HG22  ILE  83          HG22      ILE  83 328.951   6.980  -4.964
 1295   HG23  ILE  83          HG23      ILE  83 329.153   8.197  -3.707
 1296   HD11  ILE  83          HD11      ILE  83 325.602   6.303  -3.563
 1297   HD12  ILE  83          HD12      ILE  83 325.421   4.588  -3.937
 1298   HD13  ILE  83          HD13      ILE  83 325.975   5.706  -5.179
 1299    H    ASP  84           H        ASP  84 331.862   6.122  -2.585
 1300    HA   ASP  84           HA       ASP  84 332.341   8.153  -0.749
 1301    HB2  ASP  84           HB2      ASP  84 334.233   6.989  -1.002
 1302    HB3  ASP  84           HB3      ASP  84 333.888   6.633  -2.680
 1303    H    VAL  85           H        VAL  85 332.481  10.237  -0.831
 1304    HA   VAL  85           HA       VAL  85 332.066  11.700  -3.368
 1305    HB   VAL  85           HB       VAL  85 331.413  12.511  -0.533
 1306   HG11  VAL  85          HG11      VAL  85 330.344  14.539  -1.765
 1307   HG12  VAL  85          HG12      VAL  85 331.489  14.132  -3.050
 1308   HG13  VAL  85          HG13      VAL  85 332.082  14.551  -1.444
 1309   HG21  VAL  85          HG21      VAL  85 329.935  11.157  -2.508
 1310   HG22  VAL  85          HG22      VAL  85 329.253  12.775  -2.335
 1311   HG23  VAL  85          HG23      VAL  85 329.407  11.726  -0.926
 1312    H    PHE  86           H        PHE  86 333.815  12.838  -4.081
 1313    HA   PHE  86           HA       PHE  86 335.757  13.752  -2.093
 1314    HB2  PHE  86           HB2      PHE  86 336.277  11.904  -4.377
 1315    HB3  PHE  86           HB3      PHE  86 337.480  13.140  -4.024
 1316    HD1  PHE  86           HD1      PHE  86 337.430  13.281  -1.118
 1317    HD2  PHE  86           HD2      PHE  86 337.190   9.898  -3.688
 1318    HE1  PHE  86           HE1      PHE  86 338.370  11.867   0.662
 1319    HE2  PHE  86           HE2      PHE  86 338.128   8.477  -1.912
 1320    HZ   PHE  86           HZ       PHE  86 338.719   9.461   0.267
 1321    H    GLN  87           H        GLN  87 335.573  15.818  -2.295
 1322    HA   GLN  87           HA       GLN  87 336.018  17.027  -4.906
 1323    HB2  GLN  87           HB2      GLN  87 333.531  16.672  -4.376
 1324    HB3  GLN  87           HB3      GLN  87 333.699  18.019  -3.272
 1325    HG2  GLN  87           HG2      GLN  87 334.864  18.727  -5.781
 1326    HG3  GLN  87           HG3      GLN  87 333.272  18.052  -6.050
 1327   HE21  GLN  87          HE21      GLN  87 331.495  18.933  -4.624
 1328   HE22  GLN  87          HE22      GLN  87 331.537  20.631  -4.305
 1329    H    GLN  88           H        GLN  88 337.653  18.387  -4.647
 1330    HA   GLN  88           HA       GLN  88 338.455  19.409  -2.125
 1331    HB2  GLN  88           HB2      GLN  88 339.299  20.400  -4.841
 1332    HB3  GLN  88           HB3      GLN  88 340.171  20.593  -3.329
 1333    HG2  GLN  88           HG2      GLN  88 339.768  17.837  -3.654
 1334    HG3  GLN  88           HG3      GLN  88 340.271  18.454  -5.226
 1335   HE21  GLN  88          HE21      GLN  88 341.305  17.368  -2.255
 1336   HE22  GLN  88          HE22      GLN  88 342.938  17.928  -2.315
 1337    H    GLN  89           H        GLN  89 337.956  21.255  -1.103
 1338    HA   GLN  89           HA       GLN  89 336.073  23.066  -2.431
 1339    HB2  GLN  89           HB2      GLN  89 335.580  23.893  -0.156
 1340    HB3  GLN  89           HB3      GLN  89 335.306  22.164  -0.316
 1341    HG2  GLN  89           HG2      GLN  89 336.635  21.790   1.404
