*HEADER    STRUCTURAL PROTEIN                      18-JAN-03   1NPQ              
*TITLE     STRUCTURE OF A RHODAMINE-LABELED N-DOMAIN TROPONIN C MUTANT           
*TITLE    2 (CA2+ SATURATED) IN COMPLEX WITH SKELETAL TROPONIN I 115-            
*TITLE    3 131                                                                  
*COMPND    MOL_ID: 1;                                                            
*COMPND   2 MOLECULE: TROPONIN C;                                                
*COMPND   3 CHAIN: A;                                                            
*COMPND   4 FRAGMENT: TNC, RESIDUES 1-90;                                        
*COMPND   5 SYNONYM: TROPONIN C, SKELETAL MUSCLE;                                
*COMPND   6 ENGINEERED: YES;                                                     
*COMPND   7 MUTATION: YES;                                                       
*COMPND   8 MOL_ID: 2;                                                           
*COMPND   9 MOLECULE: TROPONIN I;                                                
*COMPND  10 CHAIN: B;                                                            
*COMPND  11 FRAGMENT: SWITCH PEPTIDE, RESIDUES 115-131;                          
*COMPND  12 SYNONYM: TROPONIN I, FAST SKELETAL MUSCLE; TROPONIN I,               
*COMPND  13 FAST-TWITCH ISOFORM;                                                 
*COMPND  14 ENGINEERED: YES                                                      
*SOURCE    MOL_ID: 1;                                                            
*SOURCE   2 ORGANISM_SCIENTIFIC: GALLUS GALLUS;                                  
*SOURCE   3 ORGANISM_COMMON: CHICKEN;                                            
*SOURCE   4 GENE: TNNC2;                                                         
*SOURCE   5 EXPRESSION_SYSTEM: ESCHERICHIA COLI;                                 
*SOURCE   6 EXPRESSION_SYSTEM_COMMON: BACTERIA;                                  
*SOURCE   7 EXPRESSION_SYSTEM_STRAIN: BL21(DE3)PLYSS;                            
*SOURCE   8 EXPRESSION_SYSTEM_VECTOR_TYPE: PET3A;                                
*SOURCE   9 EXPRESSION_SYSTEM_PLASMID: PET3ASNTNC;                               
*SOURCE  10 MOL_ID: 2;                                                           
*SOURCE  11 SYNTHETIC: YES;                                                      
*SOURCE  12 OTHER_DETAILS: THIS SEQUENCE OCCURS NATURALLY IN                     
*SOURCE  13 ORYCTOLAGUS CUNICULUS (RABIT)                                        
*KEYWDS    TROPONIN C- TROPONIN I COMPLEX, BIFUNCTIONAL RHODAMINE                
*KEYWDS   2 LABELED TOPONIN C                                                    
*EXPDTA    NMR, 21 STRUCTURES                                                    
*AUTHOR    P.MERCIER, R.E.FERGUSON, M.IRVING, J.E.T.CORRIE,                      
*AUTHOR   2 D.R.TRENTHAM, B.D.SYKES                                              
*REVDAT   1   29-APR-03 1NPQ    0                                                




restraints_for_deposition.tblS???0Y??0YmBIN???Jassign      (resid 2 and name HB#)        (resid 2 and name HA)            2.750   0.870   0.870 !12147                         
assign      (resid 3 and name HB#)        (resid 2 and name HA)            3.820   1.180   1.180 !12161                         
assign      (resid 3 and name HB#)        (resid 3 and name HG#)           2.785   0.985   0.985 !10388                         
assign      (resid 3 and name HE#)        (resid 3 and name HG#)           3.400   1.600   1.600 !10390                         
assign      (resid 3 and name HN)         (resid 3 and name HE#)           3.450   1.550   1.550 !5342                          
assign      (resid 4 and name HG2#)       (resid 4 and name HA)            2.865   1.065   1.065 !10605 3013                    
assign      (resid 6 and name HG#)        (resid 4 and name HG2#)          3.280   1.400   1.400 !3026                          
assign      (resid 3 and name HB#)        (resid 4 and name HG2#)          3.030   1.220   1.220 !3029                          
assign      (resid 8 and name HB#)        (resid 5 and name HA)            3.400   1.600   1.600 !453 4450                      
assign      (resid 5 and name HB#)        (resid 5 and name HA)            2.830   1.030   1.030 !552 556                       
assign      (resid 5 and name HB2)        (resid 5 and name HB1)           1.965   0.165   0.165 !7488 7490                     
assign      (resid 8 and name HB#)        (resid 5 and name HB#)           3.400   1.600   1.600 !7565 4469                     
assign      (resid 7 and name HN)         (resid 6 and name HB#)           3.370   1.190   1.190 !11758                         
assign      (resid 6 and name HA)         (resid 6 and name HB#)           2.815   0.945   0.945 !11766                         
assign      (resid 6 and name HG#)        (resid 6 and name HB#)           2.725   0.915   0.915 !11778                         
assign      (resid 80 and name HG##)      (resid 6 and name HB#)           3.580   1.420   1.420 !11837 11852 11853 3149        
assign      (resid 80 and name HG##)      (resid 7 and name HA)            2.745   0.945   0.945 !12187 2010                    
assign      (resid 7 and name HG#)        (resid 7 and name HA)            2.815   1.015   1.015 !12293                         
assign      (resid 7 and name HN)         (resid 7 and name HB#)           2.965   1.165   1.165 !481 605                       
assign      (resid 77 and name HG#)       (resid 7 and name HB#)           2.950   1.150   1.150 !489                           
assign      (resid 76 and name HB#)       (resid 7 and name HB#)           2.795   0.995   0.995 !507 622                       
assign      (resid 7 and name HA)         (resid 7 and name HB#)           2.750   0.950   0.950 !610                           
assign      (resid 7 and name HG#)        (resid 7 and name HB#)           2.960   1.160   1.160 !613                           
assign      (resid 76 and name HG#)       (resid 7 and name HB#)           3.055   1.215   1.215 !618                           
assign      (resid 11 and name HB#)       (resid 8 and name HA)            2.845   1.045   1.045 !1519 11088                    
assign      (resid 11 and name HD#)       (resid 8 and name HA)            4.085   0.915   0.915 !1621                          
assign      (resid 7 and name HB#)        (resid 8 and name HA)            3.635   0.775   0.775 !1631                          
assign      (resid 8 and name HB#)        (resid 8 and name HA)            2.645   0.495   0.495 !1654                          
assign      (resid 7 and name HN)         (resid 8 and name HB#)           3.410   1.590   1.590 !4440                          
assign      (resid 9 and name HG#)        (resid 9 and name HA)            2.760   0.890   0.890 !11711 8658 8659               
assign      (resid 12 and name HB#)       (resid 9 and name HB#)           3.400   1.600   1.600 !11521 4258                    
assign      (resid 9 and name HG2)        (resid 9 and name HG1)           2.175   0.375   0.375 !8668                          
assign      (resid 5 and name HB#)        (resid 9 and name HG#)           3.470   1.170   1.170 !8806                          
assign      (resid 13 and name HB#)       (resid 10 and name HA)           2.850   1.050   1.050 !1266 1268 7315 7316           
assign      (resid 9 and name HB#)        (resid 10 and name HA)           3.745   0.885   0.885 !1276                          
assign      (resid 10 and name HB#)       (resid 10 and name HA)           2.755   0.865   0.865 !1298 4234                     
assign      (resid 83 and name HG##)      (resid 10 and name HA)           3.110   1.240   1.240 !1303 1318 1890 3015           
assign      (resid 7 and name HA)         (resid 10 and name HB#)          3.545   1.185   1.185 !4239                          
assign      (resid 79 and name HA)        (resid 10 and name HB#)          3.885   1.115   1.115 !4240                          
assign      (resid 80 and name HB)        (resid 10 and name HB#)          3.775   1.225   1.225 !4252                          
assign      (resid 76 and name HB#)       (resid 10 and name HB#)          3.855   1.145   1.145 !4265                          
assign      (resid 80 and name HG##)      (resid 10 and name HB#)          3.655   1.345   1.345 !4301 3161                     
assign      (resid 8 and name HN)         (resid 10 and name HB#)          3.890   1.110   1.110 !4437                          
assign      (resid 80 and name HA)        (resid 10 and name HB#)          2.935   1.055   1.055 !4462 8289                     
assign      (resid 83 and name HG##)      (resid 10 and name HB#)          3.610   1.390   1.390 !4494 1918                     
assign      (resid 11 and name HD#)       (resid 11 and name HA)           3.200   1.400   1.400 !11395 6497                    
assign      (resid 19 and name HD1#)      (resid 11 and name HA)           3.400   1.600   1.600 !11447 6396                    
assign      (resid 79 and name HD##)      (resid 11 and name HA)           3.400   1.600   1.600 !11456 11458                   
assign      (resid 11 and name HN)        (resid 11 and name HB#)          2.510   0.710   0.710 !11076                         
assign      (resid 12 and name HN)        (resid 11 and name HB#)          2.780   0.980   0.980 !11077                         
assign      (resid 11 and name HD#)       (resid 11 and name HB#)          2.815   1.015   1.015 !11093                         
assign      (resid 19 and name HD1#)      (resid 11 and name HB#)          3.605   1.395   1.395 !11123                         
assign      (resid 79 and name HD##)      (resid 11 and name HB#)          3.615   1.385   1.385 !11129                         
assign      (resid 11 and name HG#)       (resid 11 and name HD#)          3.300   1.500   1.500 !6520 11341 11480              
assign      (resid 19 and name HD1#)      (resid 11 and name HD#)          3.500   1.500   1.500 !6523 6406                     
assign      (resid 79 and name HD##)      (resid 11 and name HD#)          3.445   1.555   1.555 !6524 1101                     
assign      (resid 11 and name HA)        (resid 11 and name HG#)          3.065   1.265   1.265 !11338 11479                   
assign      (resid 19 and name HD1#)      (resid 11 and name HG#)          3.415   1.585   1.585 !11377 11539 6414              
assign      (resid 11 and name HN)        (resid 11 and name HG#)          3.330   1.500   1.500 !11472                         
assign      (resid 79 and name HD##)      (resid 11 and name HG#)          3.400   1.600   1.600 !11547 11548 1125 1139 2291    
assign      (resid 12 and name HB#)       (resid 12 and name HA)           2.640   0.490   0.490 !2142                          
assign      (resid 13 and name HB#)       (resid 13 and name HA)           2.860   1.060   1.060 !11563 11564 7312 7313         
assign      (resid 12 and name HB#)       (resid 13 and name HA)           3.885   1.115   1.115 !11606                         
assign      (resid 12 and name HA)        (resid 13 and name HA)           3.560   1.260   1.260 !11690                         
assign      (resid 13 and name HB2)       (resid 13 and name HB1)          2.155   0.355   0.355 !7322                          
assign      (resid 14 and name HG)        (resid 13 and name HB#)          2.855   1.045   1.045 !7331                          
assign      (resid 83 and name HG##)      (resid 13 and name HB#)          3.535   1.465   1.465 !7338 7340 7344 7346 3020      
assign      (resid 14 and name HD##)      (resid 14 and name HA)           3.400   1.600   1.600 !2150 2251 1794                
assign      (resid 18 and name HG#)       (resid 14 and name HB#)          2.585   0.745   0.745 !5945                          
assign      (resid 14 and name HB1)       (resid 14 and name HB2)          2.075   0.275   0.275 !5955                          
assign      (resid 14 and name HD##)      (resid 14 and name HB#)          2.875   1.075   1.075 !5958 5961 1822 12453 12463    
assign      (resid 18 and name HG#)       (resid 14 and name HD##)         3.400   1.600   1.600 !1801 9781 9782                
assign      (resid 18 and name HB#)       (resid 14 and name HD##)         3.400   1.600   1.600 !1804 9783 9784                
assign      (resid 14 and name HD21)      (resid 14 and name HD11)         2.955   1.155   1.155 !1830 12477                    
assign      (resid 79 and name HD##)      (resid 14 and name HD##)         3.400   1.600   1.600 !1939                          
assign      (resid 11 and name HA)        (resid 14 and name HD##)         3.575   1.415   1.415 !19                            
assign      (resid 79 and name HA)        (resid 14 and name HD##)         3.660   1.340   1.340 !12418                         
assign      (resid 14 and name HG)        (resid 14 and name HD##)         2.875   1.075   1.075 !12445 928 933                 
assign      (resid 14 and name HB#)       (resid 14 and name HG)           2.830   1.030   1.030 !907 919                       
assign      (resid 18 and name HG#)       (resid 14 and name HG)           3.425   1.575   1.575 !955 9758                      
assign      (resid 15 and name HB#)       (resid 15 and name HA)           2.750   0.870   0.870 !12702                         
assign      (resid 15 and name HB2)       (resid 15 and name HB1)          2.165   0.365   0.365 !8895 8896                     
assign      (resid 17 and name HB#)       (resid 15 and name HB#)          2.335   0.535   0.535 !8927                          
assign      (resid 16 and name HG#)       (resid 16 and name HA)           2.775   0.925   0.925 !11033 11037 8660              
assign      (resid 19 and name HG2#)      (resid 16 and name HA)           3.575   1.385   1.385 !11066 4766                    
assign      (resid 19 and name HG1#)      (resid 16 and name HA)           3.400   1.180   1.180 !11068                         
assign      (resid 19 and name HD1#)      (resid 16 and name HA)           3.160   1.360   1.360 !11070 6395                    
assign      (resid 19 and name HD1#)      (resid 16 and name HG#)          3.565   1.435   1.435 !8628 8688 6324 6409           
assign      (resid 17 and name HG#)       (resid 17 and name HA)           2.860   0.960   0.960 !11167                         
assign      (resid 17 and name HB#)       (resid 17 and name HA)           2.695   0.895   0.895 !11175                         
assign      (resid 17 and name HG#)       (resid 17 and name HB#)          2.760   0.890   0.890 !11950 8519 8622               
assign      (resid 17 and name HN)        (resid 17 and name HG#)          3.685   1.315   1.315 !8497 8594                     
assign      (resid 14 and name HB#)       (resid 18 and name HB#)          3.360   1.420   1.420 !9664                          
assign      (resid 18 and name HA)        (resid 18 and name HB#)          3.200   1.340   1.340 !9739                          
assign      (resid 18 and name HG#)       (resid 18 and name HB#)          2.835   1.035   1.035 !9744 9745 9749 9754 9765 9909 
assign      (resid 18 and name HB2)       (resid 18 and name HB1)          2.655   0.855   0.855 !9756                          
assign      (resid 18 and name HA)        (resid 18 and name HG#)          3.130   1.330   1.330 !9738 9899                     
assign      (resid 15 and name HN)        (resid 18 and name HG#)          3.525   1.475   1.475 !9889                          
assign      (resid 18 and name HG#)       (resid 18 and name HE#)          2.790   0.990   0.990 !4786                          
assign      (resid 82 and name HE#)       (resid 18 and name HE#)          3.535   1.465   1.465 !4809 3977                     
assign      (resid 14 and name HD##)      (resid 18 and name HE#)          3.090   1.150   1.150 !4822                          
assign      (resid 22 and name HB#)       (resid 19 and name HA)           3.400   1.600   1.600 !8366 8143                     
assign      (resid 19 and name HG2#)      (resid 19 and name HA)           2.940   1.080   1.080 !8401 4771                     
assign      (resid 79 and name HD##)      (resid 19 and name HA)           3.695   1.305   1.305 !8409 8582                     
assign      (resid 16 and name HA)        (resid 19 and name HB)           2.610   0.810   0.810 !8201                          
assign      (resid 19 and name HA)        (resid 19 and name HB)           2.900   1.060   1.060 !8202                          
assign      (resid 19 and name HG2#)      (resid 19 and name HB)           2.760   0.960   0.960 !8246 4794                     
assign      (resid 19 and name HG1#)      (resid 19 and name HB)           2.725   0.925   0.925 !8249                          
assign      (resid 19 and name HD1#)      (resid 19 and name HB)           2.965   1.085   1.085 !8251                          
assign      (resid 19 and name HA)        (resid 19 and name HD1#)         3.410   1.590   1.590 !6397                          
assign      (resid 19 and name HG2#)      (resid 19 and name HD1#)         3.250   1.450   1.450 !6420                          
assign      (resid 19 and name HG1#)      (resid 19 and name HD1#)         2.755   0.955   0.955 !6423 10791                    
assign      (resid 79 and name HD##)      (resid 19 and name HD1#)         3.510   1.490   1.490 !6430                          
assign      (resid 11 and name HG#)       (resid 19 and name HG1#)         3.060   1.110   1.110 !10523                         
assign      (resid 79 and name HD##)      (resid 19 and name HG1#)         3.615   1.385   1.385 !10555 10802                   
assign      (resid 19 and name HA)        (resid 19 and name HG1#)         2.795   0.995   0.995 !10738 10739                   
assign      (resid 19 and name HG2#)      (resid 19 and name HG1#)         3.200   1.180   1.180 !10783                         
assign      (resid 19 and name HG11)      (resid 19 and name HG12)         2.380   0.580   0.580 !10788                         
assign      (resid 23 and name HN)        (resid 19 and name HG2#)         3.700   1.300   1.300 !4747                          
assign      (resid 19 and name HN)        (resid 19 and name HG2#)         3.480   1.340   1.340 !4748                          
assign      (resid 20 and name HA)        (resid 19 and name HG2#)         3.400   1.600   1.600 !4762 1418                     
assign      (resid 22 and name HB#)       (resid 19 and name HG2#)         3.815   1.185   1.185 !4775                          
assign      (resid 11 and name HD#)       (resid 19 and name HG2#)         3.860   1.140   1.140 !4779                          
assign      (resid 23 and name HB#)       (resid 19 and name HG2#)         3.570   1.430   1.430 !4806 10782                    
assign      (resid 20 and name HB#)       (resid 19 and name HG2#)         3.745   1.255   1.255 !4807                          
assign      (resid 23 and name HB#)       (resid 20 and name HA)           2.825   1.025   1.025 !1389 10732                    
assign      (resid 19 and name HN)        (resid 20 and name HB#)          3.400   1.600   1.600 !4549                          
assign      (resid 20 and name HN)        (resid 20 and name HB#)          2.765   0.965   0.965 !4550                          
assign      (resid 21 and name HG#)       (resid 20 and name HB#)          3.400   1.600   1.600 !4569 4578                     
assign      (resid 21 and name HG#)       (resid 21 and name HA)           3.050   1.250   1.250 !11296 11301                   
assign      (resid 21 and name HB#)       (resid 21 and name HA)           2.735   0.935   0.935 !11304 11306                   
assign      (resid 79 and name HD##)      (resid 22 and name HB#)          3.420   1.580   1.580 !8098 2274 1098                
assign      (resid 23 and name HB#)       (resid 23 and name HA)           2.875   1.075   1.075 !12172 10625 10736             
assign      (resid 23 and name HD#)       (resid 23 and name HA)           2.900   1.100   1.100 !12194 695 807                 
assign      (resid 23 and name HB2)       (resid 23 and name HB1)          2.330   0.530   0.530 !10637 10645                   
assign      (resid 23 and name HD#)       (resid 23 and name HB#)          3.025   1.225   1.225 !10652 10803 726 727 733 735   
assign      (resid 23 and name HG#)       (resid 23 and name HB#)          2.750   0.950   0.950 !10656                         
assign      (resid 26 and name HB#)       (resid 23 and name HD#)          2.995   1.195   1.195 !698                           
assign      (resid 23 and name HD2)       (resid 23 and name HD1)          2.305   0.505   0.505 !826 834                       
assign      (resid 23 and name HG#)       (resid 23 and name HD#)          2.835   1.035   1.035 !828 829                       
assign      (resid 23 and name HN)        (resid 23 and name HG#)          3.400   1.600   1.600 !1882                          
assign      (resid 23 and name HD#)       (resid 23 and name HE#)          2.795   0.995   0.995 !6835 6858 6946 6968           
assign      (resid 23 and name HG#)       (resid 23 and name HE#)          3.000   1.160   1.160 !6840 6841                     
assign      (resid 25 and name HA)        (resid 24 and name HA)           3.330   1.530   1.530 !1372                          
assign      (resid 23 and name HN)        (resid 24 and name HB#)          3.400   1.600   1.600 !4543                          
assign      (resid 26 and name HN)        (resid 24 and name HB#)          3.455   1.545   1.545 !4545                          
assign      (resid 25 and name HA)        (resid 24 and name HB#)          3.400   1.600   1.600 !4559                          
assign      (resid 21 and name HB#)       (resid 24 and name HB#)          3.255   1.455   1.455 !4585                          
assign      (resid 28 and name HB#)       (resid 25 and name HA)           2.955   0.685   0.685 !1510 1513                     
assign      (resid 25 and name HB#)       (resid 25 and name HA)           2.760   0.880   0.880 !1522 4235                     
assign      (resid 26 and name HA)        (resid 25 and name HB#)          3.780   1.220   1.220 !4241                          
assign      (resid 23 and name HA)        (resid 26 and name HA)           3.360   1.560   1.560 !10020                         
assign      (resid 29 and name HB#)       (resid 26 and name HA)           3.400   1.600   1.600 !10024                         
assign      (resid 37 and name HD1#)      (resid 26 and name HA)           3.400   1.600   1.600 !10052 6090                    
assign      (resid 26 and name HN)        (resid 26 and name HB#)          3.330   1.530   1.530 !7594                          
assign      (resid 27 and name HN)        (resid 26 and name HB#)          3.400   1.600   1.600 !7596                          
assign      (resid 23 and name HA)        (resid 26 and name HB#)          3.400   1.600   1.600 !7610                          
assign      (resid 26 and name HA)        (resid 27 and name HA)           3.400   1.600   1.600 !657                           
assign      (resid 30 and name HB#)       (resid 27 and name HA)           3.105   1.305   1.305 !659 675 7852 7914             
assign      (resid 28 and name HG#)       (resid 28 and name HA)           2.770   0.920   0.920 !136 10280 10281               
assign      (resid 28 and name HN)        (resid 28 and name HB#)          3.050   1.180   1.180 !10155                         
assign      (resid 28 and name HA)        (resid 28 and name HB#)          3.045   1.175   1.175 !10163                         
assign      (resid 28 and name HG#)       (resid 28 and name HB#)          2.845   1.045   1.045 !10175 10289 10290             
assign      (resid 28 and name HG2)       (resid 28 and name HG1)          2.240   0.440   0.440 !10288                         
assign      (resid 29 and name HB#)       (resid 29 and name HA)           2.770   0.920   0.920 !11888                         
assign      (resid 45 and name HG##)      (resid 29 and name HA)           3.400   1.300   1.300 !12049 2570                    
assign      (resid 29 and name HB1)       (resid 29 and name HB2)          1.950   0.150   0.150 !7681                          
assign      (resid 37 and name HD1#)      (resid 29 and name HB#)          2.795   0.995   0.995 !7697 7698 6093 6098           
assign      (resid 30 and name HB#)       (resid 30 and name HA)           2.750   0.870   0.870 !2704                          
assign      (resid 30 and name HB2)       (resid 30 and name HB1)          1.945   0.145   0.145 !7865                          
assign      (resid 31 and name HB#)       (resid 31 and name HA)           2.645   0.485   0.485 !1650                          
assign      (resid 33 and name HN)        (resid 31 and name HB#)          3.445   1.555   1.555 !3649                          
assign      (resid 32 and name HB#)       (resid 32 and name HA)           2.745   0.845   0.845 !12704                         
assign      (resid 31 and name HB#)       (resid 32 and name HA)           4.075   0.925   0.925 !12705                         
assign      (resid 32 and name HB2)       (resid 32 and name HB1)          1.940   0.140   0.140 !7618                          
assign      (resid 34 and name HA1)       (resid 34 and name HA2)          1.945   0.145   0.145 !5568                          
assign      (resid 35 and name HA2)       (resid 35 and name HA1)          2.275   0.475   0.475 !6002 6012                     
assign      (resid 74 and name HA)        (resid 36 and name HA)           3.090   1.110   1.110 !12606 12598                   
assign      (resid 36 and name HB#)       (resid 36 and name HA)           2.795   0.995   0.995 !12614 12615 7225 7226         
assign      (resid 74 and name HA)        (resid 36 and name HB#)          3.170   1.250   1.250 !7224 12593 12595              
assign      (resid 72 and name HB)        (resid 36 and name HB#)          2.760   0.960   0.960 !7227 7228 6312 6332           
assign      (resid 36 and name HB2)       (resid 36 and name HB1)          2.325   0.525   0.525 !7231 7241                     
assign      (resid 73 and name HB)        (resid 36 and name HB#)          2.955   1.045   1.045 !7248 7369                     
assign      (resid 72 and name HG2#)      (resid 36 and name HB#)          3.600   1.400   1.400 !7257 2736 2738                
assign      (resid 41 and name HB#)       (resid 37 and name HA)           3.085   1.215   1.215 !12688                         
assign      (resid 37 and name HB)        (resid 37 and name HA)           2.900   1.100   1.100 !12689                         
assign      (resid 37 and name HG1#)      (resid 37 and name HA)           2.770   0.970   0.970 !12690                         
assign      (resid 37 and name HG2#)      (resid 37 and name HA)           3.400   1.600   1.600 !12691 4553                    
assign      (resid 37 and name HD1#)      (resid 37 and name HB)           2.805   1.005   1.005 !7638 6113                     
assign      (resid 73 and name HB)        (resid 37 and name HB)           2.235   0.435   0.435 !7689 7399                     
assign      (resid 73 and name HG2#)      (resid 37 and name HB)           2.955   1.155   1.155 !7692 4481                     
assign      (resid 37 and name HG2#)      (resid 37 and name HB)           2.725   0.925   0.925 !7693 4588                     
assign      (resid 37 and name HN)        (resid 37 and name HD1#)         3.280   1.300   1.300 !6083                          
assign      (resid 41 and name HB#)       (resid 37 and name HD1#)         3.610   1.390   1.390 !6103                          
assign      (resid 73 and name HB)        (resid 37 and name HD1#)         3.070   1.160   1.160 !6111                          
assign      (resid 37 and name HG2#)      (resid 37 and name HD1#)         2.820   1.020   1.020 !6121                          
assign      (resid 73 and name HD1#)      (resid 37 and name HD1#)         3.575   1.425   1.425 !6122 6358                     
assign      (resid 30 and name HN)        (resid 37 and name HD1#)         3.405   1.385   1.385 !6152                          
assign      (resid 37 and name HB)        (resid 37 and name HG1#)         2.775   0.975   0.975 !623                           
assign      (resid 37 and name HG12)      (resid 37 and name HG11)         2.515   0.715   0.715 !645                           
assign      (resid 37 and name HG2#)      (resid 37 and name HG1#)         3.145   1.345   1.345 !749 4817                      
assign      (resid 37 and name HN)        (resid 37 and name HG2#)         3.330   1.530   1.530 !4542                          
assign      (resid 73 and name HN)        (resid 37 and name HG2#)         3.400   1.600   1.600 !4544                          
assign      (resid 41 and name HN)        (resid 37 and name HG2#)         3.400   1.600   1.600 !4551                          
assign      (resid 42 and name HA)        (resid 37 and name HG2#)         3.190   1.390   1.390 !4558 345                      
assign      (resid 29 and name HB#)       (resid 37 and name HG2#)         3.400   1.600   1.600 !4561 4567                     
assign      (resid 41 and name HB#)       (resid 37 and name HG2#)         2.965   1.165   1.165 !4570                          
assign      (resid 73 and name HB)        (resid 37 and name HG2#)         2.940   1.140   1.140 !4586 7405                     
assign      (resid 42 and name HG)        (resid 37 and name HG2#)         3.275   1.475   1.475 !4595                          
assign      (resid 38 and name HB2)       (resid 38 and name HB1)          2.260   0.460   0.460 !8533 8534                     
assign      (resid 72 and name HG2#)      (resid 38 and name HB#)          3.400   1.600   1.600 !8575 8576 2732                
assign      (resid 39 and name HB)        (resid 39 and name HA)           2.780   0.950   0.950 !8165 8021                     
assign      (resid 39 and name HG2#)      (resid 39 and name HA)           2.815   0.965   0.965 !8290 2359                     
assign      (resid 62 and name HD1#)      (resid 39 and name HA)           2.910   1.110   1.110 !8296 6646                     
assign      (resid 39 and name HG2#)      (resid 39 and name HB)           2.750   0.920   0.920 !7974 2353                     
assign      (resid 58 and name HD##)      (resid 39 and name HB)           3.515   1.385   1.385 !7977 1220                     
assign      (resid 62 and name HD1#)      (resid 39 and name HB)           3.705   1.295   1.295 !7979                          
assign      (resid 59 and name HA)        (resid 39 and name HG2#)         3.615   1.385   1.385 !2351 588                      
assign      (resid 55 and name HE#)       (resid 39 and name HG2#)         3.750   1.250   1.250 !2364                          
assign      (resid 58 and name HB#)       (resid 39 and name HG2#)         3.210   1.130   1.130 !2373                          
assign      (resid 62 and name HB)        (resid 39 and name HG2#)         3.360   1.210   1.210 !2376                          
assign      (resid 62 and name HG1#)      (resid 39 and name HG2#)         3.650   1.350   1.350 !2382                          
assign      (resid 62 and name HD1#)      (resid 39 and name HG2#)         3.175   1.115   1.115 !2424                          
assign      (resid 62 and name HG2#)      (resid 39 and name HG2#)         3.575   1.425   1.425 !2426 5648                     
assign      (resid 40 and name HB#)       (resid 40 and name HA)           2.855   1.055   1.055 !11421 11582 9976 9977         
assign      (resid 40 and name HD#)       (resid 40 and name HA)           3.400   1.600   1.600 !11591 11625                   
assign      (resid 40 and name HG#)       (resid 40 and name HA)           3.055   1.255   1.255 !11609                         
assign      (resid 40 and name HB2)       (resid 40 and name HB1)          2.325   0.525   0.525 !9991                          
assign      (resid 40 and name HG#)       (resid 40 and name HB#)          3.015   1.215   1.215 !9997 10000 1564 1685          
assign      (resid 40 and name HE#)       (resid 40 and name HD#)          3.165   1.365   1.365 !11629                         
assign      (resid 40 and name HG#)       (resid 40 and name HD#)          2.965   1.165   1.165 !11660 11662 1689              
assign      (resid 40 and name HE#)       (resid 40 and name HG#)          3.370   1.570   1.570 !1552 1678 6945                
assign      (resid 40 and name HG2)       (resid 40 and name HG1)          2.255   0.455   0.455 !1693 1696                     
assign      (resid 40 and name HB#)       (resid 40 and name HE#)          3.350   1.550   1.550 !6932                          
assign      (resid 44 and name HG2#)      (resid 41 and name HA)           3.400   1.600   1.600 !11922                         
assign      (resid 37 and name HG2#)      (resid 41 and name HA)           3.400   1.600   1.600 !11927                         
assign      (resid 41 and name HN)        (resid 41 and name HG#)          2.980   1.150   1.150 !8193                          
assign      (resid 41 and name HA)        (resid 41 and name HG#)          2.830   1.030   1.030 !8198                          
assign      (resid 42 and name HG)        (resid 42 and name HA)           2.765   0.915   0.915 !335                           
assign      (resid 45 and name HG##)      (resid 42 and name HA)           3.580   1.420   1.420 !349 2572                      
assign      (resid 42 and name HA)        (resid 42 and name HB#)          2.795   0.995   0.995 !6783 6784                     
assign      (resid 39 and name HA)        (resid 42 and name HB#)          2.875   1.005   1.005 !6789                          
assign      (resid 42 and name HB1)       (resid 42 and name HB2)          2.345   0.545   0.545 !6832                          
assign      (resid 58 and name HB#)       (resid 42 and name HB#)          3.005   1.075   1.075 !6950                          
assign      (resid 42 and name HN)        (resid 42 and name HD##)         3.630   1.370   1.370 !2346 891                      
assign      (resid 46 and name HG#)       (resid 42 and name HD##)         3.610   1.390   1.390 !2367 2480                     
assign      (resid 42 and name HG)        (resid 42 and name HD##)         2.730   0.930   0.930 !2385                          
assign      (resid 42 and name HB#)       (resid 42 and name HD##)         2.885   1.045   1.045 !2498 922                      
assign      (resid 42 and name HB#)       (resid 42 and name HG)           2.790   0.990   0.990 !823 909                       
assign      (resid 43 and name HA1)       (resid 43 and name HA2)          1.940   0.140   0.140 !4332                          
assign      (resid 46 and name HB#)       (resid 43 and name HA#)          2.900   1.060   1.060 !4346 4347 10379               
assign      (resid 58 and name HD##)      (resid 43 and name HA#)          3.155   1.165   1.165 !4419 4424 4425 1226 2171      
assign      (resid 44 and name HB)        (resid 44 and name HA)           2.815   0.985   0.985 !8358 7750                     
assign      (resid 47 and name HD#)       (resid 44 and name HA)           3.005   1.095   1.095 !8367 8369                     
assign      (resid 44 and name HG2#)      (resid 44 and name HA)           2.715   0.915   0.915 !8400 2908                     
assign      (resid 41 and name HA)        (resid 44 and name HB)           2.950   0.960   0.960 !7749                          
assign      (resid 44 and name HG2#)      (resid 44 and name HB)           2.945   1.145   1.145 !7781 2903                     
assign      (resid 45 and name HG##)      (resid 44 and name HB)           3.760   1.240   1.240 !7786                          
assign      (resid 29 and name HA)        (resid 44 and name HB)           3.295   1.115   1.115 !7819                          
assign      (resid 44 and name HN)        (resid 44 and name HG2#)         3.535   1.415   1.415 !2899                          
assign      (resid 45 and name HN)        (resid 44 and name HG2#)         3.620   1.380   1.380 !2902                          
assign      (resid 45 and name HA)        (resid 44 and name HG2#)         3.640   1.360   1.360 !2911 8571                     
assign      (resid 48 and name HG#)       (resid 44 and name HG2#)         3.580   1.420   1.420 !2913 10205                    
assign      (resid 48 and name HE#)       (resid 44 and name HG2#)         3.410   1.590   1.590 !2922 5272                     
assign      (resid 45 and name HG##)      (resid 44 and name HG2#)         3.690   1.310   1.310 !2948 2949 2594                
assign      (resid 48 and name HB#)       (resid 45 and name HA)           3.400   1.600   1.600 !8556 8559 10166               
assign      (resid 45 and name HB)        (resid 45 and name HA)           2.765   0.905   0.905 !8566 10499                    
assign      (resid 45 and name HG##)      (resid 45 and name HA)           3.085   1.255   1.255 !8581 8584 2576 3303           
!assign      (resid 49 and name HD##)      (resid 45 and name HB)           3.680   1.320   1.320 !10413                         
assign      (resid 44 and name HG2#)      (resid 45 and name HB)           3.685   1.315   1.315 !10538                         
assign      (resid 45 and name HG##)      (resid 45 and name HB)           2.785   0.985   0.985 !10559 10663 3315 2587         
assign      (resid 46 and name HA)        (resid 45 and name HG##)         3.600   1.400   1.400 !3299 11462                    
assign      (resid 48 and name HE#)       (resid 45 and name HG##)         3.465   1.535   1.535 !3312 2582 5274 5275           
assign      (resid 49 and name HD##)      (resid 45 and name HG##)         3.400   1.600   1.600 !3326 1046 2429                
assign      (resid 45 and name HG21)      (resid 45 and name HG11)         3.170   1.300   1.300 !3327 2608                     
assign      (resid 42 and name HD##)      (resid 45 and name HG##)         3.705   1.295   1.295 !2595                          
assign      (resid 46 and name HG#)       (resid 46 and name HA)           2.925   1.125   1.125 !11403 11405 9560 9633         
assign      (resid 51 and name HB#)       (resid 46 and name HA)           3.180   1.150   1.150 !11428                         
assign      (resid 49 and name HD##)      (resid 46 and name HA)           3.400   1.600   1.600 !11453 1010                    
assign      (resid 46 and name HB#)       (resid 46 and name HA)           2.800   1.000   1.000 !11571 10376                   
assign      (resid 46 and name HG#)       (resid 46 and name HB#)          2.810   1.010   1.010 !10380 10504 9572 9575         
assign      (resid 46 and name HB2)       (resid 46 and name HB1)          2.390   0.590   0.590 !10391                         
assign      (resid 58 and name HD##)      (resid 46 and name HB#)          3.330   1.320   1.320 !10550                         
assign      (resid 45 and name HG##)      (resid 46 and name HB#)          3.530   1.470   1.470 !10552 10558                   
assign      (resid 46 and name HG2)       (resid 46 and name HG1)          2.310   0.510   0.510 !9563 9564                     
assign      (resid 53 and name HG#)       (resid 46 and name HG#)          3.505   1.495   1.495 !9573 490                      
assign      (resid 46 and name HE#)       (resid 46 and name HG#)          3.150   1.320   1.320 !9574 4938                     
assign      (resid 58 and name HD##)      (resid 46 and name HG#)          3.540   1.460   1.460 !9585 9586 2174 2177 1110      
assign      (resid 53 and name HD#)       (resid 46 and name HE#)          3.495   1.455   1.455 !4918 4924                     
assign      (resid 47 and name HN)        (resid 47 and name HB#)          2.700   0.900   0.900 !11204 11205                   
assign      (resid 44 and name HA)        (resid 47 and name HB#)          2.815   1.015   1.015 !11217                         
assign      (resid 47 and name HD#)       (resid 47 and name HB#)          2.875   1.075   1.075 !11220 11224 11340             
assign      (resid 47 and name HN)        (resid 47 and name HD#)          3.780   1.220   1.220 !6433                          
assign      (resid 47 and name HD2)       (resid 47 and name HD1)          2.215   0.415   0.415 !6438 6443                     
assign      (resid 47 and name HG#)       (resid 47 and name HD#)          2.800   1.000   1.000 !6448 6450 12061 12062 12064 12065
assign      (resid 47 and name HN)        (resid 47 and name HG#)          3.135   1.165   1.165 !12054 12055                   
assign      (resid 52 and name HA)        (resid 47 and name HG#)          3.440   1.230   1.230 !12056                         
assign      (resid 48 and name HB#)       (resid 48 and name HA)           3.130   1.330   1.330 !12028 10161                   
assign      (resid 48 and name HG#)       (resid 48 and name HB#)          2.765   0.965   0.965 !10169 10171 10172 10177 10182 
assign      (resid 48 and name HB2)       (resid 48 and name HB1)          2.550   0.750   0.750 !10179                         
assign      (resid 48 and name HE#)       (resid 48 and name HB#)          3.400   1.600   1.600 !10189                         
assign      (resid 49 and name HG)        (resid 48 and name HB#)          3.400   1.600   1.600 !10305                         
assign      (resid 49 and name HN)        (resid 48 and name HG#)          3.545   1.455   1.455 !10153                         
assign      (resid 48 and name HA)        (resid 48 and name HG#)          3.175   1.355   1.355 !10159 10160                   
assign      (resid 45 and name HA)        (resid 48 and name HE#)          2.930   1.120   1.120 !4922                          
assign      (resid 48 and name HG#)       (resid 48 and name HE#)          2.830   1.030   1.030 !4928                          
assign      (resid 48 and name HE#)       (resid 49 and name HA)           4.030   0.970   0.970 !1734                          
assign      (resid 49 and name HD##)      (resid 49 and name HA)           2.775   0.935   0.935 !1772 2467                     
assign      (resid 45 and name HG##)      (resid 49 and name HB#)          3.455   1.545   1.545 !6965                          
assign      (resid 46 and name HA)        (resid 49 and name HB#)          3.400   1.600   1.600 !7014                          
assign      (resid 49 and name HN)        (resid 49 and name HB#)          3.390   1.590   1.590 !7082 7083                     
assign      (resid 49 and name HN)        (resid 49 and name HD##)         3.400   1.600   1.600 !2464 1006                     
assign      (resid 45 and name HG##)      (resid 49 and name HG)           3.410   1.590   1.590 !941                           
assign      (resid 51 and name HN)        (resid 50 and name HA#)          2.775   0.695   0.695 !5800 5890                     
assign      (resid 50 and name HA2)       (resid 50 and name HA1)          1.990   0.190   0.190 !5812 5820                     
assign      (resid 51 and name HB#)       (resid 51 and name HA)           2.755   0.875   0.875 !2140                          
assign      (resid 53 and name HD#)       (resid 51 and name HB#)          3.120   1.130   1.130 !10857 10950 3584 3586         
assign      (resid 51 and name HB1)       (resid 51 and name HB2)          1.945   0.145   0.145 !10885                         
assign      (resid 46 and name HB#)       (resid 51 and name HB#)          2.240   0.420   0.420 !10985                         
assign      (resid 53 and name HD#)       (resid 51 and name HG#)          3.820   1.180   1.180 !9505                          
assign      (resid 51 and name HB#)       (resid 51 and name HG#)          2.750   0.860   0.860 !9521                          
assign      (resid 46 and name HB#)       (resid 52 and name HA)           3.570   1.220   1.220 !12636                         
assign      (resid 53 and name HD#)       (resid 52 and name HA)           2.785   0.985   0.985 !12641 12642 3544 3545         
assign      (resid 52 and name HB#)       (resid 52 and name HA)           2.785   0.965   0.965 !12644 12646 7793 7794         
assign      (resid 53 and name HD#)       (resid 52 and name HB#)          3.460   1.300   1.300 !7798 7799 3556 3558           
assign      (resid 52 and name HB2)       (resid 52 and name HB1)          2.160   0.360   0.360 !7805 7808                     
assign      (resid 53 and name HD#)       (resid 53 and name HB#)          2.895   1.095   1.095 !10063 10167                   
assign      (resid 58 and name HG)        (resid 53 and name HB#)          2.690   0.890   0.890 !10075                         
assign      (resid 58 and name HD##)      (resid 53 and name HB#)          3.400   1.600   1.600 !10092 10093 10094 10095 2180  
assign      (resid 57 and name HB#)       (resid 53 and name HB#)          2.715   0.915   0.915 !10180                         
assign      (resid 43 and name HA#)       (resid 53 and name HD#)          3.320   1.350   1.350 !3463 3549                     
assign      (resid 53 and name HD2)       (resid 53 and name HD1)          2.355   0.555   0.555 !3551 3553                     
assign      (resid 53 and name HG#)       (resid 53 and name HD#)          2.750   0.940   0.940 !3572 366 370                  
assign      (resid 58 and name HD##)      (resid 53 and name HD#)          3.615   1.385   1.385 !3608 3609 1225 2170           
assign      (resid 43 and name HA#)       (resid 53 and name HG#)          3.630   1.370   1.370 !368                           
assign      (resid 51 and name HB#)       (resid 53 and name HG#)          3.385   1.225   1.225 !400                           
assign      (resid 58 and name HD##)      (resid 53 and name HG#)          3.270   1.160   1.160 !417                           
assign      (resid 54 and name HG2#)      (resid 54 and name HA)           2.970   1.170   1.170 !11065 2791                    
assign      (resid 55 and name HB#)       (resid 55 and name HA)           2.810   1.010   1.010 !10918 10922 10164 10283       
assign      (resid 55 and name HD#)       (resid 55 and name HA)           3.285   1.485   1.485 !10924 10926                   
assign      (resid 55 and name HG#)       (resid 55 and name HA)           3.065   1.265   1.265 !10931 1549                    
assign      (resid 58 and name HD##)      (resid 55 and name HA)           3.150   1.350   1.350 !10937 1223                    
assign      (resid 55 and name HB2)       (resid 55 and name HB1)          2.305   0.505   0.505 !10194                         
assign      (resid 55 and name HD#)       (resid 55 and name HB#)          3.145   1.345   1.345 !10199 10311 11958             
assign      (resid 55 and name HG#)       (resid 55 and name HB#)          2.890   1.090   1.090 !10317 1562 1565               
assign      (resid 55 and name HE#)       (resid 55 and name HD#)          3.015   1.215   1.215 !11947 12067                   
assign      (resid 55 and name HG#)       (resid 55 and name HD#)          2.830   1.030   1.030 !12093 12095 1571              
assign      (resid 55 and name HE#)       (resid 55 and name HG#)          3.285   1.485   1.485 !1551 6719                     
assign      (resid 55 and name HA)        (resid 55 and name HE#)          3.165   1.365   1.365 !6728                          
assign      (resid 57 and name HN)        (resid 56 and name HB#)          2.855   1.045   1.045 !9222                          
assign      (resid 56 and name HA)        (resid 56 and name HB#)          2.830   1.030   1.030 !9226 9295                     
assign      (resid 56 and name HB1)       (resid 56 and name HB2)          2.210   0.410   0.410 !9236                          
assign      (resid 57 and name HB#)       (resid 57 and name HA)           2.785   0.975   0.975 !11410                         
assign      (resid 60 and name HB#)       (resid 57 and name HA)           2.955   1.055   1.055 !11439                                    
assign      (resid 57 and name HB2)       (resid 57 and name HB1)          2.005   0.205   0.205 !11350 11362                   
assign      (resid 58 and name HG)        (resid 57 and name HB#)          2.445   0.565   0.565 !11511                         
assign      (resid 57 and name HA)        (resid 57 and name HG#)          3.110   1.310   1.310 !8306                          
assign      (resid 57 and name HB#)       (resid 57 and name HG#)          2.785   0.985   0.985 !8327                          
assign      (resid 58 and name HN)        (resid 58 and name HB#)          2.970   1.170   1.170 !6781 6782                     
assign      (resid 58 and name HA)        (resid 58 and name HB#)          2.730   0.930   0.930 !6785                          
assign      (resid 58 and name HB2)       (resid 58 and name HB1)          2.460   0.660   0.660 !6818                          
assign      (resid 58 and name HD##)      (resid 58 and name HB#)          3.400   1.600   1.600 !6848 6854 6963 1249 2195      
assign      (resid 58 and name HG)        (resid 58 and name HB#)          2.860   1.060   1.060 !6938 741                      
assign      (resid 62 and name HG1#)      (resid 58 and name HB#)          2.990   1.190   1.190 !6955                          
assign      (resid 58 and name HN)        (resid 58 and name HD##)         3.605   1.395   1.395 !2164 1085                     
assign      (resid 58 and name HG)        (resid 58 and name HD##)         2.830   1.030   1.030 !2186 1239 830                 
assign      (resid 42 and name HG)        (resid 58 and name HD##)         2.930   1.040   1.040 !2191                          
assign      (resid 42 and name HB#)       (resid 58 and name HD##)         3.525   1.345   1.345 !2192                          
assign      (resid 58 and name HA)        (resid 58 and name HD##)         2.735   0.935   0.935 !2271                          
assign      (resid 58 and name HA)        (resid 58 and name HG)           2.885   1.085   1.085 !806                           
assign      (resid 62 and name HG2#)      (resid 59 and name HA)           3.735   1.265   1.265 !468                           
assign      (resid 60 and name HA)        (resid 59 and name HA)           3.375   1.265   1.265 !547                           
assign      (resid 63 and name HB#)       (resid 59 and name HA)           3.435   1.295   1.295 !551                           
assign      (resid 59 and name HB#)       (resid 59 and name HA)           2.880   1.080   1.080 !558 560 7536                  
assign      (resid 58 and name HB#)       (resid 59 and name HA)           3.315   1.235   1.235 !570                           
assign      (resid 62 and name HB)        (resid 59 and name HA)           2.880   1.030   1.030 !574                           
assign      (resid 62 and name HG1#)      (resid 59 and name HA)           3.365   1.255   1.255 !595                           
assign      (resid 59 and name HB1)       (resid 59 and name HB2)          2.340   0.540   0.540 !7550 7552                     
assign      (resid 63 and name HB#)       (resid 60 and name HA)           2.910   0.660   0.660 !1502                          
assign      (resid 60 and name HB#)       (resid 60 and name HA)           2.660   0.570   0.570 !1530                          
assign      (resid 61 and name HN)        (resid 60 and name HB#)          3.400   1.600   1.600 !4441                          
assign      (resid 64 and name HB#)       (resid 61 and name HA)           3.505   1.185   1.185 !9006                          
assign      (resid 61 and name HG1#)      (resid 61 and name HA)           2.830   1.030   1.030 !9019 11769 11945              
assign      (resid 65 and name HG##)      (resid 61 and name HA)           3.790   1.210   1.210 !9020                          
assign      (resid 58 and name HA)        (resid 61 and name HB)           2.745   0.935   0.935 !8069                          
assign      (resid 61 and name HA)        (resid 61 and name HB)           2.775   0.945   0.945 !8071                          
assign      (resid 61 and name HN)        (resid 61 and name HD1#)         2.840   1.040   1.040 !6303                          
assign      (resid 58 and name HA)        (resid 61 and name HD1#)         2.700   0.900   0.900 !6306                          
assign      (resid 61 and name HA)        (resid 61 and name HD1#)         2.845   1.045   1.045 !6308                          
assign      (resid 60 and name HB#)       (resid 61 and name HD1#)         3.605   1.395   1.395 !6422                          
assign      (resid 61 and name HN)        (resid 61 and name HG1#)         2.945   1.145   1.145 !11763 11940                   
assign      (resid 61 and name HG11)      (resid 61 and name HG12)         2.440   0.640   0.640 !11843                         
assign      (resid 62 and name HA)        (resid 61 and name HG2#)         3.585   1.415   1.415 !4778                          
assign      (resid 61 and name HN)        (resid 61 and name HG2#)         3.140   1.230   1.230 !4893                          
assign      (resid 62 and name HN)        (resid 61 and name HG2#)         3.220   1.280   1.280 !4895                          
assign      (resid 58 and name HA)        (resid 61 and name HG2#)         3.600   1.400   1.400 !4915                          
assign      (resid 61 and name HA)        (resid 61 and name HG2#)         2.730   0.930   0.930 !4919                          
assign      (resid 81 and name HE#)       (resid 61 and name HG2#)         3.440   1.410   1.410 !5003                          
assign      (resid 62 and name HG1#)      (resid 61 and name HG2#)         3.560   1.440   1.440 !5018                          
assign      (resid 61 and name HG1#)      (resid 61 and name HG2#)         2.975   1.145   1.145 !5050                          
assign      (resid 62 and name HB)        (resid 62 and name HA)           2.770   0.970   0.970 !8933                          
assign      (resid 62 and name HG1#)      (resid 62 and name HA)           2.760   0.960   0.960 !8935 11770 11773              
assign      (resid 62 and name HD1#)      (resid 62 and name HA)           3.140   1.340   1.340 !9022 6651                     
assign      (resid 62 and name HG2#)      (resid 62 and name HA)           2.975   1.105   1.105 !9023                          
assign      (resid 62 and name HG1#)      (resid 62 and name HB)           2.780   0.950   0.950 !8240 8253                     
assign      (resid 62 and name HN)        (resid 62 and name HD1#)         3.485   1.515   1.515 !6642                          
assign      (resid 59 and name HA)        (resid 62 and name HD1#)         3.520   1.480   1.480 !6643                          
assign      (resid 62 and name HB)        (resid 62 and name HD1#)         2.865   1.065   1.065 !6661                          
assign      (resid 62 and name HG1#)      (resid 62 and name HD1#)         2.740   0.940   0.940 !6669                          
assign      (resid 62 and name HG2#)      (resid 62 and name HD1#)         2.980   1.180   1.180 !6692                          
assign      (resid 62 and name HG12)      (resid 62 and name HG11)         2.410   0.610   0.610 !11814 11847                   
assign      (resid 62 and name HG2#)      (resid 62 and name HG1#)         3.320   1.520   1.520 !11871 5723                    
assign      (resid 71 and name HA#)       (resid 62 and name HG2#)         3.395   1.565   1.565 !5613 5844 5846                
assign      (resid 66 and name HB#)       (resid 62 and name HG2#)         3.400   1.600   1.600 !5702 7347                     
assign      (resid 62 and name HB)        (resid 62 and name HG2#)         2.745   0.945   0.945 !5717                          
assign      (resid 73 and name HG1#)      (resid 62 and name HG2#)         3.320   1.520   1.520 !5725 420 529                  
assign      (resid 63 and name HB#)       (resid 63 and name HA)           2.775   0.945   0.945 !11700 11703                   
assign      (resid 66 and name HB#)       (resid 63 and name HA)           2.710   0.900   0.900 !12018                         
assign      (resid 63 and name HB2)       (resid 63 and name HB1)          1.950   0.150   0.150 !9232                          
assign      (resid 64 and name HA)        (resid 64 and name HB#)          2.765   0.915   0.915 !11090                         
assign      (resid 65 and name HB)        (resid 65 and name HA)           2.740   0.890   0.890 !10683                         
assign      (resid 65 and name HG##)      (resid 65 and name HA)           3.145   1.055   1.055 !10712                         
assign      (resid 81 and name HA)        (resid 65 and name HG##)         3.400   1.600   1.600 !2811                          
assign      (resid 62 and name HA)        (resid 65 and name HG##)         3.430   1.570   1.570 !2815 3880                     
assign      (resid 77 and name HG#)       (resid 65 and name HG##)         3.440   1.560   1.560 !2817                          
assign      (resid 73 and name HG2#)      (resid 65 and name HG##)         3.460   1.540   1.540 !2840 3905                     
assign      (resid 81 and name HN)        (resid 65 and name HG##)         3.400   1.600   1.600 !2901                          
assign      (resid 81 and name HE#)       (resid 65 and name HG##)         3.485   1.515   1.515 !2925 3897                     
assign      (resid 66 and name HN)        (resid 65 and name HG##)         3.750   1.250   1.250 !3874                          
assign      (resid 65 and name HB)        (resid 65 and name HG##)         2.755   0.885   0.885 !3883                          
assign      (resid 81 and name HG#)       (resid 65 and name HG##)         3.535   1.235   1.235 !3890                          
assign      (resid 81 and name HB#)       (resid 65 and name HG##)         3.180   1.060   1.060 !3893                          
assign      (resid 73 and name HG1#)      (resid 65 and name HG##)         3.760   1.240   1.240 !3982                          
assign      (resid 67 and name HB#)       (resid 67 and name HA)           2.990   1.130   1.130 !11574 10492                   
assign      (resid 68 and name HN)        (resid 67 and name HB#)          3.400   1.330   1.330 !10485                         
assign      (resid 67 and name HG#)       (resid 67 and name HB#)          2.720   0.920   0.920 !10508 7934 7935               
assign      (resid 67 and name HB1)       (resid 67 and name HB2)          2.420   0.620   0.620 !10517                         
assign      (resid 4 and name HG2#)       (resid 67 and name HB#)          3.645   1.355   1.355 !10540                         
assign      (resid 67 and name HA)        (resid 67 and name HG#)          3.140   1.340   1.340 !7912 7913                     
assign      (resid 67 and name HG2)       (resid 67 and name HG1)          2.400   0.600   0.600 !7929 7931                     
assign      (resid 70 and name HB#)       (resid 70 and name HA)           2.745   0.855   0.855 !11146                         
assign      (resid 69 and name HA#)       (resid 70 and name HA)           3.595   1.175   1.175 !11148                         
assign      (resid 71 and name HA#)       (resid 70 and name HA)           3.665   1.335   1.335 !11149 11285                   
assign      (resid 72 and name HN)        (resid 70 and name HB#)          2.425   0.495   0.495 !9072                          
assign      (resid 70 and name HB1)       (resid 70 and name HB2)          1.945   0.145   0.145 !9076                          
assign      (resid 72 and name HG2#)      (resid 70 and name HB#)          3.305   1.045   1.045 !9099                          
assign      (resid 71 and name HA2)       (resid 71 and name HA1)          1.995   0.195   0.195 !5817 5824                     
assign      (resid 72 and name HG2#)      (resid 71 and name HA#)          3.730   1.270   1.270 !5841 2730                     
assign      (resid 62 and name HD1#)      (resid 71 and name HA#)          3.810   1.190   1.190 !5843                          
assign      (resid 72 and name HB)        (resid 72 and name HA)           2.770   0.930   0.930 !12567                         
assign      (resid 72 and name HG2#)      (resid 72 and name HB)           2.760   0.890   0.890 !6342 2812                     
assign      (resid 73 and name HN)        (resid 72 and name HG2#)         3.590   1.270   1.270 !2724                          
assign      (resid 73 and name HG2#)      (resid 73 and name HA)           2.985   1.185   1.185 !12676 4449                    
assign      (resid 73 and name HG1#)      (resid 73 and name HA)           2.775   0.925   0.925 !12684                         
assign      (resid 73 and name HG2#)      (resid 73 and name HB)           2.670   0.620   0.620 !7404                          
assign      (resid 62 and name HA)        (resid 73 and name HD1#)         3.200   1.170   1.170 !6310                          
assign      (resid 73 and name HG1#)      (resid 73 and name HD1#)         2.715   0.915   0.915 !6339                          
assign      (resid 73 and name HG2#)      (resid 73 and name HD1#)         3.275   1.205   1.205 !6341                          
assign      (resid 73 and name HN)        (resid 73 and name HD1#)         3.710   1.290   1.290 !6389                          
assign      (resid 62 and name HA)        (resid 73 and name HG1#)         3.020   1.130   1.130 !369                           
assign      (resid 65 and name HB)        (resid 73 and name HG1#)         3.005   1.115   1.115 !375                           
assign      (resid 73 and name HB)        (resid 73 and name HG1#)         2.770   0.970   0.970 !382 504                       
assign      (resid 73 and name HG12)      (resid 73 and name HG11)         2.380   0.580   0.580 !397                           
assign      (resid 73 and name HG2#)      (resid 73 and name HG1#)         3.130   1.330   1.330 !406 513 4486                  
assign      (resid 37 and name HG2#)      (resid 73 and name HG1#)         3.420   1.360   1.360 !410                           
assign      (resid 78 and name HA)        (resid 73 and name HG2#)         3.030   1.230   1.230 !4452 10603                    
assign      (resid 78 and name HB#)       (resid 73 and name HG2#)         3.390   1.590   1.590 !4459 4464 7566 7568           
assign      (resid 77 and name HG#)       (resid 73 and name HG2#)         3.455   1.545   1.545 !4468                          
assign      (resid 77 and name HB#)       (resid 73 and name HG2#)         3.160   1.360   1.360 !4472 11526 11527              
assign      (resid 74 and name HB#)       (resid 74 and name HA)           2.735   0.935   0.935 !12591 12594 7165 7223         
assign      (resid 77 and name HB#)       (resid 74 and name HA)           3.480   1.190   1.190 !12596                         
assign      (resid 74 and name HB2)       (resid 74 and name HB1)          2.385   0.585   0.585 !7170 7174                     
assign      (resid 75 and name HB#)       (resid 75 and name HA)           2.790   0.990   0.990 !10446 10461 7917 7918         
assign      (resid 75 and name HB2)       (resid 75 and name HB1)          2.365   0.565   0.565 !7928                          
assign      (resid 79 and name HG)        (resid 76 and name HA)           3.105   1.265   1.265 !11748                         
assign      (resid 76 and name HG#)       (resid 76 and name HA)           3.100   1.270   1.270 !11897 8870                    
assign      (resid 76 and name HB#)       (resid 76 and name HA)           2.855   1.055   1.055 !11907 11909 23 25             
assign      (resid 79 and name HD##)      (resid 76 and name HA)           3.400   1.600   1.600 !11935 2273 1096               
assign      (resid 76 and name HG#)       (resid 76 and name HB#)          2.730   0.930   0.930 !41 8879                       
assign      (resid 77 and name HG#)       (resid 77 and name HA)           2.825   1.025   1.025 !128 12276                     
assign      (resid 80 and name HG##)      (resid 77 and name HA)           3.600   1.400   1.400 !197 210 1990                  
assign      (resid 77 and name HG#)       (resid 77 and name HB#)          2.895   1.095   1.095 !11483 11484 8607 8620         
assign      (resid 77 and name HG2)       (resid 77 and name HG1)          2.500   0.700   0.700 !8601 8603                     
assign      (resid 81 and name HB#)       (resid 78 and name HA)           2.840   1.020   1.020 !10452 10460                   
assign      (resid 81 and name HE#)       (resid 78 and name HA)           3.400   1.600   1.600 !10468 4914                    
assign      (resid 73 and name HD1#)      (resid 78 and name HA)           3.635   1.365   1.365 !10475                         
assign      (resid 78 and name HB#)       (resid 78 and name HA)           2.975   1.175   1.175 !10569 10571 7539 7609         
assign      (resid 78 and name HB1)       (resid 78 and name HB2)          2.565   0.765   0.765 !7545                          
assign      (resid 82 and name HB#)       (resid 79 and name HA)           2.950   0.990   0.990 !12335                         
assign      (resid 79 and name HG)        (resid 79 and name HA)           2.960   1.110   1.110 !12356 1444                    
assign      (resid 79 and name HB#)       (resid 79 and name HA)           3.085   1.285   1.285 !12364 7320 7321               
assign      (resid 79 and name HD##)      (resid 79 and name HA)           3.345   1.545   1.545 !12376 2275 1100               
assign      (resid 10 and name HB#)       (resid 79 and name HB#)          3.485   1.515   1.515 !7189 7336                     
assign      (resid 79 and name HG)        (resid 79 and name HB#)          2.885   1.085   1.085 !7255 1456 1478                
assign      (resid 79 and name HD##)      (resid 79 and name HB#)          3.100   1.300   1.300 !7267 7352 1124 2285 2302      
assign      (resid 80 and name HN)        (resid 79 and name HB#)          3.095   1.295   1.295 !7303                          
assign      (resid 79 and name HN)        (resid 79 and name HD##)         3.410   1.590   1.590 !2261 1083                     
assign      (resid 10 and name HB#)       (resid 79 and name HD##)         3.500   1.500   1.500 !2293 1144                     
assign      (resid 19 and name HG2#)      (resid 79 and name HD##)         3.400   1.600   1.600 !2296 1149                     
assign      (resid 79 and name HG)        (resid 79 and name HD##)         3.015   1.215   1.215 !2298 1154 1481                
assign      (resid 78 and name HN)        (resid 79 and name HD##)         3.615   1.385   1.385 !2345                          
assign      (resid 22 and name HB#)       (resid 79 and name HG)           3.605   1.395   1.395 !1443                          
assign      (resid 80 and name HB)        (resid 80 and name HA)           2.765   0.905   0.905 !8280                          
assign      (resid 83 and name HB)        (resid 80 and name HA)           2.670   0.870   0.870 !8282 10500                    
assign      (resid 83 and name HG##)      (resid 80 and name HA)           3.530   1.470   1.470 !8292 8297 3021                
assign      (resid 80 and name HG##)      (resid 80 and name HA)           2.805   0.945   0.945 !8293 8295 2013 3142           
assign      (resid 77 and name HA)        (resid 80 and name HB)           2.800   0.650   0.650 !10734                         
assign      (resid 80 and name HG##)      (resid 80 and name HB)           2.675   0.645   0.645 !10785 10798                   
assign      (resid 83 and name HG##)      (resid 80 and name HG##)         3.805   1.195   1.195 !3058 1934                     
assign      (resid 81 and name HA)        (resid 80 and name HG##)         3.700   1.300   1.300 !3141                          
assign      (resid 84 and name HD#)       (resid 80 and name HG##)         3.400   1.600   1.600 !3143 6290                     
assign      (resid 80 and name HG21)      (resid 80 and name HG11)         2.880   0.960   0.960 !3167                          
assign      (resid 77 and name HG#)       (resid 80 and name HG##)         3.765   1.235   1.235 !1898                          
assign      (resid 79 and name HN)        (resid 80 and name HG##)         3.760   1.240   1.240 !1977                          
assign      (resid 84 and name HD#)       (resid 81 and name HA)           3.445   1.555   1.555 !11702                         
assign      (resid 81 and name HG#)       (resid 81 and name HA)           2.860   1.060   1.060 !11709 10495 10496             
assign      (resid 81 and name HB#)       (resid 81 and name HA)           3.080   1.280   1.280 !11723 9635 9636               
assign      (resid 81 and name HE#)       (resid 81 and name HA)           3.400   1.600   1.600 !11728 4917                    
assign      (resid 73 and name HG2#)      (resid 81 and name HB#)          3.575   1.425   1.425 !9577                          
assign      (resid 81 and name HG#)       (resid 81 and name HB#)          2.725   0.925   0.925 !9645                          
assign      (resid 81 and name HG1)       (resid 81 and name HG2)          2.160   0.360   0.360 !10514                         
assign      (resid 82 and name HB#)       (resid 81 and name HG#)          2.800   1.000   1.000 !10531 10532                   
assign      (resid 81 and name HG#)       (resid 81 and name HE#)          2.745   0.945   0.945 !4944                          
assign      (resid 82 and name HE#)       (resid 81 and name HE#)          3.390   1.590   1.590 !5039 3980                     
assign      (resid 82 and name HE#)       (resid 82 and name HA)           3.390   1.590   1.590 !877 3955                      
assign      (resid 82 and name HB#)       (resid 82 and name HA)           2.775   0.975   0.975 !879 9900 9901                 
assign      (resid 85 and name HB#)       (resid 82 and name HA)           3.320   1.480   1.480 !962 967 12407                 
assign      (resid 82 and name HB2)       (resid 82 and name HB1)          2.460   0.660   0.660 !9913 9920                     
assign      (resid 81 and name HE#)       (resid 82 and name HB#)          3.295   1.355   1.355 !9995                          
assign      (resid 18 and name HG#)       (resid 82 and name HE#)          3.220   1.420   1.420 !3965                          
assign      (resid 86 and name HE#)       (resid 82 and name HE#)          3.400   1.600   1.600 !3972 5040                     
assign      (resid 82 and name HB#)       (resid 82 and name HE#)          3.050   1.250   1.250 !4000                          
assign      (resid 83 and name HG##)      (resid 83 and name HA)           2.995   1.145   1.145 !8402 8493 1894 3018           
assign      (resid 86 and name HG#)       (resid 83 and name HA)           3.150   1.080   1.080 !8442                          
assign      (resid 86 and name HB#)       (resid 83 and name HA)           2.965   1.165   1.165 !8453 8465 9229                
assign      (resid 86 and name HE#)       (resid 83 and name HA)           3.475   1.525   1.525 !8458 4920                     
assign      (resid 83 and name HB)        (resid 83 and name HA)           2.765   0.905   0.905 !8470 10498                    
assign      (resid 84 and name HG#)       (resid 83 and name HB)           2.925   0.975   0.975 !10525                         
assign      (resid 83 and name HG##)      (resid 83 and name HB)           2.715   0.915   0.915 !10653 10662 1907 3036         
assign      (resid 84 and name HN)        (resid 83 and name HG##)         3.580   1.420   1.420 !3005 1784                     
assign      (resid 84 and name HA)        (resid 83 and name HG##)         3.425   1.575   1.575 !3017 11455                    
assign      (resid 87 and name HE#)       (resid 83 and name HG##)         3.420   1.470   1.470 !3027 7120 7122                
assign      (resid 87 and name HN)        (resid 83 and name HG##)         3.665   1.335   1.335 !3135                          
assign      (resid 82 and name HN)        (resid 83 and name HG##)         3.740   1.260   1.260 !1673                          
assign      (resid 10 and name HN)        (resid 83 and name HG##)         3.675   1.325   1.325 !1785                          
assign      (resid 86 and name HE#)       (resid 83 and name HG##)         3.820   1.180   1.180 !1903                          
assign      (resid 83 and name HG11)      (resid 83 and name HG21)         3.110   1.160   1.160 !1938                          
assign      (resid 84 and name HD#)       (resid 84 and name HA)           2.965   1.165   1.165 !11398 6270                    
assign      (resid 87 and name HD#)       (resid 84 and name HA)           3.405   1.595   1.595 !11435 11768                   
assign      (resid 84 and name HN)        (resid 84 and name HB#)          3.185   1.385   1.385 !11206                         
assign      (resid 85 and name HN)        (resid 84 and name HB#)          3.400   1.600   1.600 !11211                         
assign      (resid 81 and name HA)        (resid 84 and name HB#)          3.405   1.595   1.595 !11339                         
assign      (resid 84 and name HA)        (resid 84 and name HG#)          2.820   1.020   1.020 !364 365                       
assign      (resid 84 and name HD#)       (resid 84 and name HG#)          2.930   1.080   1.080 !371 372                       
assign      (resid 84 and name HG1)       (resid 84 and name HG2)          2.320   0.520   0.520 !401                           
assign      (resid 80 and name HG##)      (resid 84 and name HG#)          3.645   1.355   1.355 !414                           
assign      (resid 85 and name HB#)       (resid 85 and name HA)           2.755   0.955   0.955 !783 856 15 12404              
assign      (resid 85 and name HG#)       (resid 85 and name HA)           3.050   1.220   1.220 !848                           
assign      (resid 85 and name HB1)       (resid 85 and name HB2)          2.530   0.730   0.730 !50                            
assign      (resid 85 and name HG#)       (resid 85 and name HB#)          2.765   0.965   0.965 !12420                         
assign      (resid 82 and name HA)        (resid 85 and name HG#)          2.670   0.500   0.500 !9030                          
assign      (resid 85 and name HG2)       (resid 85 and name HG1)          1.950   0.150   0.150 !9039 9044                     
assign      (resid 61 and name HG1#)      (resid 85 and name HG#)          3.075   0.625   0.625 !9062                          
assign      (resid 86 and name HG#)       (resid 86 and name HA)           2.900   1.100   1.100 !12278 12282                   
assign      (resid 86 and name HB#)       (resid 86 and name HA)           3.025   1.225   1.225 !12294 9224 9225               
assign      (resid 86 and name HN)        (resid 86 and name HB#)          2.795   0.995   0.995 !9220                          
assign      (resid 86 and name HG#)       (resid 86 and name HB#)          3.015   1.215   1.215 !9233 9308 9312 9983 10069     
assign      (resid 86 and name HB2)       (resid 86 and name HB1)          2.425   0.625   0.625 !9244                          
assign      (resid 87 and name HD#)       (resid 86 and name HB#)          3.505   1.495   1.495 !9335                          
assign      (resid 86 and name HG1)       (resid 86 and name HG2)          2.225   0.425   0.425 !9979 10064                    
assign      (resid 86 and name HE#)       (resid 86 and name HG#)          3.355   1.555   1.555 !10066 4927 4930               
assign      (resid 82 and name HB#)       (resid 86 and name HG#)          2.830   1.030   1.030 !10080                         
assign      (resid 18 and name HE#)       (resid 86 and name HE#)          3.195   1.235   1.235 !4972                          
assign      (resid 87 and name HB#)       (resid 87 and name HA)           2.800   1.000   1.000 !445 450 9630 9737             
assign      (resid 87 and name HD#)       (resid 87 and name HA)           3.280   1.450   1.450 !458                           
assign      (resid 87 and name HG#)       (resid 87 and name HA)           3.130   1.330   1.330 !459 462 1438 1439             
assign      (resid 87 and name HG#)       (resid 87 and name HB#)          3.135   1.335   1.335 !9669 9777 9779 9780 1463 1464 
assign      (resid 87 and name HB2)       (resid 87 and name HB1)          2.325   0.525   0.525 !9770 9771                     
assign      (resid 87 and name HD#)       (resid 87 and name HB#)          3.105   1.305   1.305 !9774 9775                     
assign      (resid 83 and name HG##)      (resid 87 and name HD#)          3.450   1.550   1.550 !11866                         
assign      (resid 87 and name HE#)       (resid 87 and name HG#)          3.265   1.465   1.465 !1333 1446 7113 7115 7117 7118 
assign      (resid 83 and name HG##)      (resid 87 and name HG#)          3.525   1.475   1.475 !1363 1364                     
assign      (resid 87 and name HD#)       (resid 87 and name HG#)          2.730   0.930   0.930 !1468 1469                     
assign      (resid 87 and name HG2)       (resid 87 and name HG1)          2.350   0.550   0.550 !1473 1475                     
assign      (resid 87 and name HB#)       (resid 87 and name HE#)          2.960   1.160   1.160 !7030 7107                     
assign      (resid 87 and name HD#)       (resid 87 and name HE#)          2.755   0.955   0.955 !7034 7112                     
assign      (resid 88 and name HG#)       (resid 88 and name HA)           3.385   1.585   1.585 !566 8734 8735                 
assign      (resid 88 and name HB#)       (resid 88 and name HA)           3.095   1.295   1.295 !569 11213 11214               
assign      (resid 88 and name HG#)       (resid 88 and name HB#)          2.810   1.010   1.010 !11237 11238 8764              
assign      (resid 89 and name HB#)       (resid 89 and name HA)           2.855   1.055   1.055 !12569 12570                   
assign      (resid 89 and name HB2)       (resid 89 and name HB1)          1.935   0.135   0.135 !7173                          
assign      (resid 90 and name HN)        (resid 89 and name HB#)          3.530   0.720   0.720 !7300 7302                     
assign      (resid 90 and name HB#)       (resid 90 and name HA)           2.750   0.870   0.870 !2076 3423                     
! Xplor table file created by nnoe_calib.tcl (on Tue Dec  4 15:09:05 MST 2001)
! peak list used: n15noesy_600_round13

! residue 3 (i.e.  ...;3.HN,3.N)
assign (resid 2 and name HA) (resid 3 and name HN)   3.014 1.214 1.214
assign (resid 2 and name HB*) (resid 3 and name HN)   3.493 1.507 1.507
assign (resid 3 and name HB*) (resid 3 and name HN)   3.409 1.591 1.591
assign (resid 5 and name HN) (resid 3 and name HN)   3.400 1.600 1.600

! residue 4 (i.e.  ...;4.HN,4.N)
assign (resid 4 and name HA) (resid 4 and name HN)   2.952 0.691 0.691
assign (resid 3 and name HB*) (resid 4 and name HN)   2.908 0.676 0.676
assign (resid 4 and name HG2*) (resid 4 and name HN)   3.012 0.711 0.711

! residue 5 (i.e.  ...;5.HN,5.N)
assign (resid 4 and name HG2*) (resid 5 and name HN)   3.748 1.252 1.252
assign (resid 6 and name HN) (resid 5 and name HN)   3.270 1.293 1.293
assign ((resid 5 and name HB2) or (resid 5 and name HB1)) (resid 5 and name HN)   3.152 1.301 1.301
assign ((resid 5 and name HB1) or (resid 5 and name HB2)) (resid 5 and name HN)   3.152 1.301 1.301