 1342    HG3  GLN  89           HG3      GLN  89 337.979  22.530   0.536
 1343   HE21  GLN  89          HE21      GLN  89 335.067  23.492   2.325
 1344   HE22  GLN  89          HE22      GLN  89 335.811  24.803   3.170
 1345    H    THR  90           H        THR  90 336.361  25.312  -2.417
 1346    HA   THR  90           HA       THR  90 338.801  26.460  -1.387
 1347    HB   THR  90           HB       THR  90 339.659  27.244  -3.514
 1348    HG1  THR  90           HG1      THR  90 338.682  26.679  -5.439
 1349   HG21  THR  90          HG21      THR  90 340.346  24.967  -2.770
 1350   HG22  THR  90          HG22      THR  90 340.451  25.241  -4.509
 1351   HG23  THR  90          HG23      THR  90 339.110  24.310  -3.842
 1352    H1   THR   2           HT1      THR   2 291.326  -3.889  20.766
 1353    H2   THR   2           HT2      THR   2 292.725  -4.837  20.467
 1354    H3   THR   2           HT3      THR   2 291.388  -5.515  21.303
 1355    HA   THR   2           HA       THR   2 291.313  -4.537  18.531
 1356    HB   THR   2           HB       THR   2 292.782  -6.383  18.512
 1357    HG1  THR   2           HG1      THR   2 290.291  -7.664  18.171
 1358   HG21  THR   2          HG21      THR   2 291.801  -8.600  19.611
 1359   HG22  THR   2          HG22      THR   2 291.125  -7.412  20.726
 1360   HG23  THR   2          HG23      THR   2 292.868  -7.491  20.473
 1361    H    VAL   3           H        VAL   3 289.466  -5.832  17.421
 1362    HA   VAL   3           HA       VAL   3 287.154  -5.934  19.247
 1363    HB   VAL   3           HB       VAL   3 285.774  -5.164  17.274
 1364   HG11  VAL   3          HG11      VAL   3 287.598  -2.924  17.843
 1365   HG12  VAL   3          HG12      VAL   3 286.953  -3.762  19.254
 1366   HG13  VAL   3          HG13      VAL   3 285.854  -3.057  18.069
 1367   HG21  VAL   3          HG21      VAL   3 287.090  -3.772  15.611
 1368   HG22  VAL   3          HG22      VAL   3 287.206  -5.522  15.433
 1369   HG23  VAL   3          HG23      VAL   3 288.524  -4.624  16.183
 1370    H    GLY   4           H        GLY   4 288.361  -7.001  16.063
 1371    HA2  GLY   4           HA2      GLY   4 288.231  -9.614  16.105
 1372    HA3  GLY   4           HA3      GLY   4 286.510  -9.273  16.170
 1373    H    ASP   5           H        ASP   5 286.192 -10.361  14.198
 1374    HA   ASP   5           HA       ASP   5 287.532  -9.893  11.806
 1375    HB2  ASP   5           HB2      ASP   5 285.763 -11.680  12.394
 1376    HB3  ASP   5           HB3      ASP   5 284.579 -10.469  11.914
 1377    H    GLU   6           H        GLU   6 287.114  -8.577  10.013
 1378    HA   GLU   6           HA       GLU   6 285.027  -6.629  10.003
 1379    HB2  GLU   6           HB2      GLU   6 287.659  -5.896  11.106
 1380    HB3  GLU   6           HB3      GLU   6 287.047  -4.798   9.877
 1381    HG2  GLU   6           HG2      GLU   6 285.848  -3.814  11.450
 1382    HG3  GLU   6           HG3      GLU   6 284.880  -5.283  11.560
 1383    H    ILE   7           H        ILE   7 285.311  -8.320   8.121
 1384    HA   ILE   7           HA       ILE   7 287.187  -7.898   6.093
 1385    HB   ILE   7           HB       ILE   7 285.828  -9.233   4.693
 1386   HG12  ILE   7          HG12      ILE   7 283.723  -7.991   4.894
 1387   HG13  ILE   7          HG13      ILE   7 283.457  -9.712   5.150
 1388   HG21  ILE   7          HG21      ILE   7 285.959 -11.099   5.934