! residue 6 (i.e.  ...;6.HN,6.N)
assign (resid 7 and name HN) (resid 6 and name HN)   2.890 1.067 1.067
assign ((resid 6 and name HG2) or (resid 6 and name HG1)) (resid 6 and name HN)   3.269 1.250 1.250
assign (resid 5 and name HN) (resid 6 and name HN)   3.270 1.293 1.293
assign ((resid 5 and name HB1) or (resid 5 and name HB2)) (resid 6 and name HN)   3.140 1.181 1.181
assign ((resid 6 and name HG1) or (resid 6 and name HG2)) (resid 6 and name HN)   3.269 1.250 1.250
assign ((resid 6 and name HB2) or (resid 6 and name HB1)) (resid 6 and name HN)   2.862 1.055 1.055

! residue 7 (i.e.  ...;7.HN,7.N)
assign ((resid 6 and name HG1) or (resid 6 and name HG2)) (resid 7 and name HN)   3.023 0.806 0.806
assign (resid 6 and name HN) (resid 7 and name HN)   2.890 1.067 1.067
assign (resid 8 and name HN) (resid 7 and name HN)   2.649 0.745 0.745
assign (resid 7 and name HA) (resid 7 and name HN)   2.975 0.784 0.784
assign (resid 7 and name HG*) (resid 7 and name HN)   3.132 0.858 0.858

! residue 8 (i.e.  ...;8.HN,8.N)
assign (resid 5 and name HA) (resid 8 and name HN)   3.503 0.897 0.897
assign (resid 8 and name HA) (resid 8 and name HN)   2.949 0.680 0.680
assign ((resid 5 and name HB1) or (resid 5 and name HB2)) (resid 8 and name HN)   3.381 0.841 0.841
assign ((resid 7 and name HB2) or (resid 7 and name HB1)) (resid 8 and name HN)   3.153 0.842 0.842
assign ((resid 7 and name HB1) or (resid 7 and name HB2)) (resid 8 and name HN)   3.153 0.842 0.842
assign (resid 9 and name HN) (resid 8 and name HN)   2.801 1.001 1.001
assign (resid 7 and name HN) (resid 8 and name HN)   2.649 0.745 0.745
assign (resid 8 and name HB*) (resid 8 and name HN)   2.968 0.686 0.686

! residue 9 (i.e.  ...;9.HN,9.N)
assign (resid 8 and name HN) (resid 9 and name HN)   2.801 1.001 1.001
assign (resid 10 and name HN) (resid 9 and name HN)   2.752 0.953 0.953
assign (resid 7 and name HN) (resid 9 and name HN)   3.376 1.302 1.302
assign ((resid 9 and name HG2) or (resid 9 and name HG1)) (resid 9 and name HN)   3.171 1.228 1.228
assign ((resid 9 and name HG1) or (resid 9 and name HG2)) (resid 9 and name HN)   3.171 1.228 1.228
assign (resid 9 and name HB*) (resid 9 and name HN)   2.633 0.833 0.833
assign (resid 8 and name HB*) (resid 9 and name HN)   3.081 1.153 1.153
assign (resid 10 and name HB*) (resid 9 and name HN)   3.754 1.246 1.246

! residue 10 (i.e.  ...;10.HN,10.N)
assign (resid 9 and name HN) (resid 10 and name HN)   2.752 0.953 0.953
assign (resid 7 and name HA) (resid 10 and name HN)   3.172 1.197 1.197
assign (resid 9 and name HB*) (resid 10 and name HN)   3.028 1.129 1.129
assign (resid 10 and name HB*) (resid 10 and name HN)   2.838 1.038 1.038

! residue 11 (i.e.  ...;11.HN,11.N)
assign (resid 12 and name HN) (resid 11 and name HN)   2.799 0.607 0.607
assign (resid 11 and name HA) (resid 11 and name HN)   2.941 0.645 0.645
assign (resid 11 and name HD*) (resid 11 and name HN)   4.003 0.997 0.997
!assign (resid 9 and name HB*) (resid 11 and name HN)   4.005 0.995 0.995
assign (resid 10 and name HB*) (resid 11 and name HN)   3.329 0.765 0.765

! residue 12 (i.e.  ...;12.HN,12.N)
assign (resid 14 and name HN) (resid 12 and name HN)   3.835 0.948 0.948
assign (resid 12 and name HA) (resid 12 and name HN)   2.939 0.636 0.636
assign (resid 11 and name HA) (resid 12 and name HN)   3.555 0.830 0.830
assign (resid 12 and name HB*) (resid 12 and name HN)   2.983 0.648 0.648
assign (resid 10 and name HB*) (resid 12 and name HN)   4.176 0.824 0.824

! residue 13 (i.e.  ...;13.HN,13.N)
assign (resid 12 and name HB*) (resid 13 and name HN)   3.620 0.887 0.887
assign (resid 14 and name HN) (resid 13 and name HN)   2.662 0.575 0.575
assign (resid 13 and name HA) (resid 13 and name HN)   2.942 0.649 0.649
assign (resid 12 and name HA) (resid 13 and name HN)   3.400 0.798 0.798
assign ((resid 13 and name HB2) or (resid 13 and name HB1)) (resid 13 and name HN)   2.625 0.570 0.570
assign ((resid 13 and name HB1) or (resid 13 and name HB2)) (resid 13 and name HN)   2.625 0.570 0.570
assign (resid 10 and name HB*) (resid 13 and name HN)   4.066 0.935 0.935

! residue 14 (i.e.  ...;14.HN,14.N)
assign (resid 14 and name HA) (resid 14 and name HN)   2.947 0.673 0.673
assign (resid 13 and name HA) (resid 14 and name HN)   3.539 0.901 0.901
assign (resid 11 and name HA) (resid 14 and name HN)   3.481 0.874 0.874
assign ((resid 13 and name HB1) or (resid 13 and name HB2)) (resid 14 and name HN)   2.985 0.685 0.685
assign (resid 14 and name HG) (resid 14 and name HN)   2.524 0.554 0.554
assign ((resid 14 and name HB2) or (resid 14 and name HB1)) (resid 14 and name HN)   2.837 0.810 0.810
assign ((resid 14 and name HB1) or (resid 14 and name HB2)) (resid 14 and name HN)   2.837 0.810 0.810
assign ((resid 14 and name HD1*) or (resid 14 and name HD2*)) (resid 14 and name HN)   3.935 1.065 1.065
assign ((resid 14 and name HD2*) or (resid 14 and name HD1*)) (resid 14 and name HN)   3.935 1.065 1.065

! residue 15 (i.e.  ...;15.HN,15.N)
assign (resid 15 and name HA) (resid 15 and name HN)   2.948 0.674 0.674
assign ((resid 15 and name HB1) or (resid 15 and name HB2)) (resid 15 and name HN)   2.847 0.643 0.643
assign ((resid 18 and name HB2) or (resid 18 and name HB1)) (resid 15 and name HN)   3.078 0.717 0.717
assign ((resid 14 and name HD1*) or (resid 14 and name HD2*)) (resid 15 and name HN)   3.961 1.039 1.039
assign ((resid 14 and name HB1) or (resid 14 and name HB2)) (resid 15 and name HN)   3.159 0.745 0.745

! residue 16 (i.e.  ...;16.HN,16.N)
assign (resid 17 and name HN) (resid 16 and name HN)   3.275 0.904 0.904
assign (resid 15 and name HA) (resid 16 and name HN)   2.651 0.572 0.572
assign ((resid 15 and name HB2) or (resid 15 and name HB1)) (resid 16 and name HN)   2.998 0.665 0.665
assign ((resid 16 and name HG2) or (resid 16 and name HG1)) (resid 16 and name HN)   3.470 0.824 0.824
assign (resid 16 and name HB*) (resid 16 and name HN)   2.909 0.640 0.640
assign (resid 16 and name HA) (resid 16 and name HN)   2.942 0.649 0.649

! residue 17 (i.e.  ...;17.HN,17.N)
assign (resid 16 and name HN) (resid 17 and name HN)   3.275 0.904 0.904
assign (resid 18 and name HN) (resid 17 and name HN)   2.707 0.907 0.907
assign (resid 15 and name HA) (resid 17 and name HN)   3.667 0.853 0.853
assign ((resid 15 and name HB2) or (resid 15 and name HB1)) (resid 17 and name HN)   3.287 0.725 0.725
assign (resid 17 and name HA) (resid 17 and name HN)   2.938 0.628 0.628
assign (resid 16 and name HA) (resid 17 and name HN)   3.392 0.757 0.757
assign ((resid 17 and name HB1) or (resid 17 and name HB2)) (resid 17 and name HN)   3.020 0.649 0.649

! residue 18 (i.e.  ...;18.HN,18.N)
assign (resid 17 and name HN) (resid 18 and name HN)   2.707 0.907 0.907
assign (resid 19 and name HN) (resid 18 and name HN)   2.673 0.873 0.873
assign ((resid 18 and name HG2) or (resid 18 and name HG1)) (resid 18 and name HN)   3.311 1.344 1.344
assign ((resid 18 and name HG1) or (resid 18 and name HG2)) (resid 18 and name HN)   3.311 1.344 1.344
assign ((resid 17 and name HG1) or (resid 17 and name HG2)) (resid 18 and name HN)   3.562 1.406 1.406
assign ((resid 18 and name HB2) or (resid 18 and name HB1)) (resid 18 and name HN)   2.684 0.884 0.884
assign ((resid 19 and name HG11) or (resid 19 and name HG12)) (resid 18 and name HN)   3.568 1.410 1.410

! residue 19 (i.e.  ...;19.HN,19.N)
assign (resid 20 and name HN) (resid 19 and name HN)   2.873 0.837 0.837
assign (resid 19 and name HA) (resid 19 and name HN)   2.957 0.712 0.712
assign ((resid 19 and name HG12) or (resid 19 and name HG11)) (resid 19 and name HN)   2.889 0.981 0.981
assign (resid 18 and name HN) (resid 19 and name HN)   2.673 0.873 0.873
assign (resid 16 and name HA) (resid 19 and name HN)   3.175 0.797 0.797
assign ((resid 18 and name HB2) or (resid 18 and name HB1)) (resid 19 and name HN)   3.149 0.786 0.786
assign (resid 19 and name HB) (resid 19 and name HN)   2.421 0.549 0.549
assign ((resid 19 and name HG11) or (resid 19 and name HG12)) (resid 19 and name HN)   2.889 0.981 0.981
assign (resid 19 and name HD1*) (resid 19 and name HN)   3.870 1.130 1.130

! residue 20 (i.e.  ...;20.HN,20.N)
assign (resid 19 and name HN) (resid 20 and name HN)   2.873 0.837 0.837
assign (resid 20 and name HA) (resid 20 and name HN)   2.939 0.634 0.634
assign (resid 19 and name HA) (resid 20 and name HN)   3.800 0.925 0.925
assign (resid 19 and name HB) (resid 20 and name HN)   2.849 0.610 0.610
assign (resid 19 and name HG2*) (resid 20 and name HN)   4.056 0.944 0.944

! residue 21 (i.e.  ...;21.HN,21.N)
assign (resid 22 and name HN) (resid 21 and name HN)   2.708 0.908 0.908
assign (resid 24 and name HN) (resid 21 and name HN)   3.435 1.334 1.334
assign ((resid 21 and name HG1) or (resid 21 and name HG2)) (resid 21 and name HN)   3.042 1.206 1.206
assign ((resid 21 and name HB2) or (resid 21 and name HB1)) (resid 21 and name HN)   2.735 0.935 0.935
assign ((resid 21 and name HB1) or (resid 21 and name HB2)) (resid 21 and name HN)   2.735 0.935 0.935
assign (resid 20 and name HB*) (resid 21 and name HN)   3.114 1.169 1.169
assign ((resid 21 and name HG2) or (resid 21 and name HG1)) (resid 21 and name HN)   3.042 1.206 1.206

! residue 22 (i.e.  ...;22.HN,22.N)
assign (resid 23 and name HN) (resid 22 and name HN)   2.853 0.734 0.734
assign (resid 21 and name HN) (resid 22 and name HN)   2.708 0.908 0.908
assign (resid 22 and name HA) (resid 22 and name HN)   2.952 0.694 0.694
assign (resid 21 and name HA) (resid 22 and name HN)   3.224 0.795 0.795
assign (resid 22 and name HB*) (resid 22 and name HN)   2.943 0.691 0.691
assign ((resid 21 and name HB2) or (resid 21 and name HB1)) (resid 22 and name HN)   3.062 0.732 0.732

! residue 23 (i.e.  ...;23.HN,23.N)
assign (resid 22 and name HN) (resid 23 and name HN)   2.853 0.734 0.734
assign (resid 24 and name HN) (resid 23 and name HN)   2.832 1.032 1.032
assign (resid 20 and name HA) (resid 23 and name HN)   3.070 0.759 0.759
assign (resid 23 and name HA) (resid 23 and name HN)   2.958 0.716 0.716
assign (resid 22 and name HB*) (resid 23 and name HN)   3.311 0.864 0.864
assign ((resid 23 and name HB2) or (resid 23 and name HB1)) (resid 23 and name HN)   2.565 0.610 0.610
assign ((resid 23 and name HB1) or (resid 23 and name HB2)) (resid 23 and name HN)   2.565 0.610 0.610

! residue 24 (i.e.  ...;24.HN,24.N)
assign (resid 23 and name HN) (resid 24 and name HN)   2.832 1.032 1.032
assign ((resid 23 and name HB2) or (resid 23 and name HB1)) (resid 24 and name HN)   3.243 1.408 1.408
assign ((resid 23 and name HB1) or (resid 23 and name HB2)) (resid 24 and name HN)   3.243 1.408 1.408
assign (resid 24 and name HB*) (resid 24 and name HN)   2.768 0.968 0.968
assign (resid 23 and name HG*) (resid 24 and name HN)   3.633 1.367 1.367

! residue 25 (i.e.  ...;25.HN,25.N)
assign (resid 24 and name HB*) (resid 25 and name HN)   3.606 1.394 1.394
assign (resid 26 and name HN) (resid 25 and name HN)   3.171 1.221 1.221
assign (resid 25 and name HB*) (resid 25 and name HN)   3.389 1.308 1.308

! residue 26 (i.e.  ...;26.HN,26.N)
assign (resid 27 and name HN) (resid 26 and name HN)   3.338 1.394 1.394
assign (resid 25 and name HN) (resid 26 and name HN)   3.171 1.221 1.221
assign (resid 25 and name HB*) (resid 26 and name HN)   3.596 1.404 1.404

! residue 27 (i.e.  ...;27.HN,27.N)
assign (resid 26 and name HN) (resid 27 and name HN)   3.338 1.394 1.394
assign (resid 28 and name HN) (resid 27 and name HN)   2.933 1.133 1.133

! residue 28 (i.e.  ...;28.HN,28.N)
assign (resid 27 and name HN) (resid 28 and name HN)   2.933 1.133 1.133
assign (resid 27 and name HA) (resid 28 and name HN)   3.079 1.279 1.279
assign ((resid 28 and name HG1) or (resid 28 and name HG2)) (resid 28 and name HN)   3.243 1.443 1.443

! residue 29 (i.e.  ...;29.HN,29.N)
assign (resid 30 and name HN) (resid 29 and name HN)   2.759 0.762 0.762
assign (resid 28 and name HN) (resid 29 and name HN)   2.705 0.619 0.619
assign (resid 29 and name HA) (resid 29 and name HN)   2.953 0.697 0.697
assign ((resid 29 and name HB2) or (resid 29 and name HB1)) (resid 29 and name HN)   2.845 0.661 0.661
assign ((resid 28 and name HB1) or (resid 28 and name HB2)) (resid 29 and name HN)   3.404 0.880 0.880

! residue 30 (i.e.  ...;30.HN,30.N)
assign (resid 29 and name HN) (resid 30 and name HN)   2.759 0.762 0.762
assign (resid 30 and name HA) (resid 30 and name HN)   2.952 0.694 0.694
assign ((resid 30 and name HB1) or (resid 30 and name HB2)) (resid 30 and name HN)   2.699 0.615 0.615
assign ((resid 37 and name HG12) or (resid 37 and name HG11)) (resid 30 and name HN)   3.386 0.867 0.867
assign (resid 31 and name HN) (resid 30 and name HN)   3.455 1.004 1.004

! residue 31 (i.e.  ...;31.HN,31.N)
assign (resid 30 and name HA) (resid 31 and name HN)   2.634 0.571 0.571
assign ((resid 30 and name HB2) or (resid 30 and name HB1)) (resid 31 and name HN)   3.065 0.691 0.691
assign (resid 31 and name HB*) (resid 31 and name HN)   3.033 0.681 0.681
assign (resid 32 and name HN) (resid 31 and name HN)   3.224 0.926 0.926
assign (resid 30 and name HN) (resid 31 and name HN)   3.455 1.004 1.004
assign (resid 31 and name HA) (resid 31 and name HN)   2.943 0.654 0.654

! residue 32 (i.e.  ...;32.HN,32.N)
assign ((resid 32 and name HB2) or (resid 32 and name HB1)) (resid 32 and name HN)   3.181 0.856 0.856
assign ((resid 30 and name HB2) or (resid 30 and name HB1)) (resid 32 and name HN)   3.632 0.904 0.904
assign (resid 33 and name HN) (resid 32 and name HN)   2.590 0.560 0.560
assign (resid 31 and name HN) (resid 32 and name HN)   3.224 0.926 0.926
assign (resid 32 and name HA) (resid 32 and name HN)   2.943 0.654 0.654
assign (resid 30 and name HA) (resid 32 and name HN)   3.443 0.823 0.823
assign (resid 31 and name HA) (resid 32 and name HN)   3.282 0.763 0.763
assign ((resid 32 and name HB1) or (resid 32 and name HB2)) (resid 32 and name HN)   3.181 0.856 0.856
assign (resid 31 and name HB*) (resid 32 and name HN)   3.254 0.753 0.753

! residue 33 (i.e.  ...;33.HN,33.N)
assign (resid 32 and name HA) (resid 33 and name HN)   3.201 1.211 1.211
assign (resid 31 and name HA) (resid 33 and name HN)   3.462 1.349 1.349
assign (resid 33 and name HA*) (resid 33 and name HN)   2.676 0.876 0.876
assign ((resid 30 and name HB2) or (resid 30 and name HB1)) (resid 33 and name HN)   3.582 1.418 1.418

! residue 34 (i.e.  ...;34.HN,34.N)
assign (resid 35 and name HN) (resid 34 and name HN)   2.836 1.036 1.036
assign (resid 33 and name HN) (resid 34 and name HN)   2.733 0.933 0.933
assign ((resid 34 and name HA2) or (resid 34 and name HA1)) (resid 34 and name HN)   2.819 1.019 1.019
assign ((resid 34 and name HA1) or (resid 34 and name HA2)) (resid 34 and name HN)   2.819 1.019 1.019
assign (resid 33 and name HA*) (resid 34 and name HN)   3.268 1.245 1.245

! residue 35 (i.e.  ...;35.HN,35.N)
assign ((resid 34 and name HA2) or (resid 34 and name HA1)) (resid 35 and name HN)   3.495 1.368 1.368
assign (resid 34 and name HN) (resid 35 and name HN)   2.836 1.036 1.036
assign (resid 36 and name HN) (resid 35 and name HN)   2.658 0.858 0.858
assign ((resid 35 and name HA2) or (resid 35 and name HA1)) (resid 35 and name HN)   2.846 1.046 1.046
assign (resid 33 and name HA*) (resid 35 and name HN)   3.681 1.319 1.319
assign ((resid 35 and name HA1) or (resid 35 and name HA2)) (resid 35 and name HN)   2.846 1.046 1.046

! residue 36 (i.e.  ...;36.HN,36.N)
assign (resid 36 and name HA) (resid 36 and name HN)   2.949 0.678 0.678
assign ((resid 35 and name HA2) or (resid 35 and name HA1)) (resid 36 and name HN)   3.172 0.802 0.802
assign ((resid 36 and name HB2) or (resid 36 and name HB1)) (resid 36 and name HN)   3.438 0.863 0.863
assign (resid 35 and name HN) (resid 36 and name HN)   2.658 0.858 0.858
assign ((resid 35 and name HA1) or (resid 35 and name HA2)) (resid 36 and name HN)   3.172 0.802 0.802

! residue 37 (i.e.  ...;37.HN,37.N)
assign (resid 73 and name HN) (resid 37 and name HN)   2.757 0.756 0.756
assign (resid 36 and name HA) (resid 37 and name HN)   2.500 0.581 0.581
assign (resid 37 and name HA) (resid 37 and name HN)   2.962 0.732 0.732
assign (resid 72 and name HB) (resid 37 and name HN)   3.233 0.848 0.848
assign ((resid 36 and name HB1) or (resid 36 and name HB2)) (resid 37 and name HN)   2.807 0.676 0.676
assign (resid 73 and name HB) (resid 37 and name HN)   3.245 0.854 0.854
assign (resid 37 and name HB) (resid 37 and name HN)   2.644 0.623 0.623
assign ((resid 37 and name HG12) or (resid 37 and name HG11)) (resid 37 and name HN)   2.925 0.718 0.718

! residue 38 (i.e.  ...;38.HN,38.N)
assign (resid 37 and name HA) (resid 38 and name HN)   2.252 0.452 0.452
assign (resid 38 and name HA) (resid 38 and name HN)   2.967 0.752 0.752
assign (resid 41 and name HB*) (resid 38 and name HN)   2.780 0.682 0.682
assign (resid 37 and name HG2*) (resid 38 and name HN)   3.433 0.982 0.982
assign ((resid 38 and name HB2) or (resid 38 and name HB1)) (resid 38 and name HN)   2.909 0.745 0.745
assign ((resid 38 and name HB1) or (resid 38 and name HB2)) (resid 38 and name HN)   2.909 0.745 0.745

! residue 39 (i.e.  ...;39.HN,39.N)
assign (resid 40 and name HN) (resid 39 and name HN)   3.339 1.282 1.282
assign (resid 39 and name HB) (resid 39 and name HN)   2.899 0.702 0.702
assign ((resid 38 and name HB1) or (resid 38 and name HB2)) (resid 39 and name HN)   3.055 0.926 0.926
assign (resid 39 and name HA) (resid 39 and name HN)   2.960 0.725 0.725
assign (resid 38 and name HA) (resid 39 and name HN)   2.725 0.644 0.644
assign ((resid 38 and name HB2) or (resid 38 and name HB1)) (resid 39 and name HN)   3.055 0.926 0.926
assign (resid 39 and name HG2*) (resid 39 and name HN)   3.838 1.162 1.162

! residue 40 (i.e.  ...;40.HN,40.N)
assign ((resid 38 and name HB2) or (resid 38 and name HB1)) (resid 40 and name HN)   3.493 1.366 1.366
assign ((resid 40 and name HB1) or (resid 40 and name HB2)) (resid 40 and name HN)   3.067 1.229 1.229
assign (resid 39 and name HN) (resid 40 and name HN)   3.339 1.282 1.282
assign ((resid 40 and name HB2) or (resid 40 and name HB1)) (resid 40 and name HN)   3.067 1.229 1.229

! residue 41 (i.e.  ...;41.HN,41.N)
assign (resid 42 and name HN) (resid 41 and name HN)   2.867 1.057 1.057
assign (resid 41 and name HB*) (resid 41 and name HN)   2.850 1.050 1.050
assign ((resid 40 and name HB2) or (resid 40 and name HB1)) (resid 41 and name HN)   3.270 1.276 1.276
assign ((resid 40 and name HB1) or (resid 40 and name HB2)) (resid 41 and name HN)   3.270 1.276 1.276

! residue 42 (i.e.  ...;42.HN,42.N)
assign (resid 42 and name HA) (resid 42 and name HN)   2.953 0.698 0.698
assign (resid 41 and name HB*) (resid 42 and name HN)   3.501 0.930 0.930
assign ((resid 42 and name HB2) or (resid 42 and name HB1)) (resid 42 and name HN)   2.700 0.643 0.643
assign ((resid 42 and name HB1) or (resid 42 and name HB2)) (resid 42 and name HN)   2.700 0.643 0.643
assign (resid 37 and name HG2*) (resid 42 and name HN)   3.580 0.972 0.972
assign (resid 41 and name HN) (resid 42 and name HN)   2.867 1.057 1.057
assign (resid 41 and name HG*) (resid 42 and name HN)   3.888 1.112 1.112

! residue 43 (i.e.  ...;43.HN,43.N)
assign ((resid 58 and name HD2*) or (resid 58 and name HD1*)) (resid 43 and name HN)   3.664 1.336 1.336
assign (resid 44 and name HN) (resid 43 and name HN)   3.194 1.207 1.207
assign ((resid 43 and name HA2) or (resid 43 and name HA1)) (resid 43 and name HN)   3.080 1.280 1.280
assign ((resid 43 and name HA1) or (resid 43 and name HA2)) (resid 43 and name HN)   3.080 1.280 1.280
assign ((resid 42 and name HB2) or (resid 42 and name HB1)) (resid 43 and name HN)   3.198 1.210 1.210

! residue 44 (i.e.  ...;44.HN,44.N)
assign (resid 44 and name HB) (resid 44 and name HN)   2.549 0.571 0.571
assign (resid 44 and name HA) (resid 44 and name HN)   2.952 0.691 0.691
assign (resid 43 and name HN) (resid 44 and name HN)   3.194 1.207 1.207
assign (resid 45 and name HN) (resid 44 and name HN)   2.745 0.740 0.740
assign ((resid 43 and name HA2) or (resid 43 and name HA1)) (resid 44 and name HN)   3.019 0.714 0.714

! residue 45 (i.e.  ...;45.HN,45.N)
assign (resid 45 and name HA) (resid 45 and name HN)   2.981 0.806 0.806
assign (resid 45 and name HB) (resid 45 and name HN)   2.514 0.625 0.625
assign ((resid 45 and name HG2*) or (resid 45 and name HG1*)) (resid 45 and name HN)   3.034 0.832 0.832
assign (resid 44 and name HN) (resid 45 and name HN)   2.745 0.740 0.740
assign (resid 44 and name HB) (resid 45 and name HN)   2.650 0.672 0.672

! residue 46 (i.e.  ...;46.HN,46.N)
assign ((resid 46 and name HG2) or (resid 46 and name HG1)) (resid 46 and name HN)   2.951 1.102 1.102
assign ((resid 46 and name HG1) or (resid 46 and name HG2)) (resid 46 and name HN)   2.951 1.102 1.102
assign ((resid 45 and name HG1*) or (resid 45 and name HG2*)) (resid 46 and name HN)   3.713 1.287 1.287

! residue 47 (i.e.  ...;47.HN,47.N)
assign (resid 48 and name HN) (resid 47 and name HN)   2.838 1.038 1.038

! residue 48 (i.e.  ...;48.HN,48.N)
assign (resid 49 and name HN) (resid 48 and name HN)   2.838 0.667 0.667
assign (resid 48 and name HA) (resid 48 and name HN)   2.943 0.653 0.653
assign ((resid 48 and name HG2) or (resid 48 and name HG1)) (resid 48 and name HN)   3.199 0.791 0.791
assign ((resid 48 and name HG1) or (resid 48 and name HG2)) (resid 48 and name HN)   3.199 0.791 0.791
assign ((resid 48 and name HB2) or (resid 48 and name HB1)) (resid 48 and name HN)   2.870 0.712 0.712
assign ((resid 48 and name HB1) or (resid 48 and name HB2)) (resid 48 and name HN)   2.870 0.712 0.712
assign (resid 48 and name HE*) (resid 48 and name HN)   4.088 0.912 0.912
assign ((resid 47 and name HB1) or (resid 47 and name HB2)) (resid 48 and name HN)   3.079 0.694 0.694
assign (resid 50 and name HN) (resid 48 and name HN)   3.466 0.831 0.831
assign (resid 45 and name HA) (resid 48 and name HN)   3.499 0.844 0.844

! residue 49 (i.e.  ...;49.HN,49.N)
assign (resid 48 and name HN) (resid 49 and name HN)   2.838 0.667 0.667
assign (resid 50 and name HN) (resid 49 and name HN)   2.703 0.903 0.903
assign (resid 49 and name HA) (resid 49 and name HN)   2.952 0.693 0.693
assign (resid 48 and name HA) (resid 49 and name HN)   3.443 0.892 0.892

! residue 50 (i.e.  ...;50.HN,50.N)
assign (resid 51 and name HN) (resid 50 and name HN)   2.666 0.866 0.866
assign (resid 49 and name HN) (resid 50 and name HN)   2.703 0.903 0.903
assign (resid 49 and name HA) (resid 50 and name HN)   3.205 1.213 1.213
assign ((resid 50 and name HA1) or (resid 50 and name HA2)) (resid 50 and name HN)   2.565 0.765 0.765
assign ((resid 49 and name HB1) or (resid 49 and name HB2)) (resid 50 and name HN)   3.492 1.366 1.366

! residue 51 (i.e.  ...;51.HN,51.N)
assign (resid 51 and name HA) (resid 51 and name HN)   2.950 0.685 0.685
assign ((resid 51 and name HB1) or (resid 51 and name HB2)) (resid 51 and name HN)   2.755 0.625 0.625

! residue 52 (i.e.  ...;52.HN,52.N)
assign (resid 51 and name HA) (resid 52 and name HN)   3.014 1.214 1.214
assign ((resid 52 and name HB2) or (resid 52 and name HB1)) (resid 52 and name HN)   3.400 1.600 1.600
assign ((resid 52 and name HB1) or (resid 52 and name HB2)) (resid 52 and name HN)   3.400 1.600 1.600

! residue 54 (i.e.  ...;54.HN,54.N)
assign (resid 53 and name HA) (resid 54 and name HN)   3.005 1.205 1.205
assign ((resid 57 and name HB2) or (resid 57 and name HB1)) (resid 54 and name HN)   3.400 1.600 1.600
assign ((resid 57 and name HB1) or (resid 57 and name HB2)) (resid 54 and name HN)   3.400 1.600 1.600
assign (resid 54 and name HG2*) (resid 54 and name HN)   3.438 1.562 1.562

! residue 55 (i.e.  ...;55.HN,55.N)
assign ((resid 55 and name HB1) or (resid 55 and name HB2)) (resid 55 and name HN)   2.971 1.103 1.103

! residue 56 (i.e.  ...;56.HN,56.N)
assign (resid 56 and name HA) (resid 56 and name HN)   2.971 0.769 0.769
assign (resid 57 and name HN) (resid 56 and name HN)   2.987 0.794 0.794
assign ((resid 56 and name HB2) or (resid 56 and name HB1)) (resid 56 and name HN)   2.825 0.787 0.787
assign ((resid 56 and name HB1) or (resid 56 and name HB2)) (resid 56 and name HN)   2.825 0.787 0.787
assign ((resid 55 and name HB1) or (resid 55 and name HB2)) (resid 56 and name HN)   2.960 0.764 0.764

! residue 57 (i.e.  ...;57.HN,57.N)
assign (resid 56 and name HN) (resid 57 and name HN)   2.987 0.794 0.794
assign (resid 58 and name HN) (resid 57 and name HN)   2.741 0.723 0.723
assign (resid 57 and name HA) (resid 57 and name HN)   2.969 0.762 0.762
assign ((resid 57 and name HB2) or (resid 57 and name HB1)) (resid 57 and name HN)   2.637 0.640 0.640
assign (resid 57 and name HG*) (resid 57 and name HN)   3.158 0.847 0.847

! residue 58 (i.e.  ...;58.HN,58.N)
assign (resid 58 and name HA) (resid 58 and name HN)   2.965 0.748 0.748
assign (resid 57 and name HN) (resid 58 and name HN)   2.741 0.723 0.723
assign ((resid 57 and name HB2) or (resid 57 and name HB1)) (resid 58 and name HN)   3.020 0.770 0.770

! residue 59 (i.e.  ...;59.HN,59.N)
assign ((resid 59 and name HB2) or (resid 59 and name HB1)) (resid 59 and name HN)   3.154 1.324 1.324
assign ((resid 58 and name HB1) or (resid 58 and name HB2)) (resid 59 and name HN)   3.298 1.339 1.339
assign (resid 58 and name HN) (resid 59 and name HN)   3.035 1.132 1.132
assign (resid 60 and name HN) (resid 59 and name HN)   3.113 1.206 1.206
assign ((resid 59 and name HB1) or (resid 59 and name HB2)) (resid 59 and name HN)   3.154 1.324 1.324
assign ((resid 58 and name HB2) or (resid 58 and name HB1)) (resid 59 and name HN)   3.298 1.339 1.339

! residue 60 (i.e.  ...;60.HN,60.N)
assign (resid 59 and name HN) (resid 60 and name HN)   3.113 1.206 1.206
assign (resid 61 and name HN) (resid 60 and name HN)   3.031 1.130 1.130
assign ((resid 59 and name HB1) or (resid 59 and name HB2)) (resid 60 and name HN)   3.417 1.394 1.394
assign ((resid 59 and name HB2) or (resid 59 and name HB1)) (resid 60 and name HN)   3.417 1.394 1.394
assign (resid 60 and name HB*) (resid 60 and name HN)   3.265 1.243 1.243

! residue 61 (i.e.  ...;61.HN,61.N)
assign (resid 61 and name HA) (resid 61 and name HN)   2.972 0.772 0.772
assign (resid 60 and name HN) (resid 61 and name HN)   3.031 1.130 1.130

! residue 62 (i.e.  ...;62.HN,62.N)
assign (resid 63 and name HN) (resid 62 and name HN)   3.015 0.927 0.927
assign ((resid 62 and name HG12) or (resid 62 and name HG11)) (resid 62 and name HN)   2.630 0.648 0.648
assign (resid 62 and name HA) (resid 62 and name HN)   2.974 0.779 0.779

! residue 63 (i.e.  ...;63.HN,63.N)
assign (resid 62 and name HN) (resid 63 and name HN)   3.015 0.927 0.927
assign (resid 63 and name HA) (resid 63 and name HN)   2.989 0.838 0.838
assign ((resid 63 and name HB2) or (resid 63 and name HB1)) (resid 63 and name HN)   2.648 0.690 0.690

! residue 64 (i.e.  ...;64.HN,64.N)
assign ((resid 64 and name HB2) or (resid 64 and name HB1)) (resid 64 and name HN)   2.828 0.774 0.774
assign (resid 63 and name HN) (resid 64 and name HN)   3.079 0.777 0.777
assign (resid 65 and name HN) (resid 64 and name HN)   3.056 0.922 0.922
assign (resid 64 and name HA) (resid 64 and name HN)   2.961 0.730 0.730
assign ((resid 64 and name HB1) or (resid 64 and name HB2)) (resid 64 and name HN)   2.828 0.774 0.774

! residue 65 (i.e.  ...;65.HN,65.N)
assign (resid 66 and name HN) (resid 65 and name HN)   2.543 0.620 0.620
assign (resid 64 and name HN) (resid 65 and name HN)   3.056 0.922 0.922
assign (resid 65 and name HA) (resid 65 and name HN)   2.974 0.779 0.779
assign ((resid 65 and name HG2*) or (resid 65 and name HG1*)) (resid 65 and name HN)   3.158 0.866 0.866

! residue 66 (i.e.  ...;66.HN,66.N)
assign ((resid 66 and name HB2) or (resid 66 and name HB1)) (resid 66 and name HN)   3.328 1.276 1.276

! residue 67 (i.e.  ...;67.HN,67.N)
assign (resid 68 and name HN) (resid 67 and name HN)   2.826 0.650 0.650
assign (resid 67 and name HA) (resid 67 and name HN)   2.952 0.690 0.690
assign ((resid 67 and name HG2) or (resid 67 and name HG1)) (resid 67 and name HN)   3.012 0.711 0.711
assign ((resid 67 and name HB1) or (resid 67 and name HB2)) (resid 67 and name HN)   2.837 0.653 0.653

! residue 68 (i.e.  ...;68.HN,68.N)
assign (resid 69 and name HN) (resid 68 and name HN)   2.666 0.866 0.866
assign (resid 67 and name HA) (resid 68 and name HN)   3.090 1.290 1.290
assign ((resid 68 and name HB1) or (resid 68 and name HB2)) (resid 68 and name HN)   2.947 1.147 1.147

! residue 69 (i.e.  ...;69.HN,69.N)
assign (resid 70 and name HN) (resid 69 and name HN)   2.777 0.977 0.977
assign (resid 68 and name HN) (resid 69 and name HN)   2.666 0.866 0.866
assign ((resid 69 and name HA1) or (resid 69 and name HA2)) (resid 69 and name HN)   2.599 0.799 0.799

! residue 70 (i.e.  ...;70.HN,70.N)
assign (resid 71 and name HN) (resid 70 and name HN)   2.981 1.181 1.181
assign (resid 68 and name HN) (resid 70 and name HN)   3.542 1.395 1.395
assign (resid 69 and name HN) (resid 70 and name HN)   2.777 0.977 0.977
assign ((resid 70 and name HB1) or (resid 70 and name HB2)) (resid 70 and name HN)   2.748 0.947 0.947
assign ((resid 69 and name HA2) or (resid 69 and name HA1)) (resid 70 and name HN)   3.108 1.225 1.225
assign ((resid 69 and name HA1) or (resid 69 and name HA2)) (resid 70 and name HN)   3.108 1.225 1.225

! residue 71 (i.e.  ...;71.HN,71.N)
assign ((resid 71 and name HA1) or (resid 71 and name HA2)) (resid 71 and name HN)   3.167 1.313 1.313
assign (resid 70 and name HN) (resid 71 and name HN)   2.981 1.181 1.181
assign (resid 72 and name HN) (resid 71 and name HN)   2.847 1.047 1.047
assign ((resid 71 and name HA2) or (resid 71 and name HA1)) (resid 71 and name HN)   3.167 1.313 1.313

! residue 72 (i.e.  ...;72.HN,72.N)
assign (resid 71 and name HN) (resid 72 and name HN)   2.847 1.047 1.047
assign (resid 70 and name HN) (resid 72 and name HN)   3.281 0.870 0.870
assign (resid 72 and name HA) (resid 72 and name HN)   2.961 0.731 0.731
assign ((resid 71 and name HA2) or (resid 71 and name HA1)) (resid 72 and name HN)   3.155 0.811 0.811
assign (resid 72 and name HG2*) (resid 72 and name HN)   3.461 0.965 0.965

! residue 73 (i.e.  ...;73.HN,73.N)
assign (resid 73 and name HA) (resid 73 and name HN)   2.978 0.796 0.796
assign (resid 37 and name HN) (resid 73 and name HN)   2.757 0.756 0.756
assign (resid 72 and name HA) (resid 73 and name HN)   2.408 0.587 0.587
assign (resid 72 and name HB) (resid 73 and name HN)   2.661 0.669 0.669
assign (resid 73 and name HB) (resid 73 and name HN)   2.593 0.646 0.646
assign (resid 37 and name HB) (resid 73 and name HN)   2.883 0.755 0.755
assign ((resid 73 and name HG12) or (resid 73 and name HG11)) (resid 73 and name HN)   2.917 0.769 0.769

! residue 74 (i.e.  ...;74.HN,74.N)
assign ((resid 77 and name HB1) or (resid 77 and name HB2)) (resid 74 and name HN)   2.932 0.882 0.882
assign (resid 74 and name HA) (resid 74 and name HN)   2.968 0.756 0.756
assign (resid 73 and name HA) (resid 74 and name HN)   2.262 0.462 0.462
assign ((resid 74 and name HB1) or (resid 74 and name HB2)) (resid 74 and name HN)   3.146 0.835 0.835
assign ((resid 77 and name HB2) or (resid 77 and name HB1)) (resid 74 and name HN)   2.932 0.882 0.882
assign (resid 73 and name HG2*) (resid 74 and name HN)   3.798 1.202 1.202

! residue 75 (i.e.  ...;75.HN,75.N)
assign (resid 76 and name HN) (resid 75 and name HN)   3.007 0.803 0.803
assign (resid 74 and name HA) (resid 75 and name HN)   2.716 0.616 0.616
assign (resid 75 and name HA) (resid 75 and name HN)   2.951 0.689 0.689
assign ((resid 74 and name HB2) or (resid 74 and name HB1)) (resid 75 and name HN)   2.759 0.796 0.796
assign ((resid 74 and name HB1) or (resid 74 and name HB2)) (resid 75 and name HN)   2.759 0.796 0.796
assign ((resid 75 and name HB2) or (resid 75 and name HB1)) (resid 75 and name HN)   2.620 0.607 0.607
assign ((resid 75 and name HB1) or (resid 75 and name HB2)) (resid 75 and name HN)   2.620 0.607 0.607

! residue 76 (i.e.  ...;76.HN,76.N)
assign (resid 76 and name HA) (resid 76 and name HN)   3.377 0.858 0.858
assign (resid 75 and name HN) (resid 76 and name HN)   3.007 0.803 0.803
assign (resid 77 and name HN) (resid 76 and name HN)   2.597 0.674 0.674
assign (resid 76 and name HA) (resid 76 and name HN)   2.952 0.691 0.691
assign (resid 76 and name HG*) (resid 76 and name HN)   2.847 0.657 0.657
assign ((resid 76 and name HB1) or (resid 76 and name HB2)) (resid 76 and name HN)   3.003 0.709 0.709

! residue 77 (i.e.  ...;77.HN,77.N)
assign (resid 77 and name HA) (resid 77 and name HN)   2.974 0.780 0.780
assign ((resid 77 and name HG1) or (resid 77 and name HG2)) (resid 77 and name HN)   2.815 0.886 0.886
assign ((resid 77 and name HB2) or (resid 77 and name HB1)) (resid 77 and name HN)   2.638 0.651 0.651
assign (resid 78 and name HN) (resid 77 and name HN)   2.806 0.804 0.804
assign (resid 76 and name HN) (resid 77 and name HN)   2.597 0.674 0.674
assign ((resid 77 and name HG2) or (resid 77 and name HG1)) (resid 77 and name HN)   2.815 0.886 0.886

! residue 78 (i.e.  ...;78.HN,78.N)
assign (resid 77 and name HN) (resid 78 and name HN)   2.806 0.804 0.804
assign (resid 79 and name HN) (resid 78 and name HN)   2.897 0.751 0.751
assign (resid 78 and name HA) (resid 78 and name HN)   2.948 0.676 0.676
assign ((resid 78 and name HB2) or (resid 78 and name HB1)) (resid 78 and name HN)   2.763 0.649 0.649
assign ((resid 78 and name HB1) or (resid 78 and name HB2)) (resid 78 and name HN)   2.763 0.649 0.649
assign ((resid 77 and name HB2) or (resid 77 and name HB1)) (resid 78 and name HN)   3.241 0.779 0.779
assign (resid 73 and name HG2*) (resid 78 and name HN)   3.635 0.957 0.957

! residue 79 (i.e.  ...;79.HN,79.N)
assign (resid 78 and name HN) (resid 79 and name HN)   2.897 0.751 0.751
assign (resid 80 and name HN) (resid 79 and name HN)   2.947 0.875 0.875
assign (resid 79 and name HA) (resid 79 and name HN)   2.961 0.731 0.731
assign ((resid 79 and name HB2) or (resid 79 and name HB1)) (resid 79 and name HN)   3.033 0.918 0.918
assign (resid 79 and name HG) (resid 79 and name HN)   2.612 0.613 0.613
assign ((resid 79 and name HB1) or (resid 79 and name HB2)) (resid 79 and name HN)   3.033 0.918 0.918

! residue 80 (i.e.  ...;80.HN,80.N)
assign (resid 79 and name HN) (resid 80 and name HN)   2.947 0.875 0.875
assign (resid 81 and name HN) (resid 80 and name HN)   2.853 0.704 0.704
assign (resid 80 and name HA) (resid 80 and name HN)   2.954 0.702 0.702
assign (resid 80 and name HB) (resid 80 and name HN)   2.456 0.553 0.553
assign (resid 10 and name HB*) (resid 80 and name HN)   3.952 1.048 1.048
assign ((resid 80 and name HG2*) or (resid 80 and name HG1*)) (resid 80 and name HN)   3.482 1.231 1.231
assign ((resid 80 and name HG1*) or (resid 80 and name HG2*)) (resid 80 and name HN)   3.482 1.231 1.231
assign ((resid 81 and name HG1) or (resid 81 and name HG2)) (resid 80 and name HN)   3.289 0.835 0.835

! residue 81 (i.e.  ...;81.HN,81.N)
assign (resid 81 and name HA) (resid 81 and name HN)   2.960 0.724 0.724
assign ((resid 81 and name HB1) or (resid 81 and name HB2)) (resid 81 and name HN)   2.696 0.634 0.634
assign (resid 81 and name HE*) (resid 81 and name HN)   3.836 1.164 1.164
assign (resid 80 and name HN) (resid 81 and name HN)   2.853 0.704 0.704

! residue 82 (i.e.  ...;82.HN,82.N)
assign (resid 83 and name HN) (resid 82 and name HN)   2.898 0.722 0.722
assign (resid 79 and name HA) (resid 82 and name HN)   3.141 0.824 0.824
assign ((resid 81 and name HB2) or (resid 81 and name HB1)) (resid 82 and name HN)   2.846 0.703 0.703
assign ((resid 82 and name HB2) or (resid 82 and name HB1)) (resid 82 and name HN)   2.828 0.852 0.852
assign ((resid 82 and name HB1) or (resid 82 and name HB2)) (resid 82 and name HN)   2.828 0.852 0.852
assign (resid 82 and name HA) (resid 82 and name HN)   2.966 0.748 0.748

! residue 83 (i.e.  ...;83.HN,83.N)
assign (resid 83 and name HA) (resid 83 and name HN)   2.957 0.712 0.712
assign (resid 84 and name HN) (resid 83 and name HN)   2.762 0.681 0.681
assign (resid 83 and name HB) (resid 83 and name HN)   2.450 0.556 0.556
assign ((resid 82 and name HB2) or (resid 82 and name HB1)) (resid 83 and name HN)   3.033 0.740 0.740
assign (resid 10 and name HB*) (resid 83 and name HN)   3.917 1.083 1.083
assign ((resid 83 and name HG2*) or (resid 83 and name HG1*)) (resid 83 and name HN)   3.624 1.376 1.376
assign ((resid 83 and name HG1*) or (resid 83 and name HG2*)) (resid 83 and name HN)   3.624 1.376 1.376

! residue 84 (i.e.  ...;84.HN,84.N)
assign (resid 83 and name HN) (resid 84 and name HN)   2.762 0.681 0.681
assign (resid 85 and name HN) (resid 84 and name HN)   3.017 0.770 0.770
assign (resid 84 and name HA) (resid 84 and name HN)   2.946 0.666 0.666
assign (resid 83 and name HA) (resid 84 and name HN)   3.442 0.844 0.844
assign (resid 83 and name HB) (resid 84 and name HN)   3.017 0.688 0.688
assign ((resid 84 and name HG1) or (resid 84 and name HG2)) (resid 84 and name HN)   3.412 0.831 0.831

! residue 85 (i.e.  ...;85.HN,85.N)
assign (resid 86 and name HN) (resid 85 and name HN)   2.784 0.984 0.984
assign (resid 85 and name HA) (resid 85 and name HN)   2.954 0.701 0.701
assign ((resid 85 and name HG2) or (resid 85 and name HG1)) (resid 85 and name HN)   3.356 0.863 0.863
assign ((resid 85 and name HB2) or (resid 85 and name HB1)) (resid 85 and name HN)   3.011 0.814 0.814
assign ((resid 85 and name HB1) or (resid 85 and name HB2)) (resid 85 and name HN)   3.011 0.814 0.814
assign (resid 84 and name HN) (resid 85 and name HN)   3.017 0.770 0.770
assign ((resid 86 and name HB2) or (resid 86 and name HB1)) (resid 85 and name HN)   3.361 0.865 0.865

! residue 86 (i.e.  ...;86.HN,86.N)
assign (resid 87 and name HN) (resid 86 and name HN)   2.778 0.978 0.978
assign (resid 85 and name HN) (resid 86 and name HN)   2.784 0.984 0.984
assign ((resid 86 and name HG2) or (resid 86 and name HG1)) (resid 86 and name HN)   2.840 1.040 1.040
assign (resid 83 and name HA) (resid 86 and name HN)   3.155 1.188 1.188
assign (resid 87 and name HD*) (resid 86 and name HN)   3.631 1.369 1.369

! residue 87 (i.e.  ...;87.HN,87.N)
assign ((resid 86 and name HB2) or (resid 86 and name HB1)) (resid 87 and name HN)   3.611 1.098 1.098
assign (resid 86 and name HA) (resid 87 and name HN)   3.454 0.814 0.814
assign (resid 87 and name HA) (resid 87 and name HN)   2.942 0.647 0.647
assign ((resid 86 and name HB1) or (resid 86 and name HB2)) (resid 87 and name HN)   3.611 1.098 1.098
assign ((resid 87 and name HB2) or (resid 87 and name HB1)) (resid 87 and name HN)   2.970 0.806 0.806
assign ((resid 87 and name HB1) or (resid 87 and name HB2)) (resid 87 and name HN)   2.970 0.806 0.806
assign ((resid 87 and name HG2) or (resid 87 and name HG1)) (resid 87 and name HN)   3.066 0.683 0.683

! residue 88 (i.e.  ...;88.HN,88.N)
assign (resid 87 and name HN) (resid 88 and name HN)   3.285 0.745 0.745
assign (resid 88 and name HA) (resid 88 and name HN)   2.940 0.641 0.641
assign ((resid 88 and name HG1) or (resid 88 and name HG2)) (resid 88 and name HN)   3.801 0.949 0.949
assign ((resid 88 and name HB2) or (resid 88 and name HB1)) (resid 88 and name HN)   3.266 0.906 0.906
assign ((resid 88 and name HB1) or (resid 88 and name HB2)) (resid 88 and name HN)   3.266 0.906 0.906

! residue 89 (i.e.  ...;89.HN,89.N)
assign (resid 88 and name HN) (resid 89 and name HN)   3.257 1.457 1.457
assign (resid 88 and name HA) (resid 89 and name HN)   3.009 1.209 1.209
assign ((resid 89 and name HB2) or (resid 89 and name HB1)) (resid 89 and name HN)   3.400 1.600 1.600
assign ((resid 89 and name HB1) or (resid 89 and name HB2)) (resid 89 and name HN)   3.400 1.600 1.600
assign ((resid 88 and name HB2) or (resid 88 and name HB1)) (resid 89 and name HN)   3.400 1.600 1.600
assign ((resid 88 and name HB1) or (resid 88 and name HB2)) (resid 89 and name HN)   3.400 1.600 1.600
assign (resid 90 and name HN) (resid 89 and name HN)   3.365 1.565 1.565

! residue 90 (i.e.  ...;90.HN,90.N)
assign (resid 89 and name HA) (resid 90 and name HN)   2.919 0.663 0.663
assign (resid 90 and name HA) (resid 90 and name HN)   2.947 0.672 0.672
assign (resid 90 and name HB*) (resid 90 and name HN)   3.075 0.713 0.713
assign (resid 115 and name HB1) (resid 115 and name HA) 3.400 1.6 0.0 !   noesyaria.263
assign (resid 115 and name HA) (resid 115 and name HD1) 5.000 3.2 0.0 !   noesyaria.204
assign (resid 115 and name HA) (resid 116 and name HN) 5.000 3.2 0.0 !   noesyaria.131
assign (resid 116 and name HA) (resid 116 and name HG2) 5.000 3.2 0.0 !   noesyaria.198
assign (resid 116 and name HE1) (resid 116 and name HG2) 5.000 3.2 0.0 !   noesyaria.229
assign (resid 116 and name HA) (resid 116 and name HN) 3.400 1.6 0.0 !   noesyaria.130
assign (resid 116 and name HA) (resid 117 and name HN) 5.000 3.2 0.0 !   noesyaria.0
assign (resid 117 and name HA) (resid 117 and name HN) 5.000 3.2 0.0 !   noesyaria.1
assign (resid 117 and name HA) (resid 118 and name HN) 5.000 3.2 0.0 !   noesyaria.116
assign (resid 118 and name HB#) (resid 118 and name HN) 5.000 3.2 0.0 !   noesyaria.115
assign (resid 118 and name HA) (resid 119 and name HN) 5.000 3.2 0.0 !   noesyaria.26
assign (resid 118 and name HB#) (resid 119 and name HN) 5.000 3.2 0.0 !   noesyaria.89
assign (resid 119 and name HA) (resid 119 and name HN) 3.400 1.6 0.0 !   noesyaria.3
assign (resid 119 and name HB1) (resid 119 and name HN) 2.800 1.0 0.0 !   noesyaria.46
assign (resid 117 and name HA) (resid 120 and name HN) 5.000 3.2 0.0 !   noesyaria.2
assign (resid 120 and name HA) (resid 119 and name HB1) 5.000 3.2 0.0 !   noesyaria.210
assign (resid 119 and name HA) (resid 120 and name HN) 5.000 3.2 0.0 !   noesyaria.7
assign (resid 119 and name HB1) (resid 120 and name HN) 3.400 1.6 0.0 !   noesyaria.47
assign (resid 120 and name HN) (resid 119 and name HN) 5.000 3.2 0.0 !   noesyaria.337
assign (resid 120 and name HA) (resid 120 and name HB#) 2.800 1.0 0.0 !   noesyaria.162
assign (resid 120 and name HB#) (resid 120 and name HN) 3.400 1.6 0.0 !   noesyaria.88
assign (resid 118 and name HA) (resid 121 and name HE1) 5.000 3.2 0.0 !   noesyaria.347
assign (resid 118 and name HA) (resid 121 and name HN) 5.000 3.2 0.0 !   noesyaria.27
assign (resid 119 and name HA) (resid 121 and name HN) 5.000 3.2 0.0 !   noesyaria.8
assign (resid 120 and name HA) (resid 121 and name HN) 5.000 3.2 0.0 !   noesyaria.36
assign (resid 120 and name HB#) (resid 121 and name HN) 5.000 3.2 0.0 !   noesyaria.86
assign (resid 121 and name HN) (resid 120 and name HN) 5.000 3.2 0.0 !   noesyaria.118
assign (resid 121 and name HA) (resid 121 and name HE1) 5.000 3.2 0.0 !   noesyaria.346
assign (resid 121 and name HA) (resid 121 and name HN) 3.400 1.6 0.0 !   noesyaria.17
assign (resid 121 and name HB1) (resid 121 and name HN) 5.000 3.2 0.0 !   noesyaria.48
assign (resid 121 and name HG1) (resid 121 and name HN) 5.000 3.2 0.0 !   noesyaria.45
assign (resid 119 and name HA) (resid 122 and name HN) 5.000 3.2 0.0 !   noesyaria.9
assign (resid 121 and name HA) (resid 122 and name HN) 5.000 3.2 0.0 !   noesyaria.20
assign (resid 121 and name HN) (resid 122 and name HN) 5.000 3.2 0.0 !   noesyaria.339
assign (resid 122 and name HA) (resid 122 and name HD1#) 3.400 1.6 0.0 !   noesyaria.159
assign (resid 120 and name HA) (resid 123 and name HB1) 3.400 1.6 0.0 !   noesyaria.163
assign (resid 120 and name HA) (resid 123 and name HN) 3.400 1.6 0.0 !   noesyaria.32
assign (resid 123 and name HA) (resid 123 and name HN) 3.400 1.6 0.0 !   noesyaria.41
assign (resid 123 and name HB1) (resid 123 and name HN) 2.800 1.0 0.0 !   noesyaria.55
assign (resid 123 and name HG1) (resid 123 and name HN) 5.000 3.2 0.0 !   noesyaria.83
assign (resid 120 and name HA) (resid 124 and name HN) 5.000 3.2 0.0 !   noesyaria.33
assign (resid 121 and name HA) (resid 124 and name HN) 5.000 3.2 0.0 !   noesyaria.21
assign (resid 123 and name HA) (resid 124 and name HN) 5.000 3.2 0.0 !   noesyaria.38
assign (resid 123 and name HB1) (resid 124 and name HN) 5.000 3.2 0.0 !   noesyaria.54
assign (resid 124 and name HN) (resid 123 and name HN) 5.000 3.2 0.0 !   noesyaria.128
assign (resid 124 and name HA) (resid 124 and name HN) 3.400 1.6 0.0 !   noesyaria.29
assign (resid 124 and name HB#) (resid 124 and name HN) 2.800 1.0 0.0 !   noesyaria.94
assign (resid 125 and name HD1#) (resid 124 and name HB#) 5.000 3.2 0.0 !   noesyaria.183
assign (resid 125 and name HD2#) (resid 124 and name HB#) 5.000 3.2 0.0 !   noesyaria.184
assign (resid 124 and name HB#) (resid 125 and name HN) 3.400 1.6 0.0 !   noesyaria.93
assign (resid 125 and name HA) (resid 125 and name HD1#) 5.000 3.2 0.0 !   noesyaria.146
assign (resid 125 and name HA) (resid 125 and name HD2#) 2.800 1.0 0.0 !   noesyaria.151
assign (resid 125 and name HA) (resid 125 and name HG) 3.400 1.6 0.0 !   noesyaria.150
assign (resid 125 and name HD1#) (resid 125 and name HG) 3.400 1.6 0.0 !   noesyaria.186
assign (resid 125 and name HD1#) (resid 125 and name HN) 5.000 3.2 0.0 !   noesyaria.102
assign (resid 125 and name HD2#) (resid 125 and name HN) 5.000 3.2 0.0 !   noesyaria.108
assign (resid 125 and name HG) (resid 125 and name HN) 3.400 1.6 0.0 !   noesyaria.76
assign (resid 122 and name HA) (resid 126 and name HN) 5.000 3.2 0.0 !   noesyaria.31
assign (resid 123 and name HA) (resid 126 and name HN) 5.000 3.2 0.0 !   noesyaria.39
assign (resid 125 and name HA) (resid 126 and name HN) 5.000 3.2 0.0 !   noesyaria.22
assign (resid 125 and name HG) (resid 126 and name HN) 5.000 3.2 0.0 !   noesyaria.75
assign (resid 125 and name HN) (resid 126 and name HN) 3.400 1.6 0.0 !   noesyaria.120
assign (resid 126 and name HA) (resid 126 and name HD2#) 2.800 1.0 0.0 !   noesyaria.139
assign (resid 126 and name HG) (resid 126 and name HA) 3.400 1.6 0.0 !   noesyaria.274
assign (resid 126 and name HA) (resid 126 and name HN) 2.800 1.0 0.0 !   noesyaria.12
assign (resid 126 and name HG) (resid 126 and name HN) 5.000 3.2 0.0 !   noesyaria.81
assign (resid 128 and name HA) (resid 128 and name HN) 5.000 3.2 0.0 !   noesyaria.4
assign (resid 49 and name HG) (resid 125 and name HD##) 4.00 2.00 2.00 !nc2_round_new4.35
assign (resid 49 and name HD##) (resid 125 and name HD##) 4.00 2.00 2.00 !nc2_round_new4.36
assign (resid 49 and name HD##) (resid 125 and name HG) 4.00 2.00 2.00 !nc2_round_new4.37
assign (resid 49 and name HD##) (resid 124 and name HB#) 4.00 2.00 2.00 !nc2_round_new4.38
assign (resid 49 and name HD##) (resid 121 and name HE#) 4.00 2.00 2.00 !nc2_round_new4.39
assign (resid 49 and name HD##) (resid 125 and name HB#) 4.00 2.00 2.00 !nc2_round_new4.40
assign (resid 49 and name HD##) (resid 121 and name HG#) 4.00 2.00 2.00 !nc2_round_new4.60
assign (resid 49 and name HD##) (resid 121 and name HE#) 4.00 2.00 2.00 !nc2_round_new4.61
assign (resid 49 and name HD##) (resid 125 and name HB#) 4.00 2.00 2.00 !nc2_round_new4.62
assign (resid 49 and name HD##) (resid 125 and name HG) 4.00 2.00 2.00 !nc2_round_new4.63
assign (resid 49 and name HD##) (resid 124 and name HB#) 4.00 2.00 2.00 !nc2_round_new4.64
assign (resid 49 and name HD##) (resid 125 and name HD##) 4.00 2.00 2.00 !nc2_round_new4.65
assign (resid 45 and name HG##) (resid 125 and name HD##) 4.00 2.00 2.00 !nc2_round_new4.66
assign (resid 45 and name HG##) (resid 125 and name HD##) 4.00 2.00 2.00 !nc2_round_new4.76
assign (resid 82 and name HE#) (resid 122 and name HB#) 4.00 2.00 2.00 !nc2_round_new4.96
assign (resid 82 and name HE#) (resid 118 and name HA) 4.00 2.00 2.00 !nc2_round_new4.97
assign (resid 82 and name HE#) (resid 119 and name HB#) 4.00 2.00 2.00 !nc2_round_new4.98
assign (resid 82 and name HE#) (resid 121 and name HE#) 4.00 2.00 2.00 !nc2_round_new4.99
assign (resid 82 and name HE#) (resid 122 and name HD##) 4.00 2.00 2.00 !nc2_round_new4.101
assign (resid 25 and name HB#) (resid 121 and name HE#) 4.00 2.00 2.00 !nc2_round_new4.103
assign (resid 25 and name HB#) (resid 124 and name HB#) 4.00 2.00 2.00 !nc2_round_new4.104
assign (resid 25 and name HB#) (resid 125 and name HD##) 4.00 2.00 2.00 !nc2_round_new4.105
assign (resid 86 and name HE#) (resid 118 and name HB#) 4.00 2.00 2.00 !nc2_round_new4.134
assign (resid 18 and name HE#) (resid 117 and name HA) 4.00 2.00 2.00 !nc2_round_new4.135
assign (resid 18 and name HE#) (resid 117 and name HB#) 4.00 2.00 2.00 !nc2_round_new4.136
assign (resid 18 and name HE#) (resid 118 and name HB#) 4.00 2.00 2.00 !nc2_round_new4.139
assign (resid 46 and name HE#) (resid 122 and name HD##) 4.00 2.00 2.00 !nc2_round_new4.143
assign (resid 24 and name HB#) (resid 121 and name HG#) 4.00 2.00 2.00 !nc2_round_new4.145
assign (resid 48 and name HE#) (resid 125 and name HB#) 4.00 2.00 2.00 !nc2_round_new4.152
assign (resid 48 and name HE#) (resid 124 and name HB#) 4.00 2.00 2.00 !nc2_round_new4.153
assign (resid 48 and name HE#) (resid 125 and name HD##) 4.00 2.00 2.00 !nc2_round_new4.154
assign (resid 28 and name HE#) (resid 125 and name HA) 4.00 2.00 2.00 !nc2_round_new4.155
assign (resid 18 and name HE#) (resid 118 and name HB#) 4.00 2.00 2.00 !nc2_round_new4.159
assign (resid 46 and name HE#) (resid 115 and name HA) 4.00 2.00 2.00 !nc2_round_new4.161
assign (resid 81 and name HE#) (resid 115 and name HA) 4.00 2.00 2.00 !nc2_round_new4.162
assign (resid 81 and name HE#) (resid 122 and name HD##) 4.00 2.00 2.00 !nc2_round_new4.165
assign (resid 61 and name HD1#) (resid 115 and name HA) 4.00 2.00 2.00 !nc2_round_new4.180
assign (resid 61 and name HG2#) (resid 115 and name HB#) 4.00 2.00 2.00 !nc2_round_new4.270
assign (resid 86 and name HE#) (resid 122 and name HD##) 4.00 2.00 2.00 !nc2_round_new4.271
assign (resid 48 and name HE#) (resid 125 and name HG) 4.00 2.00 2.00 !nc2_round_new4.272
assign (resid 49 and name HD##) (resid 121 and name HG#) 4.00 2.00 2.00 !nc2_round_new4.273
assign (resid 25 and name HB#) (resid 121 and name HG#) 4.00 2.00 2.00 !nc2_round_new4.275
assign (resid 45 and name HG##) (resid 121 and name HE#) 4.00 2.00 2.00 !nc2_round_new4.276
assign (resid 45 and name HG##) (resid 125 and name HB#) 4.00 2.00 2.00 !nc2_round_new4.277
assign (resid 18 and name HE#) (resid 117 and name HB#) 4.00 2.00 2.00 !nc2_round_new4.278
assign (resid 18 and name HE#) (resid 116 and name HG#) 4.00 2.00 2.00 !nc2_round_new4.279
assign (resid 86 and name HE#) (resid 116 and name HG#) 4.00 2.00 2.00 !nc2_round_new4.280
assign (resid 48 and name HE#) (resid 121 and name HG#) 4.00 2.00 2.00 !nc2_round_new4.282
assign (resid 61 and name HG2#) (resid 115 and name HA) 4.00 2.00 2.00 !nc2_round_new4.283
assign (resid 46 and name HE#) (resid 118 and name HB#) 4.00 2.00 2.00 !nc2_round_new4.284
assign (resid 48 and name HE#) (resid 125 and name HA) 4.00 2.00 2.00 !nc2_round_new4.285
assign (resid 61 and name HD1#) (resid 115 and name HB#) 4.00 2.00 2.00 !nc2_round_new4.287
assign (resid 49 and name HD##) (resid 121 and name HA) 4.00 2.00 2.00 !nc2_round_new4.59
or (resid 49 and name HD##) (resid 124 and name HA)

assign (resid 82 and name HE#) (resid 118 and name HB#) 4.00 2.00 2.00 !nc2_round_new4.100
or (resid 82 and name HE#) (resid 122 and name HG)

assign (resid 24 and name HB#) (resid 122 and name HD##) 4.00 2.00 2.00 !nc2_round_new4.144
or (resid 24 and name HB#) (resid 126 and name HD##)
or (resid 20 and name HB#) (resid 126 and name HD##)

assign (resid 28 and name HE#) (resid 125 and name HD##) 4.00 2.00 2.00 !nc2_round_new4.160
or (resid 18 and name HE#) (resid 122 and name HD##)

assign (resid 81 and name HE#) (resid 118 and name HB#) 4.00 2.00 2.00 !nc2_round_new4.166
or (resid 81 and name HE#) (resid 122 and name HG)

assign (resid 49 and name HD##) (resid 125 and name HA) 4.00 2.00 2.00 !nc2_round_new4.274
or (resid 49 and name HD##) (resid 121 and name HA)

assign (resid 18 and name HE#) (resid 119 and name HB#) 4.00 2.00 2.00 !nc2_round_new4.281
or (resid 18 and name HE#) (resid 116 and name HG#)

! phi and psi dihedral restraint file generated by Talos2Aria.py
!
! TALOS filename:
! finalpred.tab
!
! settings: min phiError=None, min psiError=None, errorFactor=2.5
!


! Talos derived phi restraint:
assign (resid   5 and name C)
       (resid   6 and name N)
       (resid   6 and name CA)
       (resid   6 and name C)
1.0 -61 30 2

! Talos derived phi restraint:
assign (resid   6 and name C)
       (resid   7 and name N)
       (resid   7 and name CA)
       (resid   7 and name C)
1.0 -63 30 2

! Talos derived phi restraint:
assign (resid   7 and name C)
       (resid   8 and name N)
       (resid   8 and name CA)
       (resid   8 and name C)
1.0 -60 30 2

! Talos derived phi restraint:
assign (resid   8 and name C)
       (resid   9 and name N)
       (resid   9 and name CA)
       (resid   9 and name C)
1.0 -64 30 2

! Talos derived phi restraint:
assign (resid   9 and name C)
       (resid  10 and name N)
       (resid  10 and name CA)
       (resid  10 and name C)
1.0 -61 30 2

! Talos derived phi restraint:
assign (resid  10 and name C)
       (resid  11 and name N)
       (resid  11 and name CA)
       (resid  11 and name C)
1.0 -62 30 2

! Talos derived phi restraint:
assign (resid  11 and name C)
       (resid  12 and name N)
       (resid  12 and name CA)
       (resid  12 and name C)
       1.0 -68  30 2

! Talos derived phi restraint:
assign (resid  14 and name C)
       (resid  15 and name N)
       (resid  15 and name CA)
       (resid  15 and name C)
       1.0 -113  74 2

! Talos derived phi restraint:
assign (resid  15 and name C)
       (resid  16 and name N)
       (resid  16 and name CA)
       (resid  16 and name C)
1.0 -59 30 2

! Talos derived phi restraint:
assign (resid  16 and name C)
       (resid  17 and name N)
       (resid  17 and name CA)
       (resid  17 and name C)
1.0 -64 30 2

! Talos derived phi restraint:
assign (resid  17 and name C)
       (resid  18 and name N)
       (resid  18 and name CA)
       (resid  18 and name C)
1.0 -64 30 2

! Talos derived phi restraint:
assign (resid  18 and name C)
       (resid  19 and name N)
       (resid  19 and name CA)
       (resid  19 and name C)
1.0 -63 30 2

! Talos derived phi restraint:
assign (resid  19 and name C)
       (resid  20 and name N)
       (resid  20 and name CA)
       (resid  20 and name C)
1.0 -61 30 2

! Talos derived phi restraint:
assign (resid  20 and name C)
       (resid  21 and name N)
       (resid  21 and name CA)
       (resid  21 and name C)
1.0 -65 30 2

! Talos derived phi restraint:
assign (resid  21 and name C)
       (resid  22 and name N)
       (resid  22 and name CA)
       (resid  22 and name C)
1.0 -60 30 2

! Talos derived phi restraint:
assign (resid  22 and name C)
       (resid  23 and name N)
       (resid  23 and name CA)
       (resid  23 and name C)
1.0 -66 30 2

! Talos derived phi restraint:
assign (resid  23 and name C)
       (resid  24 and name N)
       (resid  24 and name CA)
       (resid  24 and name C)
1.0 -62 30 2

! Talos derived phi restraint:
assign (resid  24 and name C)
       (resid  25 and name N)
       (resid  25 and name CA)
       (resid  25 and name C)
1.0 -66 30 2

! Talos derived phi restraint:
assign (resid  25 and name C)
       (resid  26 and name N)
       (resid  26 and name CA)
       (resid  26 and name C)
       1.0 -61  30 2

! Talos derived phi restraint:
assign (resid  26 and name C)
       (resid  27 and name N)
       (resid  27 and name CA)
       (resid  27 and name C)
1.0 -61 30 2

! Talos derived phi restraint:
assign (resid  27 and name C)
       (resid  28 and name N)
       (resid  28 and name CA)
       (resid  28 and name C)
1.0 -63 30 2

! Talos derived phi restraint:
assign (resid  28 and name C)
       (resid  29 and name N)
       (resid  29 and name CA)
       (resid  29 and name C)
       1.0 -70  35 2

! Talos derived phi restraint:
assign (resid  36 and name C)
       (resid  37 and name N)
       (resid  37 and name CA)
       (resid  37 and name C)
       1.0 -111  37 2

! Talos derived phi restraint:
assign (resid  37 and name C)
       (resid  38 and name N)
       (resid  38 and name CA)
       (resid  38 and name C)
       1.0 -106  73 2

! Talos derived phi restraint:
assign (resid  38 and name C)
       (resid  39 and name N)
       (resid  39 and name CA)
       (resid  39 and name C)
1.0 -62 30 2

! Talos derived phi restraint:
assign (resid  39 and name C)
       (resid  40 and name N)
       (resid  40 and name CA)
       (resid  40 and name C)
1.0 -61 30 2

! Talos derived phi restraint:
assign (resid  40 and name C)
       (resid  41 and name N)
       (resid  41 and name CA)
       (resid  41 and name C)
1.0 -65 30 2

! Talos derived phi restraint:
assign (resid  41 and name C)
       (resid  42 and name N)
       (resid  42 and name CA)
       (resid  42 and name C)
1.0 -59 30 2

! Talos derived phi restraint:
assign (resid  42 and name C)
       (resid  43 and name N)
       (resid  43 and name CA)
       (resid  43 and name C)
1.0 -64 30 2

! Talos derived phi restraint:
assign (resid  43 and name C)
       (resid  44 and name N)
       (resid  44 and name CA)
       (resid  44 and name C)
1.0 -66 30 2

! Talos derived phi restraint:
assign (resid  44 and name C)
       (resid  45 and name N)
       (resid  45 and name CA)
       (resid  45 and name C)
1.0 -63 30 2

! Talos derived phi restraint:
assign (resid  46 and name C)
       (resid  47 and name N)
       (resid  47 and name CA)
       (resid  47 and name C)
1.0 -59 30 2

! Talos derived phi restraint:
assign (resid  47 and name C)
       (resid  48 and name N)
       (resid  48 and name CA)
       (resid  48 and name C)
       1.0 -64  30 2

! Talos derived phi restraint:
assign (resid  50 and name C)
       (resid  51 and name N)
       (resid  51 and name CA)
       (resid  51 and name C)
       1.0 -125  57 2

! Talos derived phi restraint:
assign (resid  51 and name C)
       (resid  52 and name N)
       (resid  52 and name CA)
       (resid  52 and name C)
       1.0 -102  42 2

! Talos derived phi restraint:
assign (resid  52 and name C)
       (resid  53 and name N)
       (resid  53 and name CA)
       (resid  53 and name C)
       1.0 -75  44 2

! Talos derived phi restraint:
assign (resid  53 and name C)
       (resid  54 and name N)
       (resid  54 and name CA)
       (resid  54 and name C)
       1.0 -103  77 2

! Talos derived phi restraint:
assign (resid  55 and name C)
       (resid  56 and name N)
       (resid  56 and name CA)
       (resid  56 and name C)
1.0 -61 30 2

!adjusted to +/-35
! Talos derived phi restraint:
assign (resid  56 and name C)
       (resid  57 and name N)
       (resid  57 and name CA)
       (resid  57 and name C)
       1.0 -64  35 2

! Talos derived phi restraint:
assign (resid  57 and name C)
       (resid  58 and name N)
       (resid  58 and name CA)
       (resid  58 and name C)
1.0 -61 30 2

! Talos derived phi restraint:
assign (resid  58 and name C)
       (resid  59 and name N)
       (resid  59 and name CA)
       (resid  59 and name C)
1.0 -62 30 2

! Talos derived phi restraint:
assign (resid  59 and name C)
       (resid  60 and name N)
       (resid  60 and name CA)
       (resid  60 and name C)
1.0 -65 30 2

! Talos derived phi restraint:
assign (resid  60 and name C)
       (resid  61 and name N)
       (resid  61 and name CA)
       (resid  61 and name C)
1.0 -66 30 2

! Talos derived phi restraint:
assign (resid  61 and name C)
       (resid  62 and name N)
       (resid  62 and name CA)
       (resid  62 and name C)
       1.0 -64  30 2

! Talos derived phi restraint:
assign (resid  62 and name C)
       (resid  63 and name N)
       (resid  63 and name CA)
       (resid  63 and name C)
1.0 -65 30 2

! Talos derived phi restraint:
assign (resid  69 and name C)
       (resid  70 and name N)
       (resid  70 and name CA)
       (resid  70 and name C)
       1.0 -81  39 2

! Talos derived phi restraint:
assign (resid  71 and name C)
       (resid  72 and name N)
       (resid  72 and name CA)
       (resid  72 and name C)
       1.0 -135  30 2

! Talos derived phi restraint:
assign (resid  72 and name C)
       (resid  73 and name N)
       (resid  73 and name CA)
       (resid  73 and name C)
       1.0 -114  30 2

! Talos derived phi restraint:
assign (resid  73 and name C)
       (resid  74 and name N)
       (resid  74 and name CA)
       (resid  74 and name C)
       1.0 -95  54 2

! Talos derived phi restraint:
assign (resid  75 and name C)
       (resid  76 and name N)
       (resid  76 and name CA)
       (resid  76 and name C)
1.0 -59 30 2

! Talos derived phi restraint:
assign (resid  76 and name C)
       (resid  77 and name N)
       (resid  77 and name CA)
       (resid  77 and name C)
1.0 -68 30 2

! Talos derived phi restraint:
assign (resid  77 and name C)
       (resid  78 and name N)
       (resid  78 and name CA)
       (resid  78 and name C)
1.0 -64 30 2

! adjusted manually to +/- 35
! Talos derived phi restraint:
assign (resid  78 and name C)
       (resid  79 and name N)
       (resid  79 and name CA)
       (resid  79 and name C)
1.0 -60 35 2

! Talos derived phi restraint:
assign (resid  79 and name C)
       (resid  80 and name N)
       (resid  80 and name CA)
       (resid  80 and name C)
1.0 -62 30 2

! Talos derived phi restraint:
assign (resid  81 and name C)
       (resid  82 and name N)
       (resid  82 and name CA)
       (resid  82 and name C)
1.0 -63 30 2

! Talos derived phi restraint:
assign (resid  82 and name C)
       (resid  83 and name N)
       (resid  83 and name CA)
       (resid  83 and name C)
1.0 -62 30 2

! Talos derived phi restraint:
assign (resid  83 and name C)
       (resid  84 and name N)
       (resid  84 and name CA)
       (resid  84 and name C)
1.0 -58 30 2

! Talos derived phi restraint:
assign (resid  84 and name C)
       (resid  85 and name N)
       (resid  85 and name CA)
       (resid  85 and name C)
       1.0 -74  47 2
! phi and psi dihedral restraint file generated by Talos2Aria.py
!
! TALOS filename:
! finalpred.tab
!
! settings: min phiError=None, min psiError=30, errorFactor=2.0
!