 1389   HG22  ILE   7          HG22      ILE   7 284.852 -10.478   7.157
 1390   HG23  ILE   7          HG23      ILE   7 286.559 -10.032   7.208
 1391   HD11  ILE   7          HD11      ILE   7 283.589  -9.208   7.630
 1392   HD12  ILE   7          HD12      ILE   7 282.165  -8.625   6.768
 1393   HD13  ILE   7          HD13      ILE   7 283.467  -7.508   7.178
 1394    H    VAL   8           H        VAL   8 286.303  -7.302   3.753
 1395    HA   VAL   8           HA       VAL   8 284.608  -4.934   3.802
 1396    HB   VAL   8           HB       VAL   8 287.199  -4.436   4.150
 1397   HG11  VAL   8          HG11      VAL   8 288.346  -3.914   2.094
 1398   HG12  VAL   8          HG12      VAL   8 286.959  -4.448   1.146
 1399   HG13  VAL   8          HG13      VAL   8 287.879  -5.614   2.094
 1400   HG21  VAL   8          HG21      VAL   8 285.346  -2.806   4.046
 1401   HG22  VAL   8          HG22      VAL   8 285.491  -2.794   2.290
 1402   HG23  VAL   8          HG23      VAL   8 286.826  -2.222   3.287
 1403    H    ASP   9           H        ASP   9 284.317  -4.063   1.475
 1404    HA   ASP   9           HA       ASP   9 284.528  -6.248  -0.468
 1405    HB2  ASP   9           HB2      ASP   9 282.243  -5.843  -1.240
 1406    HB3  ASP   9           HB3      ASP   9 282.263  -6.294   0.462
 1407    H    LEU  10           H        LEU  10 285.847  -5.473  -2.017
 1408    HA   LEU  10           HA       LEU  10 285.106  -3.549  -3.841
 1409    HB2  LEU  10           HB2      LEU  10 286.792  -1.726  -3.243
 1410    HB3  LEU  10           HB3      LEU  10 285.282  -1.767  -2.362
 1411    HG   LEU  10           HG       LEU  10 287.656  -1.412  -1.187
 1412   HD11  LEU  10          HD11      LEU  10 285.143  -1.613  -0.340
 1413   HD12  LEU  10          HD12      LEU  10 286.520  -1.513   0.757
 1414   HD13  LEU  10          HD13      LEU  10 285.799  -3.078   0.389
 1415   HD21  LEU  10          HD21      LEU  10 287.240  -4.398  -1.113
 1416   HD22  LEU  10          HD22      LEU  10 288.306  -3.508  -0.034
 1417   HD23  LEU  10          HD23      LEU  10 288.625  -3.527  -1.767
 1418    H    THR  11           H        THR  11 286.648  -3.185  -5.510
 1419    HA   THR  11           HA       THR  11 289.194  -4.630  -5.269
 1420    HB   THR  11           HB       THR  11 287.762  -4.800  -7.874
 1421    HG1  THR  11           HG1      THR  11 286.972  -6.916  -6.826
 1422   HG21  THR  11          HG21      THR  11 289.991  -5.769  -7.711
 1423   HG22  THR  11          HG22      THR  11 288.777  -7.014  -8.003
 1424   HG23  THR  11          HG23      THR  11 289.459  -6.809  -6.393
 1425    H    CYS  12           H        CYS  12 290.614  -3.014  -5.390
 1426    HA   CYS  12           HA       CYS  12 290.166  -0.714  -7.063
 1427    HB2  CYS  12           HB2      CYS  12 291.570  -1.101  -4.764
 1428    HB3  CYS  12           HB3      CYS  12 292.867  -1.138  -5.953
 1429    HG   CYS  12           HG       CYS  12 291.802   1.326  -4.895
 1430    H    GLU  13           H        GLU  13 292.242   0.024  -8.357
 1431    HA   GLU  13           HA       GLU  13 293.392  -2.206  -9.855
 1432    HB2  GLU  13           HB2      GLU  13 291.721   0.005 -11.043
 1433    HB3  GLU  13           HB3      GLU  13 292.860  -0.930 -12.001
 1434    HG2  GLU  13           HG2      GLU  13 291.532  -2.735 -12.063
 1435    HG3  GLU  13           HG3      GLU  13 290.986  -2.522 -10.400
 1436    H    SER  14           H        SER  14 294.782  -1.004 -11.761