! Talos derived psi restraint:
assign (resid   4 and name N)
       (resid   4 and name CA)
       (resid   4 and name C)
       (resid   5 and name N)
       1.0 152  47 2

! Talos derived psi restraint:
assign (resid   5 and name N)
       (resid   5 and name CA)
       (resid   5 and name C)
       (resid   6 and name N)
1.0 -38 40 2

! Talos derived psi restraint:
assign (resid   6 and name N)
       (resid   6 and name CA)
       (resid   6 and name C)
       (resid   7 and name N)
1.0 -41 40 2

! Talos derived psi restraint:
assign (resid   7 and name N)
       (resid   7 and name CA)
       (resid   7 and name C)
       (resid   8 and name N)
1.0 -40 40 2

! Talos derived psi restraint:
assign (resid   8 and name N)
       (resid   8 and name CA)
       (resid   8 and name C)
       (resid   9 and name N)
1.0 -43 40 2

! Talos derived psi restraint:
assign (resid   9 and name N)
       (resid   9 and name CA)
       (resid   9 and name C)
       (resid  10 and name N)
1.0 -43 40 2

! Talos derived psi restraint:
assign (resid  10 and name N)
       (resid  10 and name CA)
       (resid  10 and name C)
       (resid  11 and name N)
1.0 -39 40 2

! Talos derived psi restraint:
assign (resid  11 and name N)
       (resid  11 and name CA)
       (resid  11 and name C)
       (resid  12 and name N)
1.0 -40 40 2

! Talos derived psi restraint:
assign (resid  12 and name N)
       (resid  12 and name CA)
       (resid  12 and name C)
       (resid  13 and name N)
1.0 -36 40 2

! Talos derived psi restraint:
assign (resid  15 and name N)
       (resid  15 and name CA)
       (resid  15 and name C)
       (resid  16 and name N)
       1.0 152  45 2

! Talos derived psi restraint:
assign (resid  16 and name N)
       (resid  16 and name CA)
       (resid  16 and name C)
       (resid  17 and name N)
1.0 -38 40 2

! Talos derived psi restraint:
assign (resid  17 and name N)
       (resid  17 and name CA)
       (resid  17 and name C)
       (resid  18 and name N)
1.0 -42 40 2

! Talos derived psi restraint:
assign (resid  18 and name N)
       (resid  18 and name CA)
       (resid  18 and name C)
       (resid  19 and name N)
1.0 -42 40 2

! Talos derived psi restraint:
assign (resid  19 and name N)
       (resid  19 and name CA)
       (resid  19 and name C)
       (resid  20 and name N)
1.0 -44 40 2

! Talos derived psi restraint:
assign (resid  20 and name N)
       (resid  20 and name CA)
       (resid  20 and name C)
       (resid  21 and name N)
1.0 -38 40 2

! Talos derived psi restraint:
assign (resid  21 and name N)
       (resid  21 and name CA)
       (resid  21 and name C)
       (resid  22 and name N)
1.0 -45 40 2

! Talos derived psi restraint:
assign (resid  22 and name N)
       (resid  22 and name CA)
       (resid  22 and name C)
       (resid  23 and name N)
1.0 -37 40 2

! Talos derived psi restraint:
assign (resid  23 and name N)
       (resid  23 and name CA)
       (resid  23 and name C)
       (resid  24 and name N)
1.0 -42 40 2

! Talos derived psi restraint:
assign (resid  24 and name N)
       (resid  24 and name CA)
       (resid  24 and name C)
       (resid  25 and name N)
1.0 -40 40 2

! Talos derived psi restraint:
assign (resid  25 and name N)
       (resid  25 and name CA)
       (resid  25 and name C)
       (resid  26 and name N)
1.0 -41 40 2

! Talos derived psi restraint:
assign (resid  26 and name N)
       (resid  26 and name CA)
       (resid  26 and name C)
       (resid  27 and name N)
1.0 -44 40 2

! Talos derived psi restraint:
assign (resid  27 and name N)
       (resid  27 and name CA)
       (resid  27 and name C)
       (resid  28 and name N)
1.0 -34 40 2

! Talos derived psi restraint:
assign (resid  28 and name N)
       (resid  28 and name CA)
       (resid  28 and name C)
       (resid  29 and name N)
1.0 -36 40 2

! Talos derived psi restraint:
assign (resid  29 and name N)
       (resid  29 and name CA)
       (resid  29 and name C)
       (resid  30 and name N)
       1.0 -35  41 2
       
!experimental restraint
assign (resid  36 and name N) (resid  36 and name CA)
       (resid  36 and name C) (resid  37 and name N) 1.0  120.0  100.0 2
      

! Talos derived psi restraint:
assign (resid  37 and name N)
       (resid  37 and name CA)
       (resid  37 and name C)
       (resid  38 and name N)
1.0 136 40 2

! Talos derived psi restraint:
assign (resid  38 and name N)
       (resid  38 and name CA)
       (resid  38 and name C)
       (resid  39 and name N)
1.0 170 40 2

! Talos derived psi restraint:
assign (resid  39 and name N)
       (resid  39 and name CA)
       (resid  39 and name C)
       (resid  40 and name N)
1.0 -36 40 2

! Talos derived psi restraint:
assign (resid  40 and name N)
       (resid  40 and name CA)
       (resid  40 and name C)
       (resid  41 and name N)
1.0 -38 40 2

! Talos derived psi restraint:
assign (resid  41 and name N)
       (resid  41 and name CA)
       (resid  41 and name C)
       (resid  42 and name N)
1.0 -44 40 2

! Talos derived psi restraint:
assign (resid  42 and name N)
       (resid  42 and name CA)
       (resid  42 and name C)
       (resid  43 and name N)
1.0 -41 40 2

! Talos derived psi restraint:
assign (resid  43 and name N)
       (resid  43 and name CA)
       (resid  43 and name C)
       (resid  44 and name N)
1.0 -39 40 2

! Talos derived psi restraint:
assign (resid  44 and name N)
       (resid  44 and name CA)
       (resid  44 and name C)
       (resid  45 and name N)
1.0 -44 40 2

! Talos derived psi restraint:
assign (resid  45 and name N)
       (resid  45 and name CA)
       (resid  45 and name C)
       (resid  46 and name N)
1.0 -46 40 2

! Talos derived psi restraint:
assign (resid  47 and name N)
       (resid  47 and name CA)
       (resid  47 and name C)
       (resid  48 and name N)
1.0 -39 40 2

! Talos derived psi restraint:
assign (resid  48 and name N)
       (resid  48 and name CA)
       (resid  48 and name C)
       (resid  49 and name N)
1.0 -30 40 2

! Talos derived psi restraint:
assign (resid  51 and name N)
       (resid  51 and name CA)
       (resid  51 and name C)
       (resid  52 and name N)
1.0 149 40 2

! Talos derived psi restraint:
!assign (resid  52 and name N)
!       (resid  52 and name CA)
!       (resid  52 and name C)
!       (resid  53 and name N)
!       1.0 125  47 2

! Talos derived psi restraint:
assign (resid  53 and name N)
       (resid  53 and name CA)
       (resid  53 and name C)
       (resid  54 and name N)
1.0 148 40 2

! Talos derived psi restraint:
assign (resid  54 and name N)
       (resid  54 and name CA)
       (resid  54 and name C)
       (resid  55 and name N)
1.0 170 40 2

! Talos derived psi restraint:
assign (resid  56 and name N)
       (resid  56 and name CA)
       (resid  56 and name C)
       (resid  57 and name N)
1.0 -43 40 2

! Talos derived psi restraint:
assign (resid  57 and name N)
       (resid  57 and name CA)
       (resid  57 and name C)
       (resid  58 and name N)
1.0 -39 40 2

! Talos derived psi restraint:
assign (resid  58 and name N)
       (resid  58 and name CA)
       (resid  58 and name C)
       (resid  59 and name N)
1.0 -42 40 2

! Talos derived psi restraint:
assign (resid  59 and name N)
       (resid  59 and name CA)
       (resid  59 and name C)
       (resid  60 and name N)
1.0 -41 40 2

! Talos derived psi restraint:
assign (resid  60 and name N)
       (resid  60 and name CA)
       (resid  60 and name C)
       (resid  61 and name N)
1.0 -38 40 2

! Talos derived psi restraint:
assign (resid  61 and name N)
       (resid  61 and name CA)
       (resid  61 and name C)
       (resid  62 and name N)
1.0 -44 40 2

! Talos derived psi restraint:
assign (resid  62 and name N)
       (resid  62 and name CA)
       (resid  62 and name C)
       (resid  63 and name N)
1.0 -41 40 2

! Talos derived psi restraint:
assign (resid  63 and name N)
       (resid  63 and name CA)
       (resid  63 and name C)
       (resid  64 and name N)
1.0 -38 40 2

!experimental restraint
assign (resid  64 and name N) (resid  64 and name CA)
       (resid  64 and name C) (resid  65 and name N) 1.0  -30.0  110.0 2



! Talos derived psi restraint:
assign (resid  70 and name N)
       (resid  70 and name CA)
       (resid  70 and name C)
       (resid  71 and name N)
1.0 -12 40 2

! Talos derived psi restraint:
assign (resid  72 and name N)
       (resid  72 and name CA)
       (resid  72 and name C)
       (resid  73 and name N)
1.0 155 40 2

! Talos derived psi restraint:
assign (resid  73 and name N)
       (resid  73 and name CA)
       (resid  73 and name C)
       (resid  74 and name N)
1.0 126 40 2

! Talos derived psi restraint:
assign (resid  74 and name N)
       (resid  74 and name CA)
       (resid  74 and name C)
       (resid  75 and name N)
1.0 165 40 2

! Talos derived psi restraint:
assign (resid  76 and name N)
       (resid  76 and name CA)
       (resid  76 and name C)
       (resid  77 and name N)
1.0 -40 40 2

! Talos derived psi restraint:
assign (resid  77 and name N)
       (resid  77 and name CA)
       (resid  77 and name C)
       (resid  78 and name N)
1.0 -38 40 2

! Talos derived psi restraint:
assign (resid  78 and name N)
       (resid  78 and name CA)
       (resid  78 and name C)
       (resid  79 and name N)
1.0 -46 40 2

! Talos derived psi restraint:
assign (resid  79 and name N)
       (resid  79 and name CA)
       (resid  79 and name C)
       (resid  80 and name N)
1.0 -43 40 2

! Talos derived psi restraint:
assign (resid  80 and name N)
       (resid  80 and name CA)
       (resid  80 and name C)
       (resid  81 and name N)
1.0 -44 40 2

! Talos derived psi restraint:
assign (resid  82 and name N)
       (resid  82 and name CA)
       (resid  82 and name C)
       (resid  83 and name N)
1.0 -40 40 2

! Talos derived psi restraint:
assign (resid  83 and name N)
       (resid  83 and name CA)
       (resid  83 and name C)
       (resid  84 and name N)
1.0 -44 40 2

! Talos derived psi restraint:
assign (resid  84 and name N)
       (resid  84 and name CA)
       (resid  84 and name C)
       (resid  85 and name N)
1.0 -39 40 2

! Talos derived psi restraint:
assign (resid  85 and name N)
       (resid  85 and name CA)
       (resid  85 and name C)
       (resid  86 and name N)
1.0 -27 40 2

!experimental restraint
assign (resid  86 and name N) (resid  86 and name CA)
       (resid  86 and name C) (resid  87 and name N) 1.0  -30.0  110.0 2

       
       
       
       
       
       
! phi and psi dihedral restraint file generated by Talos2Aria.py
!
! TALOS filename:
! /export/home/coffey/pmercier/aria/tools/final.tab
!
! settings: min phiError=None, min psiError=None, errorFactor=2.5
!

! Talos derived phi restraint:
assign (resid 118 and name C)
       (resid 119 and name N)
       (resid 119 and name CA)
       (resid 119 and name C)
       1.0 -63  30 2

! Talos derived phi restraint:
assign (resid 119 and name C)
       (resid 120 and name N)
       (resid 120 and name CA)
       (resid 120 and name C)
       1.0 -64  22 2

! Talos derived phi restraint:
assign (resid 120 and name C)
       (resid 121 and name N)
       (resid 121 and name CA)
       (resid 121 and name C)
       1.0 -64  30 2

! Talos derived phi restraint:
assign (resid 121 and name C)
       (resid 122 and name N)
       (resid 122 and name CA)
       (resid 122 and name C)
       1.0 -61  30 2

! Talos derived phi restraint:
assign (resid 122 and name C)
       (resid 123 and name N)
       (resid 123 and name CA)
       (resid 123 and name C)
       1.0 -60  30 2

! Talos derived phi restraint:
assign (resid 123 and name C)
       (resid 124 and name N)
       (resid 124 and name CA)
       (resid 124 and name C)
       1.0 -70  22 2

! phi and psi dihedral restraint file generated by Talos2Aria.py
!
! TALOS filename:
! /export/home/coffey/pmercier/aria/tools/final.tab
!
! settings: min phiError=None, min psiError=30, errorFactor=2.0
!

! Talos derived psi restraint:
assign (resid 119 and name N)
       (resid 119 and name CA)
       (resid 119 and name C)
       (resid 120 and name N)
       1.0 -30  110 2

! Talos derived psi restraint:
assign (resid 120 and name N)
       (resid 120 and name CA)
       (resid 120 and name C)
       (resid 121 and name N)
       1.0 -30  110 2

! Talos derived psi restraint:
assign (resid 121 and name N)
       (resid 121 and name CA)
       (resid 121 and name C)
       (resid 122 and name N)
       1.0 -30  110 2

! Talos derived psi restraint:
assign (resid 122 and name N)
       (resid 122 and name CA)
       (resid 122 and name C)
       (resid 123 and name N)
       1.0 -30  110 2

! Talos derived psi restraint:
assign (resid 123 and name N)
       (resid 123 and name CA)
       (resid 123 and name C)
       (resid 124 and name N)
       1.0 -30  110 2

! Talos derived psi restraint:
assign (resid 124 and name N)
       (resid 124 and name CA)
       (resid 124 and name C)
       (resid 125 and name N)
       1.0 -30  110 2




  Entry H atom name         Submitted Coord H atom name
  Start of MODEL    1
    1   2H    ALA   1          HN2       ALA   1 -22.611   1.488 -11.306
    2    H    ALA   1           H        ALA   1 -21.466   2.252 -12.329
    3   3H    ALA   1          HN3       ALA   1 -22.469   1.007 -12.947
    4    HA   ALA   1           HA       ALA   1 -21.444  -0.594 -11.593
    5   1HB   ALA   1          1HB       ALA   1 -20.238  -0.581 -13.516
    6   2HB   ALA   1          2HB       ALA   1 -18.963  -0.075 -12.406
    7   3HB   ALA   1          3HB       ALA   1 -19.819   1.126 -13.374
    8    H    SER   2           H        SER   2 -21.747  -0.079  -9.364
    9    HA   SER   2           HA       SER   2 -19.344   1.093  -8.129
   10   1HB   SER   2          2HB       SER   2 -22.212   1.696  -7.651
   11   2HB   SER   2          1HB       SER   2 -21.180   1.590  -6.225
   12    HG   SER   2           HG       SER   2 -19.824   3.156  -7.179
   13    H    MET   3           H        MET   3 -18.523   0.057  -6.347
   14    HA   MET   3           HA       MET   3 -19.959  -2.281  -5.321
   15   1HB   MET   3          2HB       MET   3 -17.343  -2.271  -6.737
   16   2HB   MET   3          1HB       MET   3 -17.498  -3.325  -5.338
   17   1HG   MET   3          2HG       MET   3 -18.762  -4.787  -6.439
   18   2HG   MET   3          1HG       MET   3 -19.757  -3.522  -7.158
   19   1HE   MET   3          1HE       MET   3 -18.015  -2.620 -10.415
   20   2HE   MET   3          2HE       MET   3 -17.591  -1.781  -8.923
   21   3HE   MET   3          3HE       MET   3 -19.262  -2.255  -9.223
   22    H    THR   4           H        THR   4 -17.084  -0.218  -4.992
   23    HA   THR   4           HA       THR   4 -17.618   0.204  -2.206
   24    HB   THR   4           HB       THR   4 -16.551  -1.944  -1.976
   25    HG1  THR   4           1HG      THR   4 -14.707  -1.306  -0.767
   26   1HG2  THR   4          1HG2      THR   4 -13.919  -1.628  -2.759
   27   2HG2  THR   4          2HG2      THR   4 -14.859  -1.023  -4.123
   28   3HG2  THR   4          3HG2      THR   4 -15.133  -2.656  -3.518
   29    H    ASP   5           H        ASP   5 -17.208   2.291  -1.963
   30    HA   ASP   5           HA       ASP   5 -15.178   3.563  -3.641
   31   1HB   ASP   5          2HB       ASP   5 -17.210   4.867  -1.820
   32   2HB   ASP   5          1HB       ASP   5 -16.212   5.666  -3.031
   33    H    GLN   6           H        GLN   6 -14.575   1.880  -1.244
   34    HA   GLN   6           HA       GLN   6 -13.695   3.613   0.837
   35   1HB   GLN   6          2HB       GLN   6 -12.584   1.652   1.747
   36   2HB   GLN   6          1HB       GLN   6 -14.205   1.230   1.212
   37   1HG   GLN   6          2HG       GLN   6 -13.236   0.322  -0.872
   38   2HG   GLN   6          1HG       GLN   6 -11.628   0.659  -0.234
   39   1HE2  GLN   6          1HE2      GLN   6 -11.077  -1.526  -0.321
   40   2HE2  GLN   6          2HE2      GLN   6 -11.690  -2.670   0.819
   41    H    GLN   7           H        GLN   7 -12.274   2.377  -2.099
   42    HA   GLN   7           HA       GLN   7  -9.573   2.980  -1.486
   43   1HB   GLN   7          2HB       GLN   7 -10.787   2.892  -4.246
   44   2HB   GLN   7          1HB       GLN   7  -9.117   2.578  -3.796
   45   1HG   GLN   7          2HG       GLN   7  -9.528   0.448  -3.272
   46   2HG   GLN   7          1HG       GLN   7 -11.051   0.832  -2.475
   47   1HE2  GLN   7          1HE2      GLN   7 -10.898  -1.416  -3.950
   48   2HE2  GLN   7          2HE2      GLN   7 -11.801  -1.246  -5.414
   49    H    ALA   8           H        ALA   8 -12.244   4.858  -2.694
   50    HA   ALA   8           HA       ALA   8 -10.671   7.040  -3.668
   51   1HB   ALA   8          1HB       ALA   8 -12.683   7.142  -4.698
   52   2HB   ALA   8          2HB       ALA   8 -13.081   8.162  -3.315
   53   3HB   ALA   8          3HB       ALA   8 -13.547   6.461  -3.320
   54    H    GLU   9           H        GLU   9 -12.673   6.557  -0.761
   55    HA   GLU   9           HA       GLU   9 -12.142   9.025   0.441
   56   1HB   GLU   9          2HB       GLU   9 -12.608   6.452   1.944
   57   2HB   GLU   9          1HB       GLU   9 -13.010   8.086   2.454
   58   1HG   GLU   9          2HG       GLU   9 -14.460   7.967   0.212
   59   2HG   GLU   9          1HG       GLU   9 -14.441   6.255   0.637
   60    H    ALA  10           H        ALA  10 -10.266   6.100   0.274
   61    HA   ALA  10           HA       ALA  10  -8.526   6.431   2.415
   62   1HB   ALA  10          1HB       ALA  10  -6.900   5.134   0.990
   63   2HB   ALA  10          2HB       ALA  10  -8.100   5.206  -0.300
   64   3HB   ALA  10          3HB       ALA  10  -8.482   4.389   1.216
   65    H    ARG  11           H        ARG  11  -8.154   7.590  -0.933
   66    HA   ARG  11           HA       ARG  11  -5.702   8.887  -0.588
   67   1HB   ARG  11          2HB       ARG  11  -7.701   8.672  -2.628
   68   2HB   ARG  11          1HB       ARG  11  -7.231  10.359  -2.476
   69   1HG   ARG  11          2HG       ARG  11  -4.899   9.760  -2.804
   70   2HG   ARG  11          1HG       ARG  11  -5.341   8.054  -2.904
   71   1HD   ARG  11          2HD       ARG  11  -5.112   8.763  -5.133
   72   2HD   ARG  11          1HD       ARG  11  -6.849   8.716  -4.838
   73    HE   ARG  11           HE       ARG  11  -6.197  11.281  -4.277
   74   1HH1  ARG  11          1HH1      ARG  11  -5.603   9.213  -7.026
   75   2HH1  ARG  11          2HH1      ARG  11  -5.599  10.518  -8.165
   76   1HH2  ARG  11          1HH2      ARG  11  -6.192  12.997  -5.774
   77   2HH2  ARG  11          2HH2      ARG  11  -5.932  12.666  -7.454
   78    H    ALA  12           H        ALA  12  -8.952   9.872   0.201
   79    HA   ALA  12           HA       ALA  12  -8.194  12.623   0.701
   80   1HB   ALA  12          1HB       ALA  12 -10.778  11.125   1.073
   81   2HB   ALA  12          2HB       ALA  12 -10.380  12.302  -0.178
   82   3HB   ALA  12          3HB       ALA  12 -10.565  12.824   1.497
   83    H    PHE  13           H        PHE  13  -8.673   9.672   2.502
   84    HA   PHE  13           HA       PHE  13  -8.854  10.852   5.078
   85   1HB   PHE  13          2HB       PHE  13  -8.627   8.149   3.964
   86   2HB   PHE  13          1HB       PHE  13  -7.832   8.336   5.525
   87    HD1  PHE  13           1HD      PHE  13 -10.803   7.452   3.998
   88    HD2  PHE  13           2HD      PHE  13  -9.326   9.737   7.271
   89    HE1  PHE  13           1HE      PHE  13 -12.980   7.238   5.126
   90    HE2  PHE  13           2HE      PHE  13 -11.499   9.525   8.405
   91    HZ   PHE  13           HZ       PHE  13 -13.329   8.275   7.332
   92    H    LEU  14           H        LEU  14  -6.193   9.921   3.018
   93    HA   LEU  14           HA       LEU  14  -4.267  10.442   5.160
   94   1HB   LEU  14          2HB       LEU  14  -3.765   9.467   2.347
   95   2HB   LEU  14          1HB       LEU  14  -2.594   9.534   3.650
   96    HG   LEU  14           HG       LEU  14  -5.071   7.818   3.752
   97   1HD1  LEU  14          1HD1      LEU  14  -2.424   7.351   2.501
   98   2HD1  LEU  14          2HD1      LEU  14  -4.015   6.733   2.058
   99   3HD1  LEU  14          3HD1      LEU  14  -3.142   6.026   3.417
  100   1HD2  LEU  14          1HD2      LEU  14  -2.506   7.666   5.327
  101   2HD2  LEU  14          2HD2      LEU  14  -3.972   6.718   5.575
  102   3HD2  LEU  14          3HD2      LEU  14  -3.978   8.453   5.898
  103    H    SER  15           H        SER  15  -2.571  11.955   4.908
  104    HA   SER  15           HA       SER  15  -3.369  14.361   3.572
  105   1HB   SER  15          2HB       SER  15  -1.680  13.709   5.721
  106   2HB   SER  15          1HB       SER  15  -0.627  14.420   4.496
  107    HG   SER  15           HG       SER  15  -1.709  15.902   6.025
  108    H    GLU  16           H        GLU  16  -1.832  15.587   2.171
  109    HA   GLU  16           HA       GLU  16  -1.267  14.176  -0.170
  110   1HB   GLU  16          2HB       GLU  16  -0.921  16.891   0.813
  111   2HB   GLU  16          1HB       GLU  16   0.394  16.410  -0.250
  112   1HG   GLU  16          2HG       GLU  16  -1.260  15.773  -1.959
  113   2HG   GLU  16          1HG       GLU  16  -2.544  16.345  -0.896
  114    H    GLU  17           H        GLU  17   0.683  14.800   2.652
  115    HA   GLU  17           HA       GLU  17   3.226  14.277   1.603
  116   1HB   GLU  17          2HB       GLU  17   2.042  14.635   4.195
  117   2HB   GLU  17          1HB       GLU  17   3.148  13.271   4.249
  118   1HG   GLU  17          2HG       GLU  17   4.848  14.668   4.407
  119   2HG   GLU  17          1HG       GLU  17   4.445  15.327   2.822
  120    H    MET  18           H        MET  18   0.721  12.119   2.822
  121    HA   MET  18           HA       MET  18   2.307   9.759   2.739
  122   1HB   MET  18          2HB       MET  18  -0.111  10.387   3.818
  123   2HB   MET  18          1HB       MET  18  -0.609   9.461   2.408
  124   1HG   MET  18          2HG       MET  18  -0.446   7.829   4.009
  125   2HG   MET  18          1HG       MET  18   1.140   7.737   3.243
  126   1HE   MET  18          1HE       MET  18  -0.106   7.286   6.846
  127   2HE   MET  18          2HE       MET  18   1.600   6.875   7.020
  128   3HE   MET  18          3HE       MET  18   0.701   6.326   5.606
  129    H    ILE  19           H        ILE  19  -0.061  11.192   0.516
  130    HA   ILE  19           HA       ILE  19  -0.127   9.168  -1.391
  131    HB   ILE  19           HB       ILE  19  -0.337  12.135  -1.912
  132   1HG1  ILE  19          2HG1      ILE  19  -2.436  10.089  -1.161
  133   2HG1  ILE  19          1HG1      ILE  19  -1.909  11.458  -0.187
  134   1HG2  ILE  19          1HG2      ILE  19  -1.457   9.823  -3.491
  135   2HG2  ILE  19          2HG2      ILE  19  -0.004  10.726  -3.924
  136   3HG2  ILE  19          3HG2      ILE  19  -1.570  11.537  -3.893
  137   1HD1  ILE  19          1HD1      ILE  19  -2.806  12.350  -2.763
  138   2HD1  ILE  19          2HD1      ILE  19  -3.388  12.784  -1.155
  139   3HD1  ILE  19          3HD1      ILE  19  -4.039  11.364  -1.976
  140    H    ALA  20           H        ALA  20   2.032  11.985  -1.181
  141    HA   ALA  20           HA       ALA  20   3.451  11.660  -3.533
  142   1HB   ALA  20          1HB       ALA  20   4.057  12.871  -0.892
  143   2HB   ALA  20          2HB       ALA  20   4.023  13.605  -2.495
  144   3HB   ALA  20          3HB       ALA  20   5.398  12.615  -2.007
  145    H    GLU  21           H        GLU  21   4.473  10.473  -0.323
  146    HA   GLU  21           HA       GLU  21   6.580   8.881  -1.310
  147   1HB   GLU  21          2HB       GLU  21   5.037   8.499   1.262
  148   2HB   GLU  21          1HB       GLU  21   6.652   7.899   0.910
  149   1HG   GLU  21          2HG       GLU  21   7.611   9.996   1.075
  150   2HG   GLU  21          1HG       GLU  21   6.080  10.828   0.811
  151    H    PHE  22           H        PHE  22   3.169   8.362  -1.025
  152    HA   PHE  22           HA       PHE  22   3.000   5.590  -0.982
  153   1HB   PHE  22          2HB       PHE  22   1.242   7.778  -1.408
  154   2HB   PHE  22          1HB       PHE  22   0.971   6.632  -2.715
  155    HD1  PHE  22           1HD      PHE  22   1.239   6.828   0.988
  156    HD2  PHE  22           2HD      PHE  22  -0.390   4.799  -2.377
  157    HE1  PHE  22           1HE      PHE  22  -0.132   5.446   2.492
  158    HE2  PHE  22           2HE      PHE  22  -1.766   3.416  -0.883
  159    HZ   PHE  22           HZ       PHE  22  -1.640   3.737   1.555
  160    H    LYS  23           H        LYS  23   3.641   7.787  -3.641
  161    HA   LYS  23           HA       LYS  23   3.491   5.712  -5.641
  162   1HB   LYS  23          2HB       LYS  23   2.942   8.195  -5.968
  163   2HB   LYS  23          1HB       LYS  23   4.681   8.451  -6.018
  164   1HG   LYS  23          2HG       LYS  23   4.257   8.236  -8.240
  165   2HG   LYS  23          1HG       LYS  23   4.569   6.547  -7.834
  166   1HD   LYS  23          2HD       LYS  23   2.517   5.967  -8.465
  167   2HD   LYS  23          1HD       LYS  23   1.804   7.158  -7.377
  168   1HE   LYS  23          2HE       LYS  23   1.415   8.614  -9.038
  169   2HE   LYS  23          1HE       LYS  23   2.979   8.314  -9.792
  170   1HZ   LYS  23          1HZ       LYS  23   0.468   6.788 -10.130
  171   2HZ   LYS  23          2HZ       LYS  23   1.968   6.151 -10.583
  172   3HZ   LYS  23          3HZ       LYS  23   1.392   7.562 -11.316
  173    H    ALA  24           H        ALA  24   5.692   6.261  -3.310
  174    HA   ALA  24           HA       ALA  24   8.176   6.366  -4.567
  175   1HB   ALA  24          1HB       ALA  24   9.022   5.259  -2.482
  176   2HB   ALA  24          2HB       ALA  24   7.345   5.101  -1.964
  177   3HB   ALA  24          3HB       ALA  24   8.045   6.702  -2.216
  178    H    ALA  25           H        ALA  25   7.071   3.394  -2.975
  179    HA   ALA  25           HA       ALA  25   8.612   1.787  -4.790
  180   1HB   ALA  25          1HB       ALA  25   8.441   1.218  -2.419
  181   2HB   ALA  25          2HB       ALA  25   7.864  -0.097  -3.444
  182   3HB   ALA  25          3HB       ALA  25   6.709   0.943  -2.610
  183    H    PHE  26           H        PHE  26   5.651   3.196  -5.153
  184    HA   PHE  26           HA       PHE  26   3.924   1.247  -6.065
  185   1HB   PHE  26          2HB       PHE  26   3.503   3.749  -5.819
  186   2HB   PHE  26          1HB       PHE  26   4.225   3.928  -7.415
  187    HD1  PHE  26           1HD      PHE  26   3.154   2.758  -9.364
  188    HD2  PHE  26           2HD      PHE  26   1.271   3.083  -5.561
  189    HE1  PHE  26           1HE      PHE  26   0.979   2.263 -10.403
  190    HE2  PHE  26           2HE      PHE  26  -0.907   2.589  -6.592
  191    HZ   PHE  26           HZ       PHE  26  -1.055   2.178  -9.017
  192    H    ASP  27           H        ASP  27   6.794   2.495  -7.576
  193    HA   ASP  27           HA       ASP  27   6.177   1.381 -10.170
  194   1HB   ASP  27          2HB       ASP  27   8.199   3.152  -9.044
  195   2HB   ASP  27          1HB       ASP  27   8.892   1.968 -10.149
  196    H    MET  28           H        MET  28   8.648   0.754  -7.676
  197    HA   MET  28           HA       MET  28   9.662  -1.583  -8.875
  198   1HB   MET  28          2HB       MET  28   9.898  -0.250  -6.247
  199   2HB   MET  28          1HB       MET  28  10.239  -1.974  -6.259
  200   1HG   MET  28          2HG       MET  28  11.900  -1.621  -8.026
  201   2HG   MET  28          1HG       MET  28  11.574   0.110  -7.970
  202   1HE   MET  28          1HE       MET  28  13.715   0.869  -7.695
  203   2HE   MET  28          2HE       MET  28  14.693   0.833  -6.227
  204   3HE   MET  28          3HE       MET  28  13.172   1.727  -6.253
  205    H    PHE  29           H        PHE  29   6.880  -1.002  -6.887
  206    HA   PHE  29           HA       PHE  29   6.428  -3.512  -5.791
  207   1HB   PHE  29          2HB       PHE  29   4.900  -1.102  -6.253
  208   2HB   PHE  29          1HB       PHE  29   3.900  -2.526  -6.516
  209    HD1  PHE  29           1HD      PHE  29   5.235  -0.308  -4.110
  210    HD2  PHE  29           2HD      PHE  29   3.950  -4.325  -4.663
  211    HE1  PHE  29           1HE      PHE  29   4.945  -0.545  -1.679
  212    HE2  PHE  29           2HE      PHE  29   3.656  -4.570  -2.234
  213    HZ   PHE  29           HZ       PHE  29   4.153  -2.678  -0.738
  214    H    ASP  30           H        ASP  30   4.674  -2.294  -8.644
  215    HA   ASP  30           HA       ASP  30   3.765  -4.788  -9.500
  216   1HB   ASP  30          2HB       ASP  30   4.167  -2.163 -10.912
  217   2HB   ASP  30          1HB       ASP  30   3.586  -3.580 -11.782
  218    H    ALA  31           H        ALA  31   4.862  -6.478 -10.216
  219    HA   ALA  31           HA       ALA  31   7.579  -6.176 -11.177
  220   1HB   ALA  31          1HB       ALA  31   7.139  -8.804 -11.429
  221   2HB   ALA  31          2HB       ALA  31   5.883  -8.414 -10.254
  222   3HB   ALA  31          3HB       ALA  31   7.571  -8.043  -9.898
  223    H    ASP  32           H        ASP  32   4.568  -7.625 -12.422
  224    HA   ASP  32           HA       ASP  32   5.647  -7.949 -15.058
  225   1HB   ASP  32          2HB       ASP  32   3.332  -8.623 -15.657
  226   2HB   ASP  32          1HB       ASP  32   3.960  -9.501 -14.267
  227    H    GLY  33           H        GLY  33   3.760  -5.530 -13.391
  228   1HA   GLY  33          2HA       GLY  33   3.333  -3.343 -13.998
  229   2HA   GLY  33          1HA       GLY  33   4.246  -3.621 -15.474
  230    H    GLY  34           H        GLY  34   1.447  -5.477 -14.400
  231   1HA   GLY  34          2HA       GLY  34  -0.427  -4.081 -16.045
  232   2HA   GLY  34          1HA       GLY  34   0.149  -5.545 -16.828
  233    H    GLY  35           H        GLY  35  -0.235  -5.236 -13.357
  234   1HA   GLY  35          2HA       GLY  35  -2.768  -6.689 -13.433
  235   2HA   GLY  35          1HA       GLY  35  -1.403  -7.514 -12.695
  236    H    ASP  36           H        ASP  36  -0.872  -7.065 -10.627
  237    HA   ASP  36           HA       ASP  36  -1.577  -4.636  -9.314
  238   1HB   ASP  36          2HB       ASP  36  -3.356  -7.007  -9.042
  239   2HB   ASP  36          1HB       ASP  36  -3.008  -6.083  -7.584
  240    H    ILE  37           H        ILE  37  -1.453  -5.197  -6.736
  241    HA   ILE  37           HA       ILE  37   1.178  -6.437  -6.449
  242    HB   ILE  37           HB       ILE  37  -0.375  -4.803  -4.440
  243   1HG1  ILE  37          2HG1      ILE  37   1.848  -3.994  -6.326
  244   2HG1  ILE  37          1HG1      ILE  37   0.168  -3.473  -6.418
  245   1HG2  ILE  37          1HG2      ILE  37   1.802  -4.585  -3.312
  246   2HG2  ILE  37          2HG2      ILE  37   2.504  -5.694  -4.491
  247   3HG2  ILE  37          3HG2      ILE  37   1.247  -6.258  -3.389
  248   1HD1  ILE  37          1HD1      ILE  37   2.207  -2.131  -5.181
  249   2HD1  ILE  37          2HD1      ILE  37   1.387  -2.926  -3.837
  250   3HD1  ILE  37          3HD1      ILE  37   0.484  -1.864  -4.917
  251    H    SER  38           H        SER  38   1.506  -8.309  -5.420
  252    HA   SER  38           HA       SER  38  -0.779  -9.520  -4.006
  253   1HB   SER  38          2HB       SER  38   0.001 -10.628  -6.162
  254   2HB   SER  38          1HB       SER  38   1.486 -11.042  -5.303
  255    HG   SER  38           HG       SER  38  -0.357 -12.615  -5.319
  256    H    THR  39           H        THR  39   0.539 -11.647  -2.830
  257    HA   THR  39           HA       THR  39   1.641 -10.414  -0.527
  258    HB   THR  39           HB       THR  39   2.242 -12.887   0.017
  259    HG1  THR  39           1HG      THR  39   2.044 -14.056  -1.725
  260   1HG2  THR  39          1HG2      THR  39  -0.662 -12.310  -0.476
  261   2HG2  THR  39          2HG2      THR  39   0.247 -11.654   0.885
  262   3HG2  THR  39          3HG2      THR  39   0.043 -13.398   0.719
  263    H    LYS  40           H        LYS  40   3.021 -11.814  -3.402
  264    HA   LYS  40           HA       LYS  40   5.681 -12.037  -2.356
  265   1HB   LYS  40          2HB       LYS  40   4.298 -12.790  -4.744
  266   2HB   LYS  40          1HB       LYS  40   5.738 -11.886  -5.193
  267   1HG   LYS  40          2HG       LYS  40   6.618 -13.625  -3.223
  268   2HG   LYS  40          1HG       LYS  40   5.483 -14.581  -4.177
  269   1HD   LYS  40          2HD       LYS  40   6.925 -13.249  -6.102
  270   2HD   LYS  40          1HD       LYS  40   8.140 -13.583  -4.866
  271   1HE   LYS  40          2HE       LYS  40   8.300 -15.637  -5.705
  272   2HE   LYS  40          1HE       LYS  40   6.679 -15.943  -5.084
  273   1HZ   LYS  40          1HZ       LYS  40   6.775 -16.479  -7.409
  274   2HZ   LYS  40          2HZ       LYS  40   7.366 -14.941  -7.793
  275   3HZ   LYS  40          3HZ       LYS  40   5.792 -15.116  -7.204
  276    H    GLU  41           H        GLU  41   4.033  -9.766  -4.535
  277    HA   GLU  41           HA       GLU  41   6.203  -8.099  -5.072
  278   1HB   GLU  41          2HB       GLU  41   3.253  -7.473  -4.919
  279   2HB   GLU  41          1HB       GLU  41   4.458  -6.354  -5.541
  280   1HG   GLU  41          2HG       GLU  41   5.082  -8.212  -7.175
  281   2HG   GLU  41          1HG       GLU  41   3.568  -8.973  -6.690
  282    H    LEU  42           H        LEU  42   4.135  -8.308  -2.274
  283    HA   LEU  42           HA       LEU  42   4.796  -5.779  -1.160
  284   1HB   LEU  42          2HB       LEU  42   3.108  -7.959  -0.512
  285   2HB   LEU  42          1HB       LEU  42   4.140  -7.680   0.877
  286    HG   LEU  42           HG       LEU  42   2.156  -6.415   1.212
  287   1HD1  LEU  42          1HD1      LEU  42   4.353  -5.317   1.718
  288   2HD1  LEU  42          2HD1      LEU  42   3.002  -4.211   1.475
  289   3HD1  LEU  42          3HD1      LEU  42   4.190  -4.445   0.193
  290   1HD2  LEU  42          1HD2      LEU  42   0.950  -5.937  -0.604
  291   2HD2  LEU  42          2HD2      LEU  42   2.364  -5.976  -1.658
  292   3HD2  LEU  42          3HD2      LEU  42   1.970  -4.508  -0.763
  293    H    GLY  43           H        GLY  43   5.799  -9.060  -0.155
  294   1HA   GLY  43          2HA       GLY  43   7.726  -8.311   1.690
  295   2HA   GLY  43          1HA       GLY  43   7.759  -9.813   0.777
  296    H    THR  44           H        THR  44   7.892  -8.181  -1.768
  297    HA   THR  44           HA       THR  44  10.660  -8.287  -2.147
  298    HB   THR  44           HB       THR  44   8.511  -6.820  -3.685
  299    HG1  THR  44           1HG      THR  44   8.488  -9.163  -3.591
  300   1HG2  THR  44          1HG2      THR  44  10.116  -6.903  -5.594
  301   2HG2  THR  44          2HG2      THR  44  11.384  -7.288  -4.430
  302   3HG2  THR  44          3HG2      THR  44  10.528  -5.748  -4.326
  303    H    VAL  45           H        VAL  45   8.834  -5.264  -2.501
  304    HA   VAL  45           HA       VAL  45  11.035  -3.606  -2.002
  305    HB   VAL  45           HB       VAL  45   9.043  -2.832  -3.194
  306   1HG1  VAL  45          1HG1      VAL  45   7.096  -3.525  -2.318
  307   2HG1  VAL  45          2HG1      VAL  45   7.202  -2.046  -1.363
  308   3HG1  VAL  45          3HG1      VAL  45   7.735  -3.580  -0.676
  309   1HG2  VAL  45          1HG2      VAL  45   9.582  -0.739  -2.664
  310   2HG2  VAL  45          2HG2      VAL  45  10.548  -1.396  -1.343
  311   3HG2  VAL  45          3HG2      VAL  45   8.881  -0.898  -1.054
  312    H    MET  46           H        MET  46   8.866  -5.207   0.170
  313    HA   MET  46           HA       MET  46   9.373  -3.500   2.418
  314   1HB   MET  46          2HB       MET  46   7.950  -6.087   1.980
  315   2HB   MET  46          1HB       MET  46   8.402  -5.644   3.622
  316   1HG   MET  46          2HG       MET  46   6.778  -3.906   1.782
  317   2HG   MET  46          1HG       MET  46   6.096  -4.994   2.989
  318   1HE   MET  46          1HE       MET  46   4.825  -3.714   4.141
  319   2HE   MET  46          2HE       MET  46   5.022  -1.964   4.069
  320   3HE   MET  46          3HE       MET  46   5.355  -2.827   5.570
  321    H    ARG  47           H        ARG  47  10.832  -6.366   1.069
  322    HA   ARG  47           HA       ARG  47  12.450  -6.829   3.439
  323   1HB   ARG  47          2HB       ARG  47  12.215  -8.230   0.782
  324   2HB   ARG  47          1HB       ARG  47  13.467  -8.642   1.945
  325   1HG   ARG  47          2HG       ARG  47  11.866  -9.349   3.548
  326   2HG   ARG  47          1HG       ARG  47  10.534  -8.686   2.601
  327   1HD   ARG  47          2HD       ARG  47  10.306 -10.721   1.722
  328   2HD   ARG  47          1HD       ARG  47  11.802 -10.407   0.846
  329    HE   ARG  47           HE       ARG  47  12.187 -11.453   3.502
  330   1HH1  ARG  47          1HH1      ARG  47  11.693 -12.255   0.140
  331   2HH1  ARG  47          2HH1      ARG  47  12.408 -13.825   0.283
  332   1HH2  ARG  47          1HH2      ARG  47  13.127 -13.518   3.689
  333   2HH2  ARG  47          2HH2      ARG  47  13.221 -14.543   2.296
  334    H    MET  48           H        MET  48  12.715  -5.312   0.324
  335    HA   MET  48           HA       MET  48  15.612  -5.026   0.618
  336   1HB   MET  48          2HB       MET  48  15.574  -4.161  -1.673
  337   2HB   MET  48          1HB       MET  48  14.795  -5.734  -1.573
  338   1HG   MET  48          2HG       MET  48  12.869  -4.936  -2.327
  339   2HG   MET  48          1HG       MET  48  12.906  -3.575  -1.208
  340   1HE   MET  48          1HE       MET  48  11.749  -1.915  -3.551
  341   2HE   MET  48          2HE       MET  48  13.072  -0.760  -3.384
  342   3HE   MET  48          3HE       MET  48  12.467  -1.620  -1.968
  343    H    LEU  49           H        LEU  49  13.908  -3.637   2.442
  344    HA   LEU  49           HA       LEU  49  14.825  -0.925   1.906
  345   1HB   LEU  49          2HB       LEU  49  11.958  -1.716   2.286
  346   2HB   LEU  49          1HB       LEU  49  12.515  -0.131   2.787
  347    HG   LEU  49           HG       LEU  49  12.518  -1.259  -0.010
  348   1HD1  LEU  49          1HD1      LEU  49  10.377  -0.484   0.418
  349   2HD1  LEU  49          2HD1      LEU  49  11.161   0.915  -0.317
  350   3HD1  LEU  49          3HD1      LEU  49  10.949   0.840   1.432
  351   1HD2  LEU  49          1HD2      LEU  49  13.224   1.342  -0.288
  352   2HD2  LEU  49          2HD2      LEU  49  14.363  -0.003  -0.285
  353   3HD2  LEU  49          3HD2      LEU  49  14.082   0.918   1.192
  354    H    GLY  50           H        GLY  50  13.087  -3.034   4.183
  355   1HA   GLY  50          2HA       GLY  50  14.871  -2.806   6.281
  356   2HA   GLY  50          1HA       GLY  50  13.742  -1.474   6.476
  357    H    GLN  51           H        GLN  51  11.393  -2.698   5.599
  358    HA   GLN  51           HA       GLN  51  10.540  -3.997   7.933
  359   1HB   GLN  51          2HB       GLN  51   9.300  -2.875   5.762
  360   2HB   GLN  51          1HB       GLN  51   8.969  -4.585   5.520
  361   1HG   GLN  51          2HG       GLN  51   7.172  -4.047   6.786
  362   2HG   GLN  51          1HG       GLN  51   8.307  -4.443   8.076
  363   1HE2  GLN  51          1HE2      GLN  51   6.580  -3.045   9.146
  364   2HE2  GLN  51          2HE2      GLN  51   6.923  -1.354   9.235
  365    H    ASN  52           H        ASN  52   9.499  -6.196   7.964
  366    HA   ASN  52           HA       ASN  52  10.711  -8.162   6.201
  367   1HB   ASN  52          2HB       ASN  52  12.083  -7.589   8.465
  368   2HB   ASN  52          1HB       ASN  52  11.008  -8.847   9.064
  369   1HD2  ASN  52          1HD2      ASN  52  12.938 -10.087   9.385
  370   2HD2  ASN  52          2HD2      ASN  52  13.644 -10.941   8.061
  371    HA   PRO  53           HA       PRO  53   6.419  -9.094   7.958
  372   1HB   PRO  53          2HB       PRO  53   4.951  -8.669   5.734
  373   2HB   PRO  53          1HB       PRO  53   5.337  -7.372   6.870
  374   1HG   PRO  53          2HG       PRO  53   6.636  -8.051   4.258
  375   2HG   PRO  53          1HG       PRO  53   6.187  -6.462   4.905
  376   1HD   PRO  53          2HD       PRO  53   8.724  -7.440   4.999
  377   2HD   PRO  53          1HD       PRO  53   8.071  -6.324   6.215
  378    H    THR  54           H        THR  54   6.680 -11.264   8.106
  379    HA   THR  54           HA       THR  54   7.555 -12.993   6.106
  380    HB   THR  54           HB       THR  54   6.060 -14.662   7.596
  381    HG1  THR  54           1HG      THR  54   5.080 -13.403   9.000
  382   1HG2  THR  54          1HG2      THR  54   8.270 -15.146   7.756
  383   2HG2  THR  54          2HG2      THR  54   8.010 -14.443   9.353
  384   3HG2  THR  54          3HG2      THR  54   8.731 -13.471   8.069
  385    H    LYS  55           H        LYS  55   5.976 -14.998   5.568
  386    HA   LYS  55           HA       LYS  55   4.269 -14.096   3.551
  387   1HB   LYS  55          2HB       LYS  55   5.290 -16.354   3.640
  388   2HB   LYS  55          1HB       LYS  55   4.197 -16.775   4.951
  389   1HG   LYS  55          2HG       LYS  55   2.932 -17.610   3.304
  390   2HG   LYS  55          1HG       LYS  55   2.433 -15.931   3.087
  391   1HD   LYS  55          2HD       LYS  55   4.860 -16.309   1.662
  392   2HD   LYS  55          1HD       LYS  55   3.780 -17.642   1.252
  393   1HE   LYS  55          2HE       LYS  55   2.014 -15.709   1.019
  394   2HE   LYS  55          1HE       LYS  55   3.453 -14.716   0.790
  395   1HZ   LYS  55          1HZ       LYS  55   3.336 -17.176  -0.756
  396   2HZ   LYS  55          2HZ       LYS  55   3.880 -15.638  -1.205
  397   3HZ   LYS  55          3HZ       LYS  55   2.223 -15.976  -1.191
  398    H    CYS  56           H        CYS  56   3.395 -15.570   6.681
  399    HA   CYS  56           HA       CYS  56   0.633 -15.205   6.449
  400   1HB   CYS  56          2HB       CYS  56   2.415 -16.215   8.382
  401   2HB   CYS  56          1HB       CYS  56   1.476 -14.970   9.199
  402    HG   CYS  56           HG       CYS  56   0.397 -17.480   9.190
  403    H    GLU  57           H        GLU  57   3.169 -13.018   7.423
  404    HA   GLU  57           HA       GLU  57   1.642 -11.077   8.743
  405   1HB   GLU  57          2HB       GLU  57   4.306 -11.243   7.531
  406   2HB   GLU  57          1HB       GLU  57   3.617  -9.626   7.482
  407   1HG   GLU  57          2HG       GLU  57   3.337 -10.965  10.065
  408   2HG   GLU  57          1HG       GLU  57   5.004 -10.687   9.567
  409    H    LEU  58           H        LEU  58   2.877 -10.869   5.401
  410    HA   LEU  58           HA       LEU  58   1.274  -8.710   4.637
  411   1HB   LEU  58          2HB       LEU  58   2.307 -10.889   2.825
  412   2HB   LEU  58          1HB       LEU  58   1.870  -9.255   2.363
  413    HG   LEU  58           HG       LEU  58   4.084  -9.759   4.329
  414   1HD1  LEU  58          1HD1      LEU  58   4.532 -11.081   2.289
  415   2HD1  LEU  58          2HD1      LEU  58   5.680  -9.765   2.528
  416   3HD1  LEU  58          3HD1      LEU  58   4.391  -9.605   1.335
  417   1HD2  LEU  58          1HD2      LEU  58   3.657  -7.511   4.348
  418   2HD2  LEU  58          2HD2      LEU  58   3.097  -7.490   2.675
  419   3HD2  LEU  58          3HD2      LEU  58   4.823  -7.593   3.027
  420    H    ASP  59           H        ASP  59   0.689 -12.182   4.502
  421    HA   ASP  59           HA       ASP  59  -1.624 -12.164   2.929
  422   1HB   ASP  59          2HB       ASP  59  -0.132 -14.110   4.091
  423   2HB   ASP  59          1HB       ASP  59  -1.550 -14.129   5.136
  424    H    ALA  60           H        ALA  60  -1.126 -11.428   6.304
  425    HA   ALA  60           HA       ALA  60  -3.832 -11.586   7.129
  426   1HB   ALA  60          1HB       ALA  60  -1.500 -11.311   8.444
  427   2HB   ALA  60          2HB       ALA  60  -3.072 -10.960   9.160
  428   3HB   ALA  60          3HB       ALA  60  -2.089  -9.649   8.508
  429    H    ILE  61           H        ILE  61  -1.815  -8.901   5.990
  430    HA   ILE  61           HA       ILE  61  -3.833  -6.919   6.285
  431    HB   ILE  61           HB       ILE  61  -1.349  -6.903   4.560
  432   1HG1  ILE  61          2HG1      ILE  61  -0.776  -5.227   6.559
  433   2HG1  ILE  61          1HG1      ILE  61  -1.908  -6.267   7.416
  434   1HG2  ILE  61          1HG2      ILE  61  -2.397  -5.136   3.627
  435   2HG2  ILE  61          2HG2      ILE  61  -1.839  -4.309   5.081
  436   3HG2  ILE  61          3HG2      ILE  61  -3.490  -4.924   4.995
  437   1HD1  ILE  61          1HD1      ILE  61   0.047  -7.778   5.901
  438   2HD1  ILE  61          2HD1      ILE  61  -0.411  -7.894   7.600
  439   3HD1  ILE  61          3HD1      ILE  61   0.785  -6.704   7.089
  440    H    ILE  62           H        ILE  62  -2.438  -8.365   3.327
  441    HA   ILE  62           HA       ILE  62  -4.127  -7.313   1.450
  442    HB   ILE  62           HB       ILE  62  -3.099 -10.154   1.452
  443   1HG1  ILE  62          2HG1      ILE  62  -1.855  -7.589   0.436
  444   2HG1  ILE  62          1HG1      ILE  62  -1.277  -8.573   1.776
  445   1HG2  ILE  62          1HG2      ILE  62  -3.946  -8.381  -0.836
  446   2HG2  ILE  62          2HG2      ILE  62  -4.846  -9.762  -0.212
  447   3HG2  ILE  62          3HG2      ILE  62  -3.277 -10.006  -0.977
  448   1HD1  ILE  62          1HD1      ILE  62  -1.217 -10.419  -0.136
  449   2HD1  ILE  62          2HD1      ILE  62   0.126  -9.318   0.173
  450   3HD1  ILE  62          3HD1      ILE  62  -1.008  -8.980  -1.134
  451    H    CYS  63           H        CYS  63  -4.758 -10.031   3.604
  452    HA   CYS  63           HA       CYS  63  -7.104 -10.986   2.419
  453   1HB   CYS  63          2HB       CYS  63  -5.838 -12.135   4.235
  454   2HB   CYS  63          1HB       CYS  63  -6.452 -10.941   5.373
  455    HG   CYS  63           HG       CYS  63  -8.370 -12.898   3.896
  456    H    GLU  64           H        GLU  64  -6.522  -8.241   4.497
  457    HA   GLU  64           HA       GLU  64  -9.356  -7.746   4.890
  458   1HB   GLU  64          2HB       GLU  64  -6.822  -6.607   5.945
  459   2HB   GLU  64          1HB       GLU  64  -8.217  -5.538   5.893
  460   1HG   GLU  64          2HG       GLU  64  -9.495  -7.176   7.205
  461   2HG   GLU  64          1HG       GLU  64  -8.060  -8.197   7.297
  462    H    VAL  65           H        VAL  65  -6.695  -6.576   2.949
  463    HA   VAL  65           HA       VAL  65  -7.862  -4.189   2.018
  464    HB   VAL  65           HB       VAL  65  -5.933  -5.949   0.501
  465   1HG1  VAL  65          1HG1      VAL  65  -6.514  -2.993   0.361
  466   2HG1  VAL  65          2HG1      VAL  65  -6.893  -4.204  -0.865
  467   3HG1  VAL  65          3HG1      VAL  65  -5.212  -3.811  -0.502
  468   1HG2  VAL  65          1HG2      VAL  65  -5.456  -3.934   2.682
  469   2HG2  VAL  65          2HG2      VAL  65  -4.202  -4.412   1.538
  470   3HG2  VAL  65          3HG2      VAL  65  -4.925  -5.613   2.607
  471    H    ASP  66           H        ASP  66  -7.548  -7.307   0.311
  472    HA   ASP  66           HA       ASP  66  -9.316  -6.612  -1.774
  473   1HB   ASP  66          2HB       ASP  66  -8.273  -9.258  -0.771
  474   2HB   ASP  66          1HB       ASP  66  -9.367  -9.143  -2.147
  475    H    GLU  67           H        GLU  67 -11.333  -5.985  -1.258
  476    HA   GLU  67           HA       GLU  67 -12.864  -7.213   0.824
  477   1HB   GLU  67          2HB       GLU  67 -13.488  -5.174  -1.300
  478   2HB   GLU  67          1HB       GLU  67 -14.740  -5.809  -0.242
  479   1HG   GLU  67          2HG       GLU  67 -12.276  -4.756   1.023
  480   2HG   GLU  67          1HG       GLU  67 -13.399  -3.597   0.312
  481    H    ASP  68           H        ASP  68 -12.563  -7.625  -2.626
  482    HA   ASP  68           HA       ASP  68 -14.941  -9.250  -2.851
  483   1HB   ASP  68          2HB       ASP  68 -14.142  -9.614  -5.191
  484   2HB   ASP  68          1HB       ASP  68 -14.324  -7.915  -4.761
  485    H    GLY  69           H        GLY  69 -11.506  -9.733  -2.423
  486   1HA   GLY  69          2HA       GLY  69 -10.625 -11.704  -1.428
  487   2HA   GLY  69          1HA       GLY  69 -12.022 -12.593  -2.018
  488    H    SER  70           H        SER  70  -9.553 -10.537  -3.559
  489    HA   SER  70           HA       SER  70  -9.136 -12.690  -5.524
  490   1HB   SER  70          2HB       SER  70  -8.005 -10.486  -6.675
  491   2HB   SER  70          1HB       SER  70  -9.665 -11.011  -6.951
  492    HG   SER  70           HG       SER  70  -8.726  -9.022  -5.172
  493    H    GLY  71           H        GLY  71  -7.626 -10.732  -3.112
  494   1HA   GLY  71          2HA       GLY  71  -5.555 -11.031  -2.117
  495   2HA   GLY  71          1HA       GLY  71  -5.215 -12.298  -3.287
  496    H    THR  72           H        THR  72  -6.263  -9.360  -4.667
  497    HA   THR  72           HA       THR  72  -3.479  -8.565  -5.203
  498    HB   THR  72           HB       THR  72  -4.135  -7.962  -7.484
  499    HG1  THR  72           1HG      THR  72  -6.273  -7.520  -7.343
  500   1HG2  THR  72          1HG2      THR  72  -5.241 -10.672  -7.450
  501   2HG2  THR  72          2HG2      THR  72  -3.675 -10.493  -6.658
  502   3HG2  THR  72          3HG2      THR  72  -3.872 -10.008  -8.342
  503    H    ILE  73           H        ILE  73  -3.031  -6.398  -5.187
  504    HA   ILE  73           HA       ILE  73  -5.162  -4.672  -4.155
  505    HB   ILE  73           HB       ILE  73  -2.210  -4.068  -4.262