 1437    HA   SER  14           HA       SER  14 296.585   0.291 -12.273
 1438    HB2  SER  14           HB2      SER  14 296.015   2.059  -9.903
 1439    HB3  SER  14           HB3      SER  14 296.773   2.483 -11.437
 1440    HG   SER  14           HG       SER  14 294.550   3.176 -11.206
 1441    H    LEU  15           H        LEU  15 298.773   0.622 -11.606
 1442    HA   LEU  15           HA       LEU  15 299.504  -1.104  -9.364
 1443    HB2  LEU  15           HB2      LEU  15 301.751  -1.079 -10.332
 1444    HB3  LEU  15           HB3      LEU  15 300.546  -1.593 -11.498
 1445    HG   LEU  15           HG       LEU  15 300.697   1.110 -11.975
 1446   HD11  LEU  15          HD11      LEU  15 303.412   0.092 -11.180
 1447   HD12  LEU  15          HD12      LEU  15 302.568   1.525 -10.593
 1448   HD13  LEU  15          HD13      LEU  15 303.178   1.476 -12.248
 1449   HD21  LEU  15          HD21      LEU  15 301.302   0.452 -14.053
 1450   HD22  LEU  15          HD22      LEU  15 300.904  -1.141 -13.411
 1451   HD23  LEU  15          HD23      LEU  15 302.584  -0.606 -13.466
 1452    H    GLU  16           H        GLU  16 301.867  -0.266  -8.522
 1453    HA   GLU  16           HA       GLU  16 301.295   2.385  -7.392
 1454    HB2  GLU  16           HB2      GLU  16 301.509   0.424  -5.837
 1455    HB3  GLU  16           HB3      GLU  16 303.192   0.291  -6.327
 1456    HG2  GLU  16           HG2      GLU  16 303.242   2.825  -5.607
 1457    HG3  GLU  16           HG3      GLU  16 301.861   2.329  -4.629
 1458    HA   PRO  17           HA       PRO  17 304.695   4.012  -9.755
 1459    HB2  PRO  17           HB2      PRO  17 305.120   6.280  -8.288
 1460    HB3  PRO  17           HB3      PRO  17 303.816   6.107  -9.467
 1461    HG2  PRO  17           HG2      PRO  17 303.728   5.824  -6.489
 1462    HG3  PRO  17           HG3      PRO  17 302.573   6.622  -7.573
 1463    HD2  PRO  17           HD2      PRO  17 302.125   4.162  -6.571
 1464    HD3  PRO  17           HD3      PRO  17 301.589   4.626  -8.199
 1465    H    VAL  18           H        VAL  18 306.893   5.175  -9.123
 1466    HA   VAL  18           HA       VAL  18 308.078   3.934  -6.754
 1467    HB   VAL  18           HB       VAL  18 310.094   3.305  -8.171
 1468   HG11  VAL  18          HG11      VAL  18 309.336   1.240  -7.880
 1469   HG12  VAL  18          HG12      VAL  18 308.168   1.440  -9.186
 1470   HG13  VAL  18          HG13      VAL  18 307.741   1.909  -7.540
 1471   HG21  VAL  18          HG21      VAL  18 308.888   4.629 -10.162
 1472   HG22  VAL  18          HG22      VAL  18 308.306   3.000 -10.504
 1473   HG23  VAL  18          HG23      VAL  18 310.040   3.320 -10.437
 1474    H    VAL  19           H        VAL  19 309.475   5.234  -5.733
 1475    HA   VAL  19           HA       VAL  19 310.946   7.278  -7.157
 1476    HB   VAL  19           HB       VAL  19 308.794   8.397  -6.727
 1477   HG11  VAL  19          HG11      VAL  19 307.823   8.630  -4.652
 1478   HG12  VAL  19          HG12      VAL  19 309.338   8.354  -3.793
 1479   HG13  VAL  19          HG13      VAL  19 308.489   7.001  -4.543
 1480   HG21  VAL  19          HG21      VAL  19 309.951  10.183  -5.053
 1481   HG22  VAL  19          HG22      VAL  19 310.293  10.077  -6.780
 1482   HG23  VAL  19          HG23      VAL  19 311.366   9.296  -5.619
 1483    H    VAL  20           H        VAL  20 312.846   7.725  -6.188