  506   1HG1  ILE  73          2HG1      ILE  73  -3.824  -5.206  -1.968
  507   2HG1  ILE  73          1HG1      ILE  73  -2.649  -6.102  -2.927
  508   1HG2  ILE  73          1HG2      ILE  73  -2.749  -2.402  -2.562
  509   2HG2  ILE  73          2HG2      ILE  73  -4.450  -2.863  -2.642
  510   3HG2  ILE  73          3HG2      ILE  73  -3.669  -2.124  -4.040
  511   1HD1  ILE  73          1HD1      ILE  73  -2.152  -3.852  -1.008
  512   2HD1  ILE  73          2HD1      ILE  73  -0.941  -4.402  -2.167
  513   3HD1  ILE  73          3HD1      ILE  73  -1.554  -5.509  -0.939
  514    H    ASP  74           H        ASP  74  -6.126  -3.273  -5.456
  515    HA   ASP  74           HA       ASP  74  -5.184  -2.811  -8.123
  516   1HB   ASP  74          2HB       ASP  74  -7.650  -2.756  -6.934
  517   2HB   ASP  74          1HB       ASP  74  -7.305  -1.039  -7.114
  518    H    PHE  75           H        PHE  75  -5.745  -0.200  -8.661
  519    HA   PHE  75           HA       PHE  75  -3.377   1.114  -7.950
  520   1HB   PHE  75          2HB       PHE  75  -5.811   1.761  -9.454
  521   2HB   PHE  75          1HB       PHE  75  -5.071   3.159  -8.682
  522    HD1  PHE  75           1HD      PHE  75  -4.189   0.224 -10.799
  523    HD2  PHE  75           2HD      PHE  75  -3.368   4.270  -9.765
  524    HE1  PHE  75           1HE      PHE  75  -2.544   0.354 -12.624
  525    HE2  PHE  75           2HE      PHE  75  -1.722   4.407 -11.588
  526    HZ   PHE  75           HZ       PHE  75  -1.308   2.447 -13.021
  527    H    GLU  76           H        GLU  76  -6.590   2.422  -7.175
  528    HA   GLU  76           HA       GLU  76  -5.630   3.927  -4.982
  529   1HB   GLU  76          2HB       GLU  76  -8.474   3.113  -5.607
  530   2HB   GLU  76          1HB       GLU  76  -7.982   4.405  -4.520
  531   1HG   GLU  76          2HG       GLU  76  -6.715   5.003  -6.912
  532   2HG   GLU  76          1HG       GLU  76  -8.310   4.423  -7.389
  533    H    GLU  77           H        GLU  77  -6.774   0.674  -5.292
  534    HA   GLU  77           HA       GLU  77  -7.647   0.129  -2.711
  535   1HB   GLU  77          2HB       GLU  77  -6.687  -1.421  -5.004
  536   2HB   GLU  77          1HB       GLU  77  -6.385  -2.200  -3.457
  537   1HG   GLU  77          2HG       GLU  77  -8.830  -1.791  -2.937
  538   2HG   GLU  77          1HG       GLU  77  -9.016  -1.375  -4.640
  539    H    PHE  78           H        PHE  78  -4.453   0.723  -3.882
  540    HA   PHE  78           HA       PHE  78  -3.027  -0.571  -1.788
  541   1HB   PHE  78          2HB       PHE  78  -2.119   0.142  -4.062
  542   2HB   PHE  78          1HB       PHE  78  -2.035   1.773  -3.407
  543    HD1  PHE  78           1HD      PHE  78  -0.225   2.446  -2.092
  544    HD2  PHE  78           2HD      PHE  78  -0.814  -1.689  -2.910
  545    HE1  PHE  78           1HE      PHE  78   1.981   1.944  -1.124
  546    HE2  PHE  78           2HE      PHE  78   1.391  -2.198  -1.943
  547    HZ   PHE  78           HZ       PHE  78   2.791  -0.381  -1.049
  548    H    LEU  79           H        LEU  79  -4.852   2.301  -1.906
  549    HA   LEU  79           HA       LEU  79  -3.399   3.569   0.278
  550   1HB   LEU  79          2HB       LEU  79  -5.803   4.410  -1.333
  551   2HB   LEU  79          1HB       LEU  79  -5.181   5.336   0.018
  552    HG   LEU  79           HG       LEU  79  -3.074   4.749  -1.875
  553   1HD1  LEU  79          1HD1      LEU  79  -5.654   5.745  -2.937
  554   2HD1  LEU  79          2HD1      LEU  79  -4.385   4.805  -3.725
  555   3HD1  LEU  79          3HD1      LEU  79  -4.181   6.541  -3.492
  556   1HD2  LEU  79          1HD2      LEU  79  -2.412   6.822  -1.303
  557   2HD2  LEU  79          2HD2      LEU  79  -3.610   6.648  -0.022
  558   3HD2  LEU  79          3HD2      LEU  79  -4.024   7.506  -1.507
  559    H    VAL  80           H        VAL  80  -6.476   1.963  -0.342
  560    HA   VAL  80           HA       VAL  80  -7.586   2.517   2.222
  561    HB   VAL  80           HB       VAL  80  -8.958   1.953   0.227
  562   1HG1  VAL  80          1HG1      VAL  80  -8.914  -0.890   0.440
  563   2HG1  VAL  80          2HG1      VAL  80  -7.276  -0.315   0.131
  564   3HG1  VAL  80          3HG1      VAL  80  -8.584   0.123  -0.966
  565   1HG2  VAL  80          1HG2      VAL  80 -10.161  -0.034   1.722
  566   2HG2  VAL  80          2HG2      VAL  80 -10.431   1.702   1.881
  567   3HG2  VAL  80          3HG2      VAL  80  -9.252   0.893   2.915
  568    H    MET  81           H        MET  81  -5.453   0.063   0.992
  569    HA   MET  81           HA       MET  81  -5.874  -1.972   2.855
  570   1HB   MET  81          2HB       MET  81  -3.400  -2.494   2.407
  571   2HB   MET  81          1HB       MET  81  -4.503  -2.526   1.039
  572   1HG   MET  81          2HG       MET  81  -3.608  -0.667   0.088
  573   2HG   MET  81          1HG       MET  81  -3.082   0.008   1.629
  574   1HE   MET  81          1HE       MET  81  -0.502  -0.481   2.642
  575   2HE   MET  81          2HE       MET  81   0.035  -2.151   2.459
  576   3HE   MET  81          3HE       MET  81  -1.571  -1.807   3.103
  577    H    MET  82           H        MET  82  -4.014   0.997   3.077
  578    HA   MET  82           HA       MET  82  -2.918   0.296   5.665
  579   1HB   MET  82          2HB       MET  82  -2.534   2.443   3.684
  580   2HB   MET  82          1HB       MET  82  -2.390   2.957   5.360
  581   1HG   MET  82          2HG       MET  82  -0.916   0.629   5.271
  582   2HG   MET  82          1HG       MET  82  -0.573   1.398   3.724
  583   1HE   MET  82          1HE       MET  82   0.536   4.608   4.175
  584   2HE   MET  82          2HE       MET  82   0.545   3.119   3.231
  585   3HE   MET  82          3HE       MET  82   1.966   3.576   4.172
  586    H    VAL  83           H        VAL  83  -5.551   2.163   4.343
  587    HA   VAL  83           HA       VAL  83  -6.177   3.668   6.655
  588    HB   VAL  83           HB       VAL  83  -8.095   2.778   4.497
  589   1HG1  VAL  83          1HG1      VAL  83  -8.209   5.310   6.105
  590   2HG1  VAL  83          2HG1      VAL  83  -8.952   3.814   6.672
  591   3HG1  VAL  83          3HG1      VAL  83  -9.484   4.542   5.157
  592   1HG2  VAL  83          1HG2      VAL  83  -6.949   5.473   4.336
  593   2HG2  VAL  83          2HG2      VAL  83  -7.263   4.294   3.063
  594   3HG2  VAL  83          3HG2      VAL  83  -5.800   4.169   4.039
  595    H    ARG  84           H        ARG  84  -6.963   0.427   5.612
  596    HA   ARG  84           HA       ARG  84  -9.049  -0.002   7.516
  597   1HB   ARG  84          2HB       ARG  84  -7.388  -1.923   5.881
  598   2HB   ARG  84          1HB       ARG  84  -8.730  -2.416   6.906
  599   1HG   ARG  84          2HG       ARG  84  -9.959  -0.537   5.445
  600   2HG   ARG  84          1HG       ARG  84  -8.739  -1.065   4.284
  601   1HD   ARG  84          2HD       ARG  84  -9.658  -3.125   4.052
  602   2HD   ARG  84          1HD       ARG  84 -10.200  -3.191   5.728
  603    HE   ARG  84           HE       ARG  84 -11.685  -2.243   3.460
  604   1HH1  ARG  84          1HH1      ARG  84 -11.333  -2.048   6.927
  605   2HH1  ARG  84          2HH1      ARG  84 -12.970  -1.549   7.191
  606   1HH2  ARG  84          1HH2      ARG  84 -13.838  -1.584   3.806
  607   2HH2  ARG  84          2HH2      ARG  84 -14.392  -1.286   5.419
  608    H    GLN  85           H        GLN  85  -5.726   0.282   7.861
  609    HA   GLN  85           HA       GLN  85  -5.752  -1.348  10.315
  610   1HB   GLN  85          2HB       GLN  85  -3.262  -0.493   8.854
  611   2HB   GLN  85          1HB       GLN  85  -3.436  -1.757  10.064
  612   1HG   GLN  85          2HG       GLN  85  -4.477  -1.808   7.242
  613   2HG   GLN  85          1HG       GLN  85  -3.136  -2.745   7.897
  614   1HE2  GLN  85          1HE2      GLN  85  -4.986  -4.153   6.670
  615   2HE2  GLN  85          2HE2      GLN  85  -6.003  -4.998   7.781
  616    H    MET  86           H        MET  86  -5.032   1.765   8.905
  617    HA   MET  86           HA       MET  86  -3.645   2.911  11.064
  618   1HB   MET  86          2HB       MET  86  -5.157   3.967   8.720
  619   2HB   MET  86          1HB       MET  86  -4.743   5.083  10.014
  620   1HG   MET  86          2HG       MET  86  -2.365   4.348   9.767
  621   2HG   MET  86          1HG       MET  86  -2.861   3.452   8.333
  622   1HE   MET  86          1HE       MET  86  -1.311   5.828   6.182
  623   2HE   MET  86          2HE       MET  86  -2.807   5.019   5.714
  624   3HE   MET  86          3HE       MET  86  -1.639   4.188   6.742
  625    H    LYS  87           H        LYS  87  -6.925   3.906  10.126
  626    HA   LYS  87           HA       LYS  87  -7.575   4.895  12.675
  627   1HB   LYS  87          2HB       LYS  87  -9.599   3.974  10.641
  628   2HB   LYS  87          1HB       LYS  87  -9.760   5.260  11.829
  629   1HG   LYS  87          2HG       LYS  87  -9.170   6.697  10.253
  630   2HG   LYS  87          1HG       LYS  87  -7.559   5.976  10.270
  631   1HD   LYS  87          2HD       LYS  87  -8.496   6.033   8.007
  632   2HD   LYS  87          1HD       LYS  87  -8.239   4.379   8.561
  633   1HE   LYS  87          2HE       LYS  87 -10.365   3.942   8.082
  634   2HE   LYS  87          1HE       LYS  87 -10.843   5.067   9.353
  635   1HZ   LYS  87          1HZ       LYS  87 -10.796   5.439   6.463
  636   2HZ   LYS  87          2HZ       LYS  87 -10.362   6.777   7.403
  637   3HZ   LYS  87          3HZ       LYS  87 -11.874   6.049   7.617
  638    H    GLU  88           H        GLU  88  -7.882   1.728  11.254
  639    HA   GLU  88           HA       GLU  88  -9.805   0.569  12.881
  640   1HB   GLU  88          2HB       GLU  88  -8.849  -0.557  10.936
  641   2HB   GLU  88          1HB       GLU  88  -7.298  -0.690  11.753
  642   1HG   GLU  88          2HG       GLU  88  -9.654  -1.860  13.110
  643   2HG   GLU  88          1HG       GLU  88  -9.052  -2.677  11.669
  644    H    ASP  89           H        ASP  89  -9.834   0.890  15.023
  645    HA   ASP  89           HA       ASP  89  -8.113  -0.517  16.723
  646   1HB   ASP  89          2HB       ASP  89  -7.132   2.076  15.950
  647   2HB   ASP  89          1HB       ASP  89  -7.491   2.072  17.673
  648    H    ALA  90           H        ALA  90 -10.183  -1.104  17.485
  649    HA   ALA  90           HA       ALA  90 -11.946  -1.029  18.923
  650   1HB   ALA  90          1HB       ALA  90 -11.678   0.102  20.925
  651   2HB   ALA  90          2HB       ALA  90 -10.865   1.469  20.163
  652   3HB   ALA  90          3HB       ALA  90 -10.013  -0.062  20.366
  653   2H    ARG 115          HN2       ARG 115   2.731  -1.587   9.664
  654    H    ARG 115           H        ARG 115   1.777  -2.679  10.582
  655   3H    ARG 115          HN3       ARG 115   2.743  -3.263   9.292
  656    HA   ARG 115           HA       ARG 115   1.413  -2.375   7.696
  657   1HB   ARG 115          2HB       ARG 115  -0.725  -3.340   8.157
  658   2HB   ARG 115          1HB       ARG 115   0.472  -4.304   9.009
  659   1HG   ARG 115          2HG       ARG 115  -0.104  -2.789  11.030
  660   2HG   ARG 115          1HG       ARG 115  -1.561  -2.413  10.111
  661   1HD   ARG 115          2HD       ARG 115  -2.423  -4.239  11.075
  662   2HD   ARG 115          1HD       ARG 115  -1.441  -5.140   9.922
  663    HE   ARG 115           HE       ARG 115   0.098  -4.543  12.202
  664   1HH1  ARG 115          1HH1      ARG 115  -2.561  -6.568  11.199
  665   2HH1  ARG 115          2HH1      ARG 115  -2.229  -7.799  12.371
  666   1HH2  ARG 115          1HH2      ARG 115   0.537  -6.160  13.744
  667   2HH2  ARG 115          2HH2      ARG 115  -0.471  -7.568  13.816
  668    H    MET 116           H        MET 116   0.656  -0.961  10.844
  669    HA   MET 116           HA       MET 116  -1.180   0.973   9.889
  670   1HB   MET 116          2HB       MET 116  -1.088   0.327  12.246
  671   2HB   MET 116          1HB       MET 116   0.537   0.984  12.380
  672   1HG   MET 116          2HG       MET 116  -0.603   3.195  11.593
  673   2HG   MET 116          1HG       MET 116  -2.071   2.406  12.164
  674   1HE   MET 116          1HE       MET 116  -1.570   4.894  13.040
  675   2HE   MET 116          2HE       MET 116  -0.056   5.243  13.875
  676   3HE   MET 116          3HE       MET 116  -1.527   4.946  14.802
  677    H    SER 117           H        SER 117   2.030   1.661  11.271
  678    HA   SER 117           HA       SER 117   2.213   4.053   9.641
  679   1HB   SER 117          2HB       SER 117   4.112   4.637  10.987
  680   2HB   SER 117          1HB       SER 117   2.884   3.989  12.074
  681    HG   SER 117           HG       SER 117   4.036   2.156  12.311
  682    H    ALA 118           H        ALA 118   2.314   2.866   7.606
  683    HA   ALA 118           HA       ALA 118   4.764   1.387   7.083
  684   1HB   ALA 118          1HB       ALA 118   2.251   1.037   6.167
  685   2HB   ALA 118          2HB       ALA 118   3.693   0.454   5.336
  686   3HB   ALA 118          3HB       ALA 118   2.946   1.974   4.844
  687    H    ASP 119           H        ASP 119   4.372   4.489   7.452
  688    HA   ASP 119           HA       ASP 119   5.046   5.766   5.069
  689   1HB   ASP 119          2HB       ASP 119   4.429   6.712   7.442
  690   2HB   ASP 119          1HB       ASP 119   6.175   6.725   7.672
  691    H    ALA 120           H        ALA 120   6.973   3.859   7.234
  692    HA   ALA 120           HA       ALA 120   9.537   4.766   6.634
  693   1HB   ALA 120          1HB       ALA 120   8.782   1.895   7.143
  694   2HB   ALA 120          2HB       ALA 120   8.927   3.115   8.408
  695   3HB   ALA 120          3HB       ALA 120  10.337   2.668   7.448
  696    H    MET 121           H        MET 121   8.004   1.859   5.239
  697    HA   MET 121           HA       MET 121   9.861   1.568   3.154
  698   1HB   MET 121          2HB       MET 121   8.387  -0.248   3.900
  699   2HB   MET 121          1HB       MET 121   6.990   0.627   3.290
  700   1HG   MET 121          2HG       MET 121   8.421   0.540   1.047
  701   2HG   MET 121          1HG       MET 121   9.062  -0.900   1.836
  702   1HE   MET 121          1HE       MET 121   5.203   0.423   2.127
  703   2HE   MET 121          2HE       MET 121   4.721  -0.175   0.539
  704   3HE   MET 121          3HE       MET 121   6.007   1.023   0.676
  705    H    LEU 122           H        LEU 122   6.837   3.339   3.381
  706    HA   LEU 122           HA       LEU 122   6.557   3.950   0.638
  707   1HB   LEU 122          2HB       LEU 122   5.439   5.001   3.186
  708   2HB   LEU 122          1HB       LEU 122   5.291   6.011   1.760
  709    HG   LEU 122           HG       LEU 122   4.118   4.174   0.597
  710   1HD1  LEU 122          1HD1      LEU 122   3.888   2.751   3.218
  711   2HD1  LEU 122          2HD1      LEU 122   5.239   2.421   2.133
  712   3HD1  LEU 122          3HD1      LEU 122   3.585   2.151   1.587
  713   1HD2  LEU 122          1HD2      LEU 122   2.803   5.864   1.699
  714   2HD2  LEU 122          2HD2      LEU 122   2.953   5.026   3.244
  715   3HD2  LEU 122          3HD2      LEU 122   2.035   4.294   1.928
  716    H    ARG 123           H        ARG 123   8.273   5.504   3.283
  717    HA   ARG 123           HA       ARG 123   9.050   7.756   1.625
  718   1HB   ARG 123          2HB       ARG 123   8.519   7.741   4.188
  719   2HB   ARG 123          1HB       ARG 123  10.190   7.217   4.340
  720   1HG   ARG 123          2HG       ARG 123  10.927   9.225   3.155
  721   2HG   ARG 123          1HG       ARG 123   9.248   9.751   3.012
  722   1HD   ARG 123          2HD       ARG 123   9.042  10.056   5.341
  723   2HD   ARG 123          1HD       ARG 123  10.529   9.166   5.667
  724    HE   ARG 123           HE       ARG 123  10.916  11.533   4.080
  725   1HH1  ARG 123          1HH1      ARG 123  10.674  10.272   7.326
  726   2HH1  ARG 123          2HH1      ARG 123  11.579  11.569   8.031
  727   1HH2  ARG 123          1HH2      ARG 123  12.107  13.240   5.007
  728   2HH2  ARG 123          2HH2      ARG 123  12.392  13.254   6.716
  729    H    ALA 124           H        ALA 124  10.247   4.650   2.390
  730    HA   ALA 124           HA       ALA 124  12.986   4.929   2.410
  731   1HB   ALA 124          1HB       ALA 124  11.889   2.797   2.773
  732   2HB   ALA 124          2HB       ALA 124  13.087   2.652   1.486
  733   3HB   ALA 124          3HB       ALA 124  11.372   2.752   1.087
  734    H    LEU 125           H        LEU 125  11.284   3.890  -0.538
  735    HA   LEU 125           HA       LEU 125  13.411   4.834  -2.205
  736   1HB   LEU 125          2HB       LEU 125  10.656   3.904  -3.011
  737   2HB   LEU 125          1HB       LEU 125  12.058   4.042  -4.055
  738    HG   LEU 125           HG       LEU 125  12.076   2.208  -1.677
  739   1HD1  LEU 125          1HD1      LEU 125  11.633   0.559  -3.796
  740   2HD1  LEU 125          2HD1      LEU 125  10.576   1.919  -4.174
  741   3HD1  LEU 125          3HD1      LEU 125  10.406   1.070  -2.638
  742   1HD2  LEU 125          1HD2      LEU 125  14.180   1.985  -2.373
  743   2HD2  LEU 125          2HD2      LEU 125  13.860   2.863  -3.869
  744   3HD2  LEU 125          3HD2      LEU 125  13.528   1.133  -3.773
  745    H    LEU 126           H        LEU 126  10.365   6.096  -1.103
  746    HA   LEU 126           HA       LEU 126   9.338   8.106  -1.373
  747   1HB   LEU 126          2HB       LEU 126  12.154   8.615  -1.500
  748   2HB   LEU 126          1HB       LEU 126  11.331   9.700  -2.604
  749    HG   LEU 126           HG       LEU 126  10.633   9.397   0.317
  750   1HD1  LEU 126          1HD1      LEU 126  12.927  10.474  -0.536
  751   2HD1  LEU 126          2HD1      LEU 126  12.030  11.091   0.851
  752   3HD1  LEU 126          3HD1      LEU 126  11.868  11.871  -0.722
  753   1HD2  LEU 126          1HD2      LEU 126   9.408  11.523  -0.094
  754   2HD2  LEU 126          2HD2      LEU 126   8.745  10.138  -0.960
  755   3HD2  LEU 126          3HD2      LEU 126   9.729  11.323  -1.818
  756    H    GLY 127           H        GLY 127   8.475   9.606  -2.981
  757   1HA   GLY 127          2HA       GLY 127   7.708   8.368  -5.344
  758   2HA   GLY 127          1HA       GLY 127   7.615  10.098  -5.053
  759    H    SER 128           H        SER 128  10.600  10.166  -4.666
  760    HA   SER 128           HA       SER 128  12.424  10.698  -5.915
  761   1HB   SER 128          2HB       SER 128  11.841   8.106  -6.497
  762   2HB   SER 128          1HB       SER 128  11.788   8.821  -8.109
  763    HG   SER 128           HG       SER 128  13.930   8.429  -6.408
  764    H    LYS 129           H        LYS 129  10.399  12.436  -6.292
  765    HA   LYS 129           HA       LYS 129  10.049  12.815  -9.165
  766   1HB   LYS 129          2HB       LYS 129   8.964  14.873  -7.367
  767   2HB   LYS 129          1HB       LYS 129   8.193  14.018  -8.694
  768   1HG   LYS 129          2HG       LYS 129   6.961  13.127  -7.046
  769   2HG   LYS 129          1HG       LYS 129   8.338  12.036  -6.877
  770   1HD   LYS 129          2HD       LYS 129   7.693  12.899  -4.704
  771   2HD   LYS 129          1HD       LYS 129   9.278  13.530  -5.153
  772   1HE   LYS 129          2HE       LYS 129   7.614  15.170  -4.138
  773   2HE   LYS 129          1HE       LYS 129   8.422  15.659  -5.625
  774   1HZ   LYS 129          1HZ       LYS 129   5.697  14.485  -5.480
  775   2HZ   LYS 129          2HZ       LYS 129   6.467  15.055  -6.874
  776   3HZ   LYS 129          3HZ       LYS 129   6.032  16.135  -5.647
  777    H    HIS 130           H        HIS 130  11.346  14.538  -6.350
  778    HA   HIS 130           HA       HIS 130  12.978  16.108  -6.152
  779   1HB   HIS 130          2HB       HIS 130  14.270  14.665  -7.691
  780   2HB   HIS 130          1HB       HIS 130  13.570  15.521  -9.060
  781    HD1  HIS 130           1HD      HIS 130  14.465  17.651  -6.195
  782    HD2  HIS 130           2HD      HIS 130  16.264  16.295  -9.686
  783    HE1  HIS 130           1HE      HIS 130  16.477  19.124  -6.530
  784    HE2  HIS 130           2HE      HIS 130  17.499  18.341  -8.696
  785    H    LYS 131           H        LYS 131  11.808  16.535  -9.501
  786    HA   LYS 131           HA       LYS 131  11.827  19.321  -9.469
  787   1HB   LYS 131          2HB       LYS 131   9.945  17.574 -11.060
  788   2HB   LYS 131          1HB       LYS 131  10.439  19.217 -11.447
  789   1HG   LYS 131          2HG       LYS 131  12.409  18.563 -12.320
  790   2HG   LYS 131          1HG       LYS 131  12.621  17.261 -11.149
  791   1HD   LYS 131          2HD       LYS 131  10.642  17.162 -13.418
  792   2HD   LYS 131          1HD       LYS 131  12.279  16.512 -13.520
  793   1HE   LYS 131          2HE       LYS 131  10.518  15.678 -11.262
  794   2HE   LYS 131          1HE       LYS 131  10.257  14.975 -12.857
  795   1HZ   LYS 131          1HZ       LYS 131  12.873  14.669 -12.648
  796   2HZ   LYS 131          2HZ       LYS 131  11.774  13.513 -12.085
  797   3HZ   LYS 131          3HZ       LYS 131  12.474  14.609 -11.005
  Start of MODEL    2
    1   2H    ALA   1          HN2       ALA   1 -21.145   2.238 -11.914
    2    H    ALA   1           H        ALA   1 -20.677   1.222 -13.216
    3   3H    ALA   1          HN3       ALA   1 -22.337   1.547 -12.938
    4    HA   ALA   1           HA       ALA   1 -22.458   0.228 -11.135
    5   1HB   ALA   1          1HB       ALA   1 -21.799  -1.867 -11.871
    6   2HB   ALA   1          2HB       ALA   1 -20.299  -1.260 -12.573
    7   3HB   ALA   1          3HB       ALA   1 -21.839  -0.929 -13.364
    8    H    SER   2           H        SER   2 -21.773   0.882  -9.173
    9    HA   SER   2           HA       SER   2 -18.899   0.731  -8.579
   10   1HB   SER   2          2HB       SER   2 -21.118   2.134  -7.070
   11   2HB   SER   2          1HB       SER   2 -19.413   2.144  -6.620
   12    HG   SER   2           HG       SER   2 -19.024   3.110  -8.717
   13    H    MET   3           H        MET   3 -18.413   0.079  -6.257
   14    HA   MET   3           HA       MET   3 -20.261  -1.759  -5.028
   15   1HB   MET   3          2HB       MET   3 -18.390  -2.741  -6.931
   16   2HB   MET   3          1HB       MET   3 -17.858  -3.276  -5.343
   17   1HG   MET   3          2HG       MET   3 -19.703  -4.579  -5.006
   18   2HG   MET   3          1HG       MET   3 -20.721  -3.605  -6.067
   19   1HE   MET   3          1HE       MET   3 -19.462  -3.207  -8.555
   20   2HE   MET   3          2HE       MET   3 -20.920  -4.157  -8.839
   21   3HE   MET   3          3HE       MET   3 -19.397  -4.633  -9.590
   22    H    THR   4           H        THR   4 -16.891  -0.654  -5.187
   23    HA   THR   4           HA       THR   4 -16.952  -0.280  -2.281
   24    HB   THR   4           HB       THR   4 -15.809  -2.394  -2.617
   25    HG1  THR   4           1HG      THR   4 -14.013  -1.898  -1.487
   26   1HG2  THR   4          1HG2      THR   4 -13.406  -1.658  -3.872
   27   2HG2  THR   4          2HG2      THR   4 -14.720  -1.139  -4.928
   28   3HG2  THR   4          3HG2      THR   4 -14.612  -2.824  -4.418
   29    H    ASP   5           H        ASP   5 -16.611   1.806  -1.935
   30    HA   ASP   5           HA       ASP   5 -14.860   3.284  -3.776
   31   1HB   ASP   5          2HB       ASP   5 -17.068   4.231  -1.943
   32   2HB   ASP   5          1HB       ASP   5 -15.992   5.319  -2.825
   33    H    GLN   6           H        GLN   6 -14.610   1.760  -0.910
   34    HA   GLN   6           HA       GLN   6 -13.549   3.571   0.900
   35   1HB   GLN   6          2HB       GLN   6 -12.474   1.689   1.962
   36   2HB   GLN   6          1HB       GLN   6 -14.061   1.194   1.390
   37   1HG   GLN   6          2HG       GLN   6 -13.111   0.024  -0.458
   38   2HG   GLN   6          1HG       GLN   6 -11.510   0.677  -0.116
   39   1HE2  GLN   6          1HE2      GLN   6 -10.886  -1.588  -0.139
   40   2HE2  GLN   6          2HE2      GLN   6 -11.070  -2.524   1.301
   41    H    GLN   7           H        GLN   7 -12.195   2.367  -2.042
   42    HA   GLN   7           HA       GLN   7  -9.464   2.957  -1.414
   43   1HB   GLN   7          2HB       GLN   7 -10.639   2.704  -4.178
   44   2HB   GLN   7          1HB       GLN   7  -8.979   2.414  -3.680
   45   1HG   GLN   7          2HG       GLN   7  -9.412   0.333  -2.941
   46   2HG   GLN   7          1HG       GLN   7 -11.028   0.746  -2.374
   47   1HE2  GLN   7          1HE2      GLN   7 -10.983  -1.555  -3.520
   48   2HE2  GLN   7          2HE2      GLN   7 -11.572  -1.524  -5.144
   49    H    ALA   8           H        ALA   8 -12.166   4.765  -2.557
   50    HA   ALA   8           HA       ALA   8 -10.630   6.890  -3.731
   51   1HB   ALA   8          1HB       ALA   8 -13.184   6.102  -4.048
   52   2HB   ALA   8          2HB       ALA   8 -12.604   7.720  -4.449
   53   3HB   ALA   8          3HB       ALA   8 -13.411   7.429  -2.907
   54    H    GLU   9           H        GLU   9 -12.582   6.551  -0.763
   55    HA   GLU   9           HA       GLU   9 -12.019   9.074   0.306
   56   1HB   GLU   9          2HB       GLU   9 -12.490   6.529   1.870
   57   2HB   GLU   9          1HB       GLU   9 -12.739   8.174   2.438
   58   1HG   GLU   9          2HG       GLU   9 -14.521   8.467   0.782
   59   2HG   GLU   9          1HG       GLU   9 -14.282   6.800   0.247
   60    H    ALA  10           H        ALA  10 -10.300   6.019   0.482
   61    HA   ALA  10           HA       ALA  10  -8.423   6.400   2.409
   62   1HB   ALA  10          1HB       ALA  10  -8.412   5.025  -0.225
   63   2HB   ALA  10          2HB       ALA  10  -8.236   4.361   1.400
   64   3HB   ALA  10          3HB       ALA  10  -6.879   5.192   0.637
   65    H    ARG  11           H        ARG  11  -8.041   7.396  -0.994
   66    HA   ARG  11           HA       ARG  11  -5.597   8.681  -0.768
   67   1HB   ARG  11          2HB       ARG  11  -7.478   8.309  -2.766
   68   2HB   ARG  11          1HB       ARG  11  -7.433  10.056  -2.575
   69   1HG   ARG  11          2HG       ARG  11  -4.960   9.956  -2.842
   70   2HG   ARG  11          1HG       ARG  11  -5.123   8.237  -3.209
   71   1HD   ARG  11          2HD       ARG  11  -5.064   9.262  -5.307
   72   2HD   ARG  11          1HD       ARG  11  -6.780   8.975  -5.017
   73    HE   ARG  11           HE       ARG  11  -7.120  11.241  -4.949
   74   1HH1  ARG  11          1HH1      ARG  11  -3.696  10.596  -4.761
   75   2HH1  ARG  11          2HH1      ARG  11  -3.246  12.257  -4.957
   76   1HH2  ARG  11          1HH2      ARG  11  -6.530  13.425  -5.207
   77   2HH2  ARG  11          2HH2      ARG  11  -4.854  13.863  -5.210
   78    H    ALA  12           H        ALA  12  -8.736   9.705   0.275
   79    HA   ALA  12           HA       ALA  12  -7.804  12.437   0.752
   80   1HB   ALA  12          1HB       ALA  12 -10.558  11.242   1.046
   81   2HB   ALA  12          2HB       ALA  12  -9.975  12.188  -0.324
   82   3HB   ALA  12          3HB       ALA  12 -10.143  12.943   1.261
   83    H    PHE  13           H        PHE  13  -8.231   9.467   2.400
   84    HA   PHE  13           HA       PHE  13  -8.818  10.482   4.987
   85   1HB   PHE  13          2HB       PHE  13  -9.236   8.142   4.380
   86   2HB   PHE  13          1HB       PHE  13  -7.500   7.875   4.191
   87    HD1  PHE  13           1HD      PHE  13 -10.016   8.975   6.707
   88    HD2  PHE  13           2HD      PHE  13  -6.271   7.090   5.979
   89    HE1  PHE  13           1HE      PHE  13  -9.851   8.390   9.091
   90    HE2  PHE  13           2HE      PHE  13  -6.100   6.500   8.361
   91    HZ   PHE  13           HZ       PHE  13  -7.892   7.151   9.921
   92    H    LEU  14           H        LEU  14  -5.868  10.046   3.177
   93    HA   LEU  14           HA       LEU  14  -4.312  10.862   5.540
   94   1HB   LEU  14          2HB       LEU  14  -2.951   9.878   3.087
   95   2HB   LEU  14          1HB       LEU  14  -2.508   9.677   4.778
   96    HG   LEU  14           HG       LEU  14  -4.867   8.215   4.514
   97   1HD1  LEU  14          1HD1      LEU  14  -3.071   7.612   2.173
   98   2HD1  LEU  14          2HD1      LEU  14  -4.618   8.449   2.057
   99   3HD1  LEU  14          3HD1      LEU  14  -4.559   6.778   2.620
  100   1HD2  LEU  14          1HD2      LEU  14  -2.387   7.853   5.532
  101   2HD2  LEU  14          2HD2      LEU  14  -2.348   6.739   4.166
  102   3HD2  LEU  14          3HD2      LEU  14  -3.600   6.581   5.398
  103    H    SER  15           H        SER  15  -2.165  12.004   4.708
  104    HA   SER  15           HA       SER  15  -3.089  14.398   3.319
  105   1HB   SER  15          2HB       SER  15  -0.301  14.230   4.345
  106   2HB   SER  15          1HB       SER  15  -1.475  15.549   4.461
  107    HG   SER  15           HG       SER  15  -1.189  13.269   6.082
  108    H    GLU  16           H        GLU  16  -1.646  15.428   1.710
  109    HA   GLU  16           HA       GLU  16  -1.131  13.830  -0.479
  110   1HB   GLU  16          2HB       GLU  16  -1.049  16.495  -0.035
  111   2HB   GLU  16          1HB       GLU  16   0.673  16.158  -0.141
  112   1HG   GLU  16          2HG       GLU  16   0.596  15.764  -2.348
  113   2HG   GLU  16          1HG       GLU  16  -0.966  14.952  -2.256
  114    H    GLU  17           H        GLU  17   0.819  14.430   2.320
  115    HA   GLU  17           HA       GLU  17   3.338  13.642   1.391
  116   1HB   GLU  17          2HB       GLU  17   1.998  13.914   4.017
  117   2HB   GLU  17          1HB       GLU  17   3.394  12.843   3.979
  118   1HG   GLU  17          2HG       GLU  17   4.417  14.806   4.492
  119   2HG   GLU  17          1HG       GLU  17   4.504  14.873   2.732
  120    H    MET  18           H        MET  18   0.808  11.751   3.027
  121    HA   MET  18           HA       MET  18   2.157   9.276   2.870
  122   1HB   MET  18          2HB       MET  18  -0.085  10.175   4.140
  123   2HB   MET  18          1HB       MET  18  -0.788   9.176   2.868
  124   1HG   MET  18          2HG       MET  18  -0.558   7.693   4.614
  125   2HG   MET  18          1HG       MET  18   0.894   7.389   3.662
  126   1HE   MET  18          1HE       MET  18   1.610   7.064   7.664
  127   2HE   MET  18          2HE       MET  18   1.263   6.118   6.216
  128   3HE   MET  18          3HE       MET  18  -0.027   7.026   7.006
  129    H    ILE  19           H        ILE  19   0.393  11.092   0.539
  130    HA   ILE  19           HA       ILE  19  -0.268   8.847  -1.145
  131    HB   ILE  19           HB       ILE  19  -0.430  11.830  -1.542
  132   1HG1  ILE  19          2HG1      ILE  19  -2.538   9.663  -1.395
  133   2HG1  ILE  19          1HG1      ILE  19  -2.121  10.780  -0.093
  134   1HG2  ILE  19          1HG2      ILE  19   0.026  11.179  -3.720
  135   2HG2  ILE  19          2HG2      ILE  19  -1.738  11.129  -3.663
  136   3HG2  ILE  19          3HG2      ILE  19  -0.809   9.634  -3.540
  137   1HD1  ILE  19          1HD1      ILE  19  -3.089  12.585  -1.171
  138   2HD1  ILE  19          2HD1      ILE  19  -4.190  11.258  -1.539
  139   3HD1  ILE  19          3HD1      ILE  19  -3.029  11.803  -2.750
  140    H    ALA  20           H        ALA  20   1.793  11.711  -1.682
  141    HA   ALA  20           HA       ALA  20   3.124  10.847  -3.929
  142   1HB   ALA  20          1HB       ALA  20   3.989  12.637  -1.681
  143   2HB   ALA  20          2HB       ALA  20   3.423  13.081  -3.291
  144   3HB   ALA  20          3HB       ALA  20   5.012  12.341  -3.088
  145    H    GLU  21           H        GLU  21   3.542   9.846  -0.639
  146    HA   GLU  21           HA       GLU  21   6.050   8.485  -1.162
  147   1HB   GLU  21          2HB       GLU  21   4.309   8.497   1.313
  148   2HB   GLU  21          1HB       GLU  21   5.930   7.828   1.200
  149   1HG   GLU  21          2HG       GLU  21   6.923   9.921   1.055
  150   2HG   GLU  21          1HG       GLU  21   5.418  10.707   0.581
  151    H    PHE  22           H        PHE  22   2.641   7.821  -0.861
  152    HA   PHE  22           HA       PHE  22   2.721   5.032  -0.564
  153   1HB   PHE  22          2HB       PHE  22   0.739   7.061  -1.161
  154   2HB   PHE  22          1HB       PHE  22   0.465   5.617  -2.128
  155    HD1  PHE  22           1HD      PHE  22  -0.940   7.030   0.430
  156    HD2  PHE  22           2HD      PHE  22   1.332   3.504  -0.278
  157    HE1  PHE  22           1HE      PHE  22  -2.026   5.948   2.354
  158    HE2  PHE  22           2HE      PHE  22   0.250   2.414   1.645
  159    HZ   PHE  22           HZ       PHE  22  -1.432   3.639   2.961
  160    H    LYS  23           H        LYS  23   2.951   7.125  -3.360
  161    HA   LYS  23           HA       LYS  23   2.835   4.976  -5.267
  162   1HB   LYS  23          2HB       LYS  23   2.175   7.472  -5.585
  163   2HB   LYS  23          1HB       LYS  23   3.898   7.720  -5.868
  164   1HG   LYS  23          2HG       LYS  23   2.879   7.458  -7.985
  165   2HG   LYS  23          1HG       LYS  23   3.754   5.962  -7.653
  166   1HD   LYS  23          2HD       LYS  23   1.819   4.979  -8.256
  167   2HD   LYS  23          1HD       LYS  23   1.322   5.375  -6.605
  168   1HE   LYS  23          2HE       LYS  23   0.684   7.676  -7.787
  169   2HE   LYS  23          1HE       LYS  23   0.536   6.612  -9.185
  170   1HZ   LYS  23          1HZ       LYS  23  -0.806   5.199  -7.411
  171   2HZ   LYS  23          2HZ       LYS  23  -1.541   6.393  -8.357
  172   3HZ   LYS  23          3HZ       LYS  23  -1.084   6.739  -6.766
  173    H    ALA  24           H        ALA  24   5.191   6.104  -3.174
  174    HA   ALA  24           HA       ALA  24   7.568   6.198  -4.499
  175   1HB   ALA  24          1HB       ALA  24   8.591   5.222  -2.443
  176   2HB   ALA  24          2HB       ALA  24   6.963   4.891  -1.854
  177   3HB   ALA  24          3HB       ALA  24   7.477   6.555  -2.140
  178    H    ALA  25           H        ALA  25   6.625   3.184  -2.873
  179    HA   ALA  25           HA       ALA  25   8.354   1.614  -4.499
  180   1HB   ALA  25          1HB       ALA  25   8.045   0.863  -2.299
  181   2HB   ALA  25          2HB       ALA  25   7.190  -0.304  -3.307
  182   3HB   ALA  25          3HB       ALA  25   6.289   0.934  -2.432
  183    H    PHE  26           H        PHE  26   5.378   2.911  -5.229
  184    HA   PHE  26           HA       PHE  26   3.845   0.957  -6.371
  185   1HB   PHE  26          2HB       PHE  26   3.682   3.627  -6.328
  186   2HB   PHE  26          1HB       PHE  26   4.209   3.419  -7.994
  187    HD1  PHE  26           1HD      PHE  26   2.837   1.977  -9.525
  188    HD2  PHE  26           2HD      PHE  26   1.467   3.209  -5.690
  189    HE1  PHE  26           1HE      PHE  26   0.524   1.464 -10.192
  190    HE2  PHE  26           2HE      PHE  26  -0.848   2.698  -6.348
  191    HZ   PHE  26           HZ       PHE  26  -1.322   1.824  -8.601
  192    H    ASP  27           H        ASP  27   6.894   2.193  -7.520
  193    HA   ASP  27           HA       ASP  27   6.653   1.000 -10.133
  194   1HB   ASP  27          2HB       ASP  27   8.683   2.612  -8.686
  195   2HB   ASP  27          1HB       ASP  27   9.282   1.545  -9.953
  196    H    MET  28           H        MET  28   8.855   0.439  -7.378
  197    HA   MET  28           HA       MET  28   9.956  -1.944  -8.333
  198   1HB   MET  28          2HB       MET  28   9.556  -1.075  -5.465
  199   2HB   MET  28          1HB       MET  28  10.638  -2.356  -5.999
  200   1HG   MET  28          2HG       MET  28  10.961   0.360  -7.164
  201   2HG   MET  28          1HG       MET  28  11.516   0.067  -5.511
  202   1HE   MET  28          1HE       MET  28  13.511   1.142  -7.030
  203   2HE   MET  28          2HE       MET  28  14.837   0.068  -7.475
  204   3HE   MET  28          3HE       MET  28  14.311   0.171  -5.795
  205    H    PHE  29           H        PHE  29   6.945  -1.307  -6.713
  206    HA   PHE  29           HA       PHE  29   6.318  -3.844  -5.739
  207   1HB   PHE  29          2HB       PHE  29   4.746  -1.459  -6.590
  208   2HB   PHE  29          1HB       PHE  29   3.876  -2.980  -6.381
  209    HD1  PHE  29           1HD      PHE  29   4.383  -0.077  -4.813
  210    HD2  PHE  29           2HD      PHE  29   4.987  -4.225  -4.093
  211    HE1  PHE  29           1HE      PHE  29   4.278   0.335  -2.393
  212    HE2  PHE  29           2HE      PHE  29   4.880  -3.820  -1.668
  213    HZ   PHE  29           HZ       PHE  29   4.525  -1.540  -0.815
  214    H    ASP  30           H        ASP  30   4.786  -2.476  -8.638
  215    HA   ASP  30           HA       ASP  30   3.983  -4.933  -9.690
  216   1HB   ASP  30          2HB       ASP  30   4.349  -2.201 -10.893
  217   2HB   ASP  30          1HB       ASP  30   3.858  -3.574 -11.890
  218    H    ALA  31           H        ALA  31   5.119  -6.516 -10.527
  219    HA   ALA  31           HA       ALA  31   7.857  -6.052 -11.414
  220   1HB   ALA  31          1HB       ALA  31   6.362  -8.654 -11.121
  221   2HB   ALA  31          2HB       ALA  31   7.357  -7.912  -9.867
  222   3HB   ALA  31          3HB       ALA  31   8.097  -8.455 -11.373
  223    H    ASP  32           H        ASP  32   4.865  -7.526 -12.638
  224    HA   ASP  32           HA       ASP  32   5.958  -7.668 -15.326
  225   1HB   ASP  32          2HB       ASP  32   3.780  -8.725 -15.887
  226   2HB   ASP  32          1HB       ASP  32   4.617  -9.543 -14.565
  227    H    GLY  33           H        GLY  33   3.856  -5.662 -13.433
  228   1HA   GLY  33          2HA       GLY  33   3.033  -3.557 -13.905
  229   2HA   GLY  33          1HA       GLY  33   3.826  -3.645 -15.471
  230    H    GLY  34           H        GLY  34   1.130  -5.274 -13.784
  231   1HA   GLY  34          2HA       GLY  34  -0.991  -4.388 -15.208
  232   2HA   GLY  34          1HA       GLY  34  -0.293  -5.597 -16.284
  233    H    GLY  35           H        GLY  35  -0.530  -5.623 -12.739
  234   1HA   GLY  35          2HA       GLY  35  -2.714  -7.480 -12.714
  235   2HA   GLY  35          1HA       GLY  35  -1.167  -8.278 -12.439
  236    H    ASP  36           H        ASP  36  -1.791  -5.011 -11.361
  237    HA   ASP  36           HA       ASP  36  -1.729  -4.076  -9.285
  238   1HB   ASP  36          2HB       ASP  36  -3.504  -6.469  -8.884
  239   2HB   ASP  36          1HB       ASP  36  -3.146  -5.369  -7.548
  240    H    ILE  37           H        ILE  37  -1.431  -4.776  -6.784
  241    HA   ILE  37           HA       ILE  37   1.143  -6.145  -6.755
  242    HB   ILE  37           HB       ILE  37  -0.262  -4.451  -4.693
  243   1HG1  ILE  37          2HG1      ILE  37   2.228  -3.999  -6.350
  244   2HG1  ILE  37          1HG1      ILE  37   0.660  -3.229  -6.605
  245   1HG2  ILE  37          1HG2      ILE  37   0.924  -5.804  -3.288
  246   2HG2  ILE  37          2HG2      ILE  37   2.155  -4.596  -3.657
  247   3HG2  ILE  37          3HG2      ILE  37   2.168  -6.151  -4.488
  248   1HD1  ILE  37          1HD1      ILE  37   0.844  -2.094  -4.483
  249   2HD1  ILE  37          2HD1      ILE  37   2.262  -1.762  -5.478
  250   3HD1  ILE  37          3HD1      ILE  37   2.367  -2.918  -4.149
  251    H    SER  38           H        SER  38   1.422  -8.126  -5.982
  252    HA   SER  38           HA       SER  38  -0.821  -9.429  -4.614
  253   1HB   SER  38          2HB       SER  38   0.195 -10.402  -6.753
  254   2HB   SER  38          1HB       SER  38   1.605 -10.810  -5.766
  255    HG   SER  38           HG       SER  38  -0.103 -12.464  -6.000
  256    H    THR  39           H        THR  39   0.627 -11.547  -3.457
  257    HA   THR  39           HA       THR  39   1.411 -10.365  -1.009
  258    HB   THR  39           HB       THR  39   2.308 -12.816  -0.636
  259    HG1  THR  39           1HG      THR  39   2.232 -13.798  -2.514
  260   1HG2  THR  39          1HG2      THR  39  -0.024 -13.643  -0.302
  261   2HG2  THR  39          2HG2      THR  39  -0.593 -12.119  -0.985
  262   3HG2  THR  39          3HG2      THR  39   0.352 -12.120   0.505
  263    H    LYS  40           H        LYS  40   3.357 -12.328  -3.270
  264    HA   LYS  40           HA       LYS  40   5.831 -11.842  -2.112
  265   1HB   LYS  40          2HB       LYS  40   6.760 -12.387  -4.392
  266   2HB   LYS  40          1HB       LYS  40   5.642 -13.577  -3.728
  267   1HG   LYS  40          2HG       LYS  40   4.661 -13.475  -5.729
  268   2HG   LYS  40          1HG       LYS  40   3.957 -11.964  -5.135
  269   1HD   LYS  40          2HD       LYS  40   5.464 -10.652  -6.311
  270   2HD   LYS  40          1HD       LYS  40   6.647 -11.956  -6.447
  271   1HE   LYS  40          2HE       LYS  40   5.402 -13.047  -8.125
  272   2HE   LYS  40          1HE       LYS  40   3.966 -12.077  -7.799
  273   1HZ   LYS  40          1HZ       LYS  40   4.740 -11.005  -9.624
  274   2HZ   LYS  40          2HZ       LYS  40   6.358 -11.400  -9.331
  275   3HZ   LYS  40          3HZ       LYS  40   5.622 -10.152  -8.458
  276    H    GLU  41           H        GLU  41   4.011  -9.903  -4.405
  277    HA   GLU  41           HA       GLU  41   6.021  -8.158  -5.238
  278   1HB   GLU  41          2HB       GLU  41   3.046  -7.857  -4.945
  279   2HB   GLU  41          1HB       GLU  41   4.040  -6.514  -5.493
  280   1HG   GLU  41          2HG       GLU  41   4.790  -8.767  -7.013
  281   2HG   GLU  41          1HG       GLU  41   3.028  -8.730  -6.973
  282    H    LEU  42           H        LEU  42   4.321  -8.349  -2.218
  283    HA   LEU  42           HA       LEU  42   5.036  -5.685  -1.385
  284   1HB   LEU  42          2HB       LEU  42   3.294  -7.772  -0.464
  285   2HB   LEU  42          1HB       LEU  42   4.318  -7.235   0.863
  286    HG   LEU  42           HG       LEU  42   2.234  -6.000   0.866
  287   1HD1  LEU  42          1HD1      LEU  42   3.907  -4.658   1.720
  288   2HD1  LEU  42          2HD1      LEU  42   3.242  -3.646   0.438
  289   3HD1  LEU  42          3HD1      LEU  42   4.743  -4.532   0.172
  290   1HD2  LEU  42          1HD2      LEU  42   1.324  -4.904  -0.929
  291   2HD2  LEU  42          2HD2      LEU  42   2.083  -6.274  -1.740
  292   3HD2  LEU  42          3HD2      LEU  42   2.879  -4.701  -1.736
  293    H    GLY  43           H        GLY  43   5.901  -8.949  -0.218
  294   1HA   GLY  43          2HA       GLY  43   7.827  -8.290   1.621
  295   2HA   GLY  43          1HA       GLY  43   7.885  -9.749   0.635
  296    H    THR  44           H        THR  44   8.093  -8.127  -1.850
  297    HA   THR  44           HA       THR  44  10.872  -8.131  -2.128
  298    HB   THR  44           HB       THR  44   8.587  -7.057  -3.727
  299    HG1  THR  44           1HG      THR  44  10.675  -8.917  -4.148
  300   1HG2  THR  44          1HG2      THR  44   9.946  -5.317  -4.347
  301   2HG2  THR  44          2HG2      THR  44  10.394  -6.552  -5.526
  302   3HG2  THR  44          3HG2      THR  44  11.427  -6.251  -4.128
  303    H    VAL  45           H        VAL  45   8.994  -5.174  -2.600
  304    HA   VAL  45           HA       VAL  45  11.101  -3.432  -2.029
  305    HB   VAL  45           HB       VAL  45   9.191  -2.715  -3.319
  306   1HG1  VAL  45          1HG1      VAL  45   7.313  -3.770  -2.557
  307   2HG1  VAL  45          2HG1      VAL  45   7.070  -2.167  -1.861
  308   3HG1  VAL  45          3HG1      VAL  45   7.696  -3.479  -0.859
  309   1HG2  VAL  45          1HG2      VAL  45   8.728  -0.923  -1.060
  310   2HG2  VAL  45          2HG2      VAL  45   9.377  -0.582  -2.664
  311   3HG2  VAL  45          3HG2      VAL  45  10.435  -1.205  -1.399
  312    H    MET  46           H        MET  46   8.737  -4.924   0.070
  313    HA   MET  46           HA       MET  46   9.138  -3.184   2.282
  314   1HB   MET  46          2HB       MET  46   7.842  -5.856   1.901
  315   2HB   MET  46          1HB       MET  46   8.097  -5.228   3.531
  316   1HG   MET  46          2HG       MET  46   6.961  -3.152   1.984
  317   2HG   MET  46          1HG       MET  46   6.034  -4.621   1.667
  318   1HE   MET  46          1HE       MET  46   5.756  -1.540   4.006
  319   2HE   MET  46          2HE       MET  46   7.413  -2.146   4.066
  320   3HE   MET  46          3HE       MET  46   6.394  -2.223   5.503
  321    H    ARG  47           H        ARG  47  10.688  -6.145   1.208
  322    HA   ARG  47           HA       ARG  47  12.163  -6.442   3.683
  323   1HB   ARG  47          2HB       ARG  47  12.207  -7.942   1.069
  324   2HB   ARG  47          1HB       ARG  47  13.328  -8.288   2.378
  325   1HG   ARG  47          2HG       ARG  47  11.566  -8.955   3.825
  326   2HG   ARG  47          1HG       ARG  47  10.340  -8.367   2.699
  327   1HD   ARG  47          2HD       ARG  47  11.019 -10.055   1.070
  328   2HD   ARG  47          1HD       ARG  47  12.267 -10.632   2.180
  329    HE   ARG  47           HE       ARG  47   9.612 -10.675   3.288
  330   1HH1  ARG  47          1HH1      ARG  47  11.954 -12.439   1.395
  331   2HH1  ARG  47          2HH1      ARG  47  11.262 -13.986   1.751
  332   1HH2  ARG  47          1HH2      ARG  47   8.701 -12.709   3.758
  333   2HH2  ARG  47          2HH2      ARG  47   9.415 -14.140   3.091
  334    H    MET  48           H        MET  48  12.654  -5.009   0.552
  335    HA   MET  48           HA       MET  48  15.521  -4.731   1.017
  336   1HB   MET  48          2HB       MET  48  15.611  -3.812  -1.247
  337   2HB   MET  48          1HB       MET  48  14.789  -5.372  -1.224
  338   1HG   MET  48          2HG       MET  48  12.912  -4.506  -2.033
  339   2HG   MET  48          1HG       MET  48  12.947  -3.158  -0.898
  340   1HE   MET  48          1HE       MET  48  12.393  -1.196  -1.908
  341   2HE   MET  48          2HE       MET  48  11.770  -1.887  -3.407
  342   3HE   MET  48          3HE       MET  48  12.912  -0.543  -3.462
  343    H    LEU  49           H        LEU  49  13.065  -3.181   2.295
  344    HA   LEU  49           HA       LEU  49  14.304  -0.526   1.986
  345   1HB   LEU  49          2HB       LEU  49  11.429  -1.324   2.283
  346   2HB   LEU  49          1HB       LEU  49  11.965   0.270   2.781
  347    HG   LEU  49           HG       LEU  49  12.063  -0.897   0.002
  348   1HD1  LEU  49          1HD1      LEU  49   9.910  -0.117   0.336
  349   2HD1  LEU  49          2HD1      LEU  49  10.718   1.279  -0.375
  350   3HD1  LEU  49          3HD1      LEU  49  10.439   1.212   1.365
  351   1HD2  LEU  49          1HD2      LEU  49  12.834   1.562  -0.466
  352   2HD2  LEU  49          2HD2      LEU  49  14.006   0.322  -0.025
  353   3HD2  LEU  49          3HD2      LEU  49  13.436   1.467   1.189
  354    H    GLY  50           H        GLY  50  12.692  -2.755   4.218
  355   1HA   GLY  50          2HA       GLY  50  14.366  -2.390   6.362
  356   2HA   GLY  50          1HA       GLY  50  13.159  -1.116   6.523
  357    H    GLN  51           H        GLN  51  10.928  -2.554   5.532
  358    HA   GLN  51           HA       GLN  51  10.132  -3.899   7.896
  359   1HB   GLN  51          2HB       GLN  51   8.821  -2.744   5.784
  360   2HB   GLN  51          1HB       GLN  51   8.545  -4.460   5.485
  361   1HG   GLN  51          2HG       GLN  51   6.721  -3.723   6.765
  362   2HG   GLN  51          1HG       GLN  51   7.756  -4.617   7.877
  363   1HE2  GLN  51          1HE2      GLN  51   7.749  -1.293   6.626
  364   2HE2  GLN  51          2HE2      GLN  51   7.797  -0.530   8.174
  365    H    ASN  52           H        ASN  52   9.291  -6.132   7.975
  366    HA   ASN  52           HA       ASN  52  10.528  -7.980   6.084
  367   1HB   ASN  52          2HB       ASN  52  12.057  -7.519   8.107
  368   2HB   ASN  52          1HB       ASN  52  10.878  -8.447   9.036
  369   1HD2  ASN  52          1HD2      ASN  52  11.230 -10.536   9.182
  370   2HD2  ASN  52          2HD2      ASN  52  12.190 -11.486   8.105
  371    HA   PRO  53           HA       PRO  53   6.330  -9.240   7.879
  372   1HB   PRO  53          2HB       PRO  53   4.699  -8.574   5.849
  373   2HB   PRO  53          1HB       PRO  53   5.147  -7.412   7.103
  374   1HG   PRO  53          2HG       PRO  53   6.254  -7.735   4.340
  375   2HG   PRO  53          1HG       PRO  53   5.822  -6.249   5.204
  376   1HD   PRO  53          2HD       PRO  53   8.382  -7.176   4.994
  377   2HD   PRO  53          1HD       PRO  53   7.804  -6.198   6.361
  378    H    THR  54           H        THR  54   6.676 -11.402   7.700
  379    HA   THR  54           HA       THR  54   7.398 -12.741   5.328
  380    HB   THR  54           HB       THR  54   7.872 -13.732   7.475
  381    HG1  THR  54           1HG      THR  54   5.877 -15.401   6.399
  382   1HG2  THR  54          1HG2      THR  54   4.897 -13.783   7.878
  383   2HG2  THR  54          2HG2      THR  54   6.115 -12.988   8.876
  384   3HG2  THR  54          3HG2      THR  54   6.030 -14.750   8.823
  385    H    LYS  55           H        LYS  55   5.978 -14.677   4.552
  386    HA   LYS  55           HA       LYS  55   3.861 -13.713   3.084
  387   1HB   LYS  55          2HB       LYS  55   4.744 -16.431   3.912
  388   2HB   LYS  55          1HB       LYS  55   3.130 -16.278   3.218
  389   1HG   LYS  55          2HG       LYS  55   5.408 -15.007   1.791
  390   2HG   LYS  55          1HG       LYS  55   5.238 -16.761   1.720
  391   1HD   LYS  55          2HD       LYS  55   3.400 -16.658   0.415
  392   2HD   LYS  55          1HD       LYS  55   2.762 -15.242   1.253
  393   1HE   LYS  55          2HE       LYS  55   4.989 -15.240  -0.781
  394   2HE   LYS  55          1HE       LYS  55   3.326 -14.732  -1.072
  395   1HZ   LYS  55          1HZ       LYS  55   5.391 -13.417   0.577
  396   2HZ   LYS  55          2HZ       LYS  55   3.750 -13.096   0.826
  397   3HZ   LYS  55          3HZ       LYS  55   4.458 -12.762  -0.673
  398    H    CYS  56           H        CYS  56   3.805 -15.139   6.308
  399    HA   CYS  56           HA       CYS  56   0.980 -15.276   6.534
  400   1HB   CYS  56          2HB       CYS  56   3.154 -15.204   8.634
  401   2HB   CYS  56          1HB       CYS  56   1.448 -15.482   8.992
  402    HG   CYS  56           HG       CYS  56   3.380 -17.514   7.758
  403    H    GLU  57           H        GLU  57   3.344 -12.777   7.143
  404    HA   GLU  57           HA       GLU  57   1.625 -11.065   8.642
  405   1HB   GLU  57          2HB       GLU  57   4.131 -10.414   7.075
  406   2HB   GLU  57          1HB       GLU  57   3.347  -9.350   8.244
  407   1HG   GLU  57          2HG       GLU  57   4.330 -12.078   9.004
  408   2HG   GLU  57          1HG       GLU  57   5.386 -10.666   9.017
  409    H    LEU  58           H        LEU  58   2.820 -10.928   5.295
  410    HA   LEU  58           HA       LEU  58   1.190  -8.748   4.538
  411   1HB   LEU  58          2HB       LEU  58   2.292 -10.832   2.666
  412   2HB   LEU  58          1HB       LEU  58   1.938  -9.144   2.321
  413    HG   LEU  58           HG       LEU  58   3.990  -9.725   4.402
  414   1HD1  LEU  58          1HD1      LEU  58   4.582 -11.287   2.630
  415   2HD1  LEU  58          2HD1      LEU  58   5.732  -9.953   2.703
  416   3HD1  LEU  58          3HD1      LEU  58   4.501  -9.987   1.441
  417   1HD2  LEU  58          1HD2      LEU  58   3.232  -7.556   2.555
  418   2HD2  LEU  58          2HD2      LEU  58   4.962  -7.773   2.822
  419   3HD2  LEU  58          3HD2      LEU  58   3.888  -7.482   4.190
  420    H    ASP  59           H        ASP  59   0.639 -12.182   4.675
  421    HA   ASP  59           HA       ASP  59  -1.618 -12.253   2.946
  422   1HB   ASP  59          2HB       ASP  59  -0.452 -14.105   4.990
  423   2HB   ASP  59          1HB       ASP  59  -2.083 -14.409   4.384
  424    H    ALA  60           H        ALA  60  -1.152 -11.330   6.243
  425    HA   ALA  60           HA       ALA  60  -3.918 -11.587   6.973
  426   1HB   ALA  60          1HB       ALA  60  -2.259 -11.815   8.701
  427   2HB   ALA  60          2HB       ALA  60  -3.230 -10.380   9.032
  428   3HB   ALA  60          3HB       ALA  60  -1.613 -10.213   8.348
  429    H    ILE  61           H        ILE  61  -1.844  -9.113   5.655
  430    HA   ILE  61           HA       ILE  61  -3.737  -6.985   6.098
  431    HB   ILE  61           HB       ILE  61  -1.095  -7.156   4.667
  432   1HG1  ILE  61          2HG1      ILE  61  -0.625  -5.300   6.391
  433   2HG1  ILE  61          1HG1      ILE  61  -2.128  -5.815   7.160
  434   1HG2  ILE  61          1HG2      ILE  61  -1.475  -4.553   4.566
  435   2HG2  ILE  61          2HG2      ILE  61  -3.170  -5.039   4.487
  436   3HG2  ILE  61          3HG2      ILE  61  -2.029  -5.615   3.271
  437   1HD1  ILE  61          1HD1      ILE  61   0.285  -7.547   6.663
  438   2HD1  ILE  61          2HD1      ILE  61  -1.211  -8.054   7.447
  439   3HD1  ILE  61          3HD1      ILE  61  -0.186  -6.836   8.207
  440    H    ILE  62           H        ILE  62  -2.340  -8.518   3.181
  441    HA   ILE  62           HA       ILE  62  -3.875  -7.380   1.229
  442    HB   ILE  62           HB       ILE  62  -2.980 -10.257   1.398
  443   1HG1  ILE  62          2HG1      ILE  62  -1.802  -7.801   0.078
  444   2HG1  ILE  62          1HG1      ILE  62  -1.143  -8.672   1.466
  445   1HG2  ILE  62          1HG2      ILE  62  -4.206 -10.651  -0.416
  446   2HG2  ILE  62          2HG2      ILE  62  -3.188  -9.505  -1.286
  447   3HG2  ILE  62          3HG2      ILE  62  -4.683  -8.956  -0.531
  448   1HD1  ILE  62          1HD1      ILE  62  -0.175 -10.220   0.179
  449   2HD1  ILE  62          2HD1      ILE  62  -0.362  -9.019  -1.101
  450   3HD1  ILE  62          3HD1      ILE  62  -1.548 -10.313  -0.926
  451    H    CYS  63           H        CYS  63  -4.743 -10.192   3.219
  452    HA   CYS  63           HA       CYS  63  -7.182 -10.820   2.047
  453   1HB   CYS  63          2HB       CYS  63  -5.833 -11.975   3.980
  454   2HB   CYS  63          1HB       CYS  63  -6.847 -10.976   5.025
  455    HG   CYS  63           HG       CYS  63  -8.827 -12.383   4.493
  456    H    GLU  64           H        GLU  64  -6.424  -8.468   4.577
  457    HA   GLU  64           HA       GLU  64  -9.156  -7.627   4.879
  458   1HB   GLU  64          2HB       GLU  64  -6.520  -6.591   5.901
  459   2HB   GLU  64          1HB       GLU  64  -8.012  -5.696   6.150
  460   1HG   GLU  64          2HG       GLU  64  -8.911  -7.336   7.532
  461   2HG   GLU  64          1HG       GLU  64  -7.784  -8.567   6.962
  462    H    VAL  65           H        VAL  65  -6.354  -6.652   3.043
  463    HA   VAL  65           HA       VAL  65  -7.256  -4.111   2.200
  464    HB   VAL  65           HB       VAL  65  -5.320  -6.057   0.935
  465   1HG1  VAL  65          1HG1      VAL  65  -4.542  -3.950  -0.305
  466   2HG1  VAL  65          2HG1      VAL  65  -6.138  -3.303   0.076
  467   3HG1  VAL  65          3HG1      VAL  65  -5.989  -4.770  -0.892
  468   1HG2  VAL  65          1HG2      VAL  65  -5.052  -3.722   2.783
  469   2HG2  VAL  65          2HG2      VAL  65  -3.723  -4.159   1.710
  470   3HG2  VAL  65          3HG2      VAL  65  -4.324  -5.323   2.889
  471    H    ASP  66           H        ASP  66  -7.553  -7.353   0.821
  472    HA   ASP  66           HA       ASP  66  -9.099  -6.378  -1.429
  473   1HB   ASP  66          2HB       ASP  66  -8.157  -9.115  -0.579
  474   2HB   ASP  66          1HB       ASP  66  -9.239  -8.875  -1.949
  475    H    GLU  67           H        GLU  67 -11.068  -5.668  -0.785
  476    HA   GLU  67           HA       GLU  67 -12.644  -6.991   1.194
  477   1HB   GLU  67          2HB       GLU  67 -13.011  -4.685  -0.656
  478   2HB   GLU  67          1HB       GLU  67 -14.462  -5.447  -0.005
  479   1HG   GLU  67          2HG       GLU  67 -12.267  -4.695   1.862
  480   2HG   GLU  67          1HG       GLU  67 -13.324  -3.432   1.218
  481    H    ASP  68           H        ASP  68 -12.311  -7.224  -2.255
  482    HA   ASP  68           HA       ASP  68 -14.761  -8.722  -2.605
  483   1HB   ASP  68          2HB       ASP  68 -14.077  -8.886  -4.952
  484   2HB   ASP  68          1HB       ASP  68 -13.967  -7.223  -4.384
  485    H    GLY  69           H        GLY  69 -11.379  -9.359  -2.094
  486   1HA   GLY  69          2HA       GLY  69 -10.530 -11.407  -1.296
  487   2HA   GLY  69          1HA       GLY  69 -11.982 -12.209  -1.876
  488    H    SER  70           H        SER  70  -9.478 -10.189  -3.407
  489    HA   SER  70           HA       SER  70  -9.221 -12.260  -5.483
  490   1HB   SER  70          2HB       SER  70  -8.085 -10.162  -6.680
  491   2HB   SER  70          1HB       SER  70  -9.836 -10.415  -6.706
  492    HG   SER  70           HG       SER  70  -8.497  -8.351  -5.723
  493    H    GLY  71           H        GLY  71  -7.532 -10.429  -3.073
  494   1HA   GLY  71          2HA       GLY  71  -5.453 -10.958  -2.146
  495   2HA   GLY  71          1HA       GLY  71  -5.166 -12.065  -3.486
  496    H    THR  72           H        THR  72  -6.147  -9.434  -5.052
  497    HA   THR  72           HA       THR  72  -3.406  -8.421  -5.343
  498    HB   THR  72           HB       THR  72  -3.934  -7.819  -7.566
  499    HG1  THR  72           1HG      THR  72  -5.928  -7.485  -8.291
  500   1HG2  THR  72          1HG2      THR  72  -5.323 -10.409  -6.949
  501   2HG2  THR  72          2HG2      THR  72  -3.667 -10.176  -7.510
  502   3HG2  THR  72          3HG2      THR  72  -5.020  -9.816  -8.583
  503    H    ILE  73           H        ILE  73  -3.023  -6.177  -5.475
  504    HA   ILE  73           HA       ILE  73  -5.074  -4.563  -4.118
  505    HB   ILE  73           HB       ILE  73  -2.115  -4.007  -4.318
  506   1HG1  ILE  73          2HG1      ILE  73  -3.620  -5.038  -1.905
  507   2HG1  ILE  73          1HG1      ILE  73  -2.758  -6.098  -3.025
  508   1HG2  ILE  73          1HG2      ILE  73  -4.340  -2.738  -2.731
  509   2HG2  ILE  73          2HG2      ILE  73  -3.325  -1.985  -3.960
  510   3HG2  ILE  73          3HG2      ILE  73  -2.629  -2.458  -2.410
  511   1HD1  ILE  73          1HD1      ILE  73  -1.559  -3.908  -1.343
  512   2HD1  ILE  73          2HD1      ILE  73  -0.677  -4.885  -2.518
  513   3HD1  ILE  73          3HD1      ILE  73  -1.392  -5.647  -1.098
  514    H    ASP  74           H        ASP  74  -6.171  -3.240  -5.405
  515    HA   ASP  74           HA       ASP  74  -5.366  -2.559  -8.033
  516   1HB   ASP  74          2HB       ASP  74  -7.737  -2.512  -6.684
  517   2HB   ASP  74          1HB       ASP  74  -7.347  -0.791  -6.749
  518    H    PHE  75           H        PHE  75  -5.762   0.037  -8.491
  519    HA   PHE  75           HA       PHE  75  -3.334   1.238  -7.786
  520   1HB   PHE  75          2HB       PHE  75  -5.574   1.865  -9.437
  521   2HB   PHE  75          1HB       PHE  75  -5.219   3.278  -8.441
  522    HD1  PHE  75           1HD      PHE  75  -3.498   0.760 -10.585
  523    HD2  PHE  75           2HD      PHE  75  -3.622   4.768  -9.161
  524    HE1  PHE  75           1HE      PHE  75  -1.647   1.350 -12.096
  525    HE2  PHE  75           2HE      PHE  75  -1.772   5.366 -10.668
  526    HZ   PHE  75           HZ       PHE  75  -0.782   3.655 -12.139
  527    H    GLU  76           H        GLU  76  -6.450   2.738  -6.979
  528    HA   GLU  76           HA       GLU  76  -5.436   4.179  -4.797
  529   1HB   GLU  76          2HB       GLU  76  -8.307   3.352  -5.246
  530   2HB   GLU  76          1HB       GLU  76  -7.745   4.692  -4.257
  531   1HG   GLU  76          2HG       GLU  76  -6.898   4.733  -7.075
  532   2HG   GLU  76          1HG       GLU  76  -8.623   4.943  -6.781
  533    H    GLU  77           H        GLU  77  -6.638   0.939  -5.067
  534    HA   GLU  77           HA       GLU  77  -7.417   0.363  -2.482
  535   1HB   GLU  77          2HB       GLU  77  -6.572  -1.139  -4.817
  536   2HB   GLU  77          1HB       GLU  77  -6.048  -1.919  -3.330
  537   1HG   GLU  77          2HG       GLU  77  -8.379  -1.806  -2.505
  538   2HG   GLU  77          1HG       GLU  77  -8.861  -1.156  -4.077
  539    H    PHE  78           H        PHE  78  -4.227   0.967  -3.700
  540    HA   PHE  78           HA       PHE  78  -2.766  -0.312  -1.630
  541   1HB   PHE  78          2HB       PHE  78  -1.871   0.446  -3.888
  542   2HB   PHE  78          1HB       PHE  78  -1.831   2.080  -3.218
  543    HD1  PHE  78           1HD      PHE  78   0.242   2.764  -2.537
  544    HD2  PHE  78           2HD      PHE  78  -0.813  -1.335  -2.093
  545    HE1  PHE  78           1HE      PHE  78   2.447   2.307  -1.547
  546    HE2  PHE  78           2HE      PHE  78   1.390  -1.798  -1.102
  547    HZ   PHE  78           HZ       PHE  78   3.022   0.024  -0.828
  548    H    LEU  79           H        LEU  79  -4.650   2.522  -1.653
  549    HA   LEU  79           HA       LEU  79  -3.207   3.689   0.610
  550   1HB   LEU  79          2HB       LEU  79  -5.621   4.711  -0.895
  551   2HB   LEU  79          1HB       LEU  79  -4.762   5.575   0.366
  552    HG   LEU  79           HG       LEU  79  -2.771   4.986  -1.467
  553   1HD1  LEU  79          1HD1      LEU  79  -4.314   4.263  -3.147
  554   2HD1  LEU  79          2HD1      LEU  79  -3.699   5.851  -3.605
  555   3HD1  LEU  79          3HD1      LEU  79  -5.315   5.696  -2.915
  556   1HD2  LEU  79          1HD2      LEU  79  -4.199   7.306  -0.462
  557   2HD2  LEU  79          2HD2      LEU  79  -3.608   7.541  -2.107
  558   3HD2  LEU  79          3HD2      LEU  79  -2.485   7.100  -0.821
  559    H    VAL  80           H        VAL  80  -6.365   2.330  -0.235
  560    HA   VAL  80           HA       VAL  80  -7.542   2.695   2.311
  561    HB   VAL  80           HB       VAL  80  -8.762   2.189   0.144
  562   1HG1  VAL  80          1HG1      VAL  80  -8.061  -0.657   0.847
  563   2HG1  VAL  80          2HG1      VAL  80  -7.399   0.248  -0.514
  564   3HG1  VAL  80          3HG1      VAL  80  -9.121  -0.125  -0.458
  565   1HG2  VAL  80          1HG2      VAL  80 -10.585   1.665   1.353
  566   2HG2  VAL  80          2HG2      VAL  80  -9.496   1.862   2.726
  567   3HG2  VAL  80          3HG2      VAL  80  -9.822   0.252   2.083
  568    H    MET  81           H        MET  81  -5.543   0.188   0.917
  569    HA   MET  81           HA       MET  81  -5.921  -1.932   2.627
  570   1HB   MET  81          2HB       MET  81  -3.367  -2.282   2.284
  571   2HB   MET  81          1HB       MET  81  -4.433  -2.355   0.891
  572   1HG   MET  81          2HG       MET  81  -3.597  -0.494  -0.026
  573   2HG   MET  81          1HG       MET  81  -3.291   0.283   1.527
  574   1HE   MET  81          1HE       MET  81  -1.703  -0.405   3.101
  575   2HE   MET  81          2HE       MET  81  -0.006  -0.558   2.643
  576   3HE   MET  81          3HE       MET  81  -0.971  -2.005   2.964
  577    H    MET  82           H        MET  82  -3.938   0.930   3.091
  578    HA   MET  82           HA       MET  82  -3.107   0.102   5.732
  579   1HB   MET  82          2HB       MET  82  -2.364   2.180   3.797
  580   2HB   MET  82          1HB       MET  82  -2.276   2.680   5.491
  581   1HG   MET  82          2HG       MET  82  -1.100   0.172   5.462
  582   2HG   MET  82          1HG       MET  82  -0.535   0.933   3.977
  583   1HE   MET  82          1HE       MET  82  -0.725   3.881   4.743
  584   2HE   MET  82          2HE       MET  82   0.766   3.344   3.970
  585   3HE   MET  82          3HE       MET  82   0.836   4.324   5.437
  586    H    VAL  83           H        VAL  83  -5.583   2.030   4.285
  587    HA   VAL  83           HA       VAL  83  -6.189   3.672   6.524
  588    HB   VAL  83           HB       VAL  83  -7.947   2.795   4.222
  589   1HG1  VAL  83          1HG1      VAL  83  -9.422   3.470   5.932
  590   2HG1  VAL  83          2HG1      VAL  83  -9.265   4.862   4.859
  591   3HG1  VAL  83          3HG1      VAL  83  -8.393   4.826   6.393
  592   1HG2  VAL  83          1HG2      VAL  83  -5.744   4.367   4.089
  593   2HG2  VAL  83          2HG2      VAL  83  -6.996   5.570   4.399
  594   3HG2  VAL  83          3HG2      VAL  83  -7.127   4.501   3.003
  595    H    ARG  84           H        ARG  84  -7.244   0.497   5.427
  596    HA   ARG  84           HA       ARG  84  -9.324   0.132   7.306
  597   1HB   ARG  84          2HB       ARG  84  -7.621  -1.923   5.884
  598   2HB   ARG  84          1HB       ARG  84  -9.112  -2.267   6.749
  599   1HG   ARG  84          2HG       ARG  84  -9.792  -0.246   4.965
  600   2HG   ARG  84          1HG       ARG  84  -8.719  -1.316   4.053
  601   1HD   ARG  84          2HD       ARG  84 -10.515  -2.595   3.714
  602   2HD   ARG  84          1HD       ARG  84 -10.364  -3.065   5.406
  603    HE   ARG  84           HE       ARG  84 -11.877  -0.653   4.997
  604   1HH1  ARG  84          1HH1      ARG  84 -12.020  -4.137   5.141
  605   2HH1  ARG  84          2HH1      ARG  84 -13.706  -4.175   5.539
  606   1HH2  ARG  84          1HH2      ARG  84 -14.093  -0.702   5.521
  607   2HH2  ARG  84          2HH2      ARG  84 -14.883  -2.226   5.754
  608    H    GLN  85           H        GLN  85  -5.881  -0.112   7.519
  609    HA   GLN  85           HA       GLN  85  -6.044  -1.494  10.099
  610   1HB   GLN  85          2HB       GLN  85  -3.509  -0.709   8.670
  611   2HB   GLN  85          1HB       GLN  85  -3.730  -1.952   9.901
  612   1HG   GLN  85          2HG       GLN  85  -4.633  -2.019   7.033
  613   2HG   GLN  85          1HG       GLN  85  -3.421  -3.042   7.815
  614   1HE2  GLN  85          1HE2      GLN  85  -5.531  -4.099   6.384
  615   2HE2  GLN  85          2HE2      GLN  85  -6.596  -4.922   7.467
  616    H    MET  86           H        MET  86  -5.442   1.581   8.651
  617    HA   MET  86           HA       MET  86  -4.076   2.776  10.848
  618   1HB   MET  86          2HB       MET  86  -5.172   3.622   8.254
  619   2HB   MET  86          1HB       MET  86  -5.226   4.869   9.501
  620   1HG   MET  86          2HG       MET  86  -2.793   4.470   9.892
  621   2HG   MET  86          1HG       MET  86  -2.804   3.395   8.489
  622   1HE   MET  86          1HE       MET  86  -1.370   5.620   6.143
  623   2HE   MET  86          2HE       MET  86  -2.798   4.680   5.707
  624   3HE   MET  86          3HE       MET  86  -1.631   4.028   6.858
  625    H    LYS  87           H        LYS  87  -7.444   2.573   9.817
  626    HA   LYS  87           HA       LYS  87  -8.359   4.236  12.004
  627   1HB   LYS  87          2HB       LYS  87  -9.707   2.781   9.747
  628   2HB   LYS  87          1HB       LYS  87 -10.652   3.419  11.092
  629   1HG   LYS  87          2HG       LYS  87 -10.572   5.479  10.275
  630   2HG   LYS  87          1HG       LYS  87  -8.817   5.401  10.072
  631   1HD   LYS  87          2HD       LYS  87  -9.635   5.727   7.903
  632   2HD   LYS  87          1HD       LYS  87  -9.312   3.995   7.987
  633   1HE   LYS  87          2HE       LYS  87 -12.009   4.731   8.838
  634   2HE   LYS  87          1HE       LYS  87 -11.660   5.145   7.161
  635   1HZ   LYS  87          1HZ       LYS  87 -12.520   2.759   7.907
  636   2HZ   LYS  87          2HZ       LYS  87 -10.855   2.487   8.036
  637   3HZ   LYS  87          3HZ       LYS  87 -11.519   2.988   6.562
  638    H    GLU  88           H        GLU  88  -7.054   2.405  13.293
  639    HA   GLU  88           HA       GLU  88  -9.128   0.637  14.390
  640   1HB   GLU  88          2HB       GLU  88  -7.106  -0.352  12.875
  641   2HB   GLU  88          1HB       GLU  88  -6.363  -0.403  14.469
  642   1HG   GLU  88          2HG       GLU  88  -8.782  -1.483  15.006
  643   2HG   GLU  88          1HG       GLU  88  -8.541  -2.013  13.342
  644    H    ASP  89           H        ASP  89  -7.851  -0.475  16.471
  645    HA   ASP  89           HA       ASP  89  -7.225  -0.115  18.627
  646   1HB   ASP  89          2HB       ASP  89  -5.206   0.885  17.137
  647   2HB   ASP  89          1HB       ASP  89  -5.688   2.343  18.009
  648    H    ALA  90           H        ALA  90  -6.911   1.936  20.267
  649    HA   ALA  90           HA       ALA  90  -8.558   4.183  19.864
  650   1HB   ALA  90          1HB       ALA  90 -10.539   3.082  19.966
  651   2HB   ALA  90          2HB       ALA  90 -10.271   3.277  21.698
  652   3HB   ALA  90          3HB       ALA  90  -9.878   1.749  20.911
  653   2H    ARG 115          HN2       ARG 115   0.847  -2.279  10.182
  654    H    ARG 115           H        ARG 115  -0.768  -2.638   9.729
  655   3H    ARG 115          HN3       ARG 115   0.516  -3.629   9.176
  656    HA   ARG 115           HA       ARG 115   1.427  -1.712   8.006
  657   1HB   ARG 115          2HB       ARG 115  -0.358  -3.542   7.235
  658   2HB   ARG 115          1HB       ARG 115  -1.354  -2.109   7.020
  659   1HG   ARG 115          2HG       ARG 115  -0.440  -2.167   4.959
  660   2HG   ARG 115          1HG       ARG 115   0.851  -1.277   5.766
  661   1HD   ARG 115          2HD       ARG 115   0.819  -4.275   5.493
  662   2HD   ARG 115          1HD       ARG 115   1.594  -3.204   4.327
  663    HE   ARG 115           HE       ARG 115   2.702  -2.442   6.664
  664   1HH1  ARG 115          1HH1      ARG 115   2.297  -5.558   5.146
  665   2HH1  ARG 115          2HH1      ARG 115   3.726  -6.230   5.857
  666   1HH2  ARG 115          1HH2      ARG 115   4.582  -3.324   7.600
  667   2HH2  ARG 115          2HH2      ARG 115   5.022  -4.962   7.251
  668    H    MET 116           H        MET 116   0.815  -0.255  10.198
  669    HA   MET 116           HA       MET 116  -1.170   1.733   9.347
  670   1HB   MET 116          2HB       MET 116  -1.430   0.859  11.622
  671   2HB   MET 116          1HB       MET 116   0.206   1.366  12.015
  672   1HG   MET 116          2HG       MET 116  -0.600   3.724  11.384
  673   2HG   MET 116          1HG       MET 116  -2.220   3.048  11.538
  674   1HE   MET 116          1HE       MET 116  -1.665   5.504  13.530
  675   2HE   MET 116          2HE       MET 116  -2.470   4.709  14.882
  676   3HE   MET 116          3HE       MET 116  -3.075   4.484  13.241
  677    H    SER 117           H        SER 117   1.988   1.813  11.010
  678    HA   SER 117           HA       SER 117   2.547   4.401   9.809
  679   1HB   SER 117          2HB       SER 117   4.275   4.631  11.380
  680   2HB   SER 117          1HB       SER 117   3.028   3.746  12.259
  681    HG   SER 117           HG       SER 117   4.233   1.806  11.521
  682    H    ALA 118           H        ALA 118   2.411   2.739   7.779
  683    HA   ALA 118           HA       ALA 118   4.961   1.541   7.166
  684   1HB   ALA 118          1HB       ALA 118   2.824   2.030   5.131
  685   2HB   ALA 118          2HB       ALA 118   2.609   0.795   6.371
  686   3HB   ALA 118          3HB       ALA 118   3.969   0.695   5.253
  687    H    ASP 119           H        ASP 119   4.009   4.668   7.313
  688    HA   ASP 119           HA       ASP 119   4.620   5.968   5.006
  689   1HB   ASP 119          2HB       ASP 119   3.940   7.031   7.169
  690   2HB   ASP 119          1HB       ASP 119   5.597   6.838   7.732
  691    H    ALA 120           H        ALA 120   6.821   4.300   7.134
  692    HA   ALA 120           HA       ALA 120   9.251   5.399   6.295
  693   1HB   ALA 120          1HB       ALA 120  10.129   3.024   6.887
  694   2HB   ALA 120          2HB       ALA 120   8.476   2.743   7.434
  695   3HB   ALA 120          3HB       ALA 120   9.436   4.034   8.157
  696    H    MET 121           H        MET 121   7.938   2.248   5.226
  697    HA   MET 121           HA       MET 121   9.645   1.943   3.039
  698   1HB   MET 121          2HB       MET 121   8.343   0.074   3.850
  699   2HB   MET 121          1HB       MET 121   6.839   0.903   3.478
  700   1HG   MET 121          2HG       MET 121   8.051   0.876   1.042
  701   2HG   MET 121          1HG       MET 121   8.625  -0.637   1.744
  702   1HE   MET 121          1HE       MET 121   4.798   0.815   2.532
  703   2HE   MET 121          2HE       MET 121   4.327   0.596   0.846
  704   3HE   MET 121          3HE       MET 121   5.691   1.638   1.253
  705    H    LEU 122           H        LEU 122   6.635   3.676   3.400
  706    HA   LEU 122           HA       LEU 122   6.142   4.172   0.662
  707   1HB   LEU 122          2HB       LEU 122   5.241   5.410   3.234
  708   2HB   LEU 122          1HB       LEU 122   4.879   6.215   1.720
  709    HG   LEU 122           HG       LEU 122   3.775   4.060   0.968
  710   1HD1  LEU 122          1HD1      LEU 122   4.961   2.774   2.886
  711   2HD1  LEU 122          2HD1      LEU 122   3.306   2.348   2.454
  712   3HD1  LEU 122          3HD1      LEU 122   3.618   3.353   3.869
  713   1HD2  LEU 122          1HD2      LEU 122   2.803   5.882   3.104
  714   2HD2  LEU 122          2HD2      LEU 122   1.822   4.473   2.701
  715   3HD2  LEU 122          3HD2      LEU 122   2.220   5.657   1.456
  716    H    ARG 123           H        ARG 123   7.930   5.920   3.165
  717    HA   ARG 123           HA       ARG 123   8.688   7.996   1.265
  718   1HB   ARG 123          2HB       ARG 123   8.075   8.490   3.664
  719   2HB   ARG 123          1HB       ARG 123   9.574   7.702   4.134
  720   1HG   ARG 123          2HG       ARG 123  10.893   9.366   3.174
  721   2HG   ARG 123          1HG