 1484    HA   VAL  20           HA       VAL  20 313.391   6.379  -3.648
 1485    HB   VAL  20           HB       VAL  20 315.608   6.223  -4.245
 1486   HG11  VAL  20          HG11      VAL  20 314.774   6.479  -7.074
 1487   HG12  VAL  20          HG12      VAL  20 313.882   5.345  -6.066
 1488   HG13  VAL  20          HG13      VAL  20 315.627   5.161  -6.265
 1489   HG21  VAL  20          HG21      VAL  20 315.169   8.826  -5.573
 1490   HG22  VAL  20          HG22      VAL  20 316.420   7.787  -6.253
 1491   HG23  VAL  20          HG23      VAL  20 316.505   8.278  -4.562
 1492    H    ASP  21           H        ASP  21 314.801   7.525  -2.053
 1493    HA   ASP  21           HA       ASP  21 314.742  10.427  -2.171
 1494    HB2  ASP  21           HB2      ASP  21 312.579   9.220  -1.047
 1495    HB3  ASP  21           HB3      ASP  21 313.622   9.405   0.360
 1496    H    LEU  22           H        LEU  22 315.215  10.883   0.581
 1497    HA   LEU  22           HA       LEU  22 317.893   9.695   0.846
 1498    HB2  LEU  22           HB2      LEU  22 317.754  12.163   0.566
 1499    HB3  LEU  22           HB3      LEU  22 316.830  12.250   2.053
 1500    HG   LEU  22           HG       LEU  22 318.815  11.247   3.240
 1501   HD11  LEU  22          HD11      LEU  22 319.838  11.310   0.485
 1502   HD12  LEU  22          HD12      LEU  22 320.263  10.261   1.837
 1503   HD13  LEU  22          HD13      LEU  22 320.950  11.881   1.730
 1504   HD21  LEU  22          HD21      LEU  22 318.442  13.569   3.488
 1505   HD22  LEU  22          HD22      LEU  22 319.023  13.909   1.858
 1506   HD23  LEU  22          HD23      LEU  22 320.153  13.380   3.105
 1507    H    THR  23           H        THR  23 315.894   8.080   1.714
 1508    HA   THR  23           HA       THR  23 314.953   7.022   3.515
 1509    HB   THR  23           HB       THR  23 317.337   6.371   3.623
 1510    HG1  THR  23           HG1      THR  23 316.975   5.332   5.418
 1511   HG21  THR  23          HG21      THR  23 318.607   7.386   5.613
 1512   HG22  THR  23          HG22      THR  23 317.542   8.772   5.384
 1513   HG23  THR  23          HG23      THR  23 318.601   8.249   4.075
 1514    H    HIS  24           H        HIS  24 315.295   7.308   6.272
 1515    HA   HIS  24           HA       HIS  24 314.377  10.049   6.805
 1516    HB2  HIS  24           HB2      HIS  24 312.812   7.645   6.952
 1517    HB3  HIS  24           HB3      HIS  24 312.976   8.331   8.565
 1518    HD1  HIS  24           HD1      HIS  24 312.689  11.249   8.188
 1519    HD2  HIS  24           HD2      HIS  24 310.467   8.531   5.965
 1520    HE1  HIS  24           HE1      HIS  24 310.672  12.523   7.389
 1521    HE2  HIS  24           HE2      HIS  24 309.385  10.881   5.977
 1522    H    ASN  25           H        ASN  25 316.952   8.792   7.244
 1523    HA   ASN  25           HA       ASN  25 317.317   9.548   9.986
 1524    HB2  ASN  25           HB2      ASN  25 318.343   7.372  10.671
 1525    HB3  ASN  25           HB3      ASN  25 316.604   7.282  10.402
 1526   HD21  ASN  25          HD21      ASN  25 315.961   6.588   8.176
 1527   HD22  ASN  25          HD22      ASN  25 316.882   5.321   7.449
 1528    H    ASP  26           H        ASP  26 319.287  10.413  10.237
 1529    HA   ASP  26           HA       ASP  26 321.508   9.523   8.583
 1530    HB2  ASP  26           HB2      ASP  26 320.169  12.170   8.317
 1531    HB3  ASP  26           HB3      ASP  26 321.927  12.133   8.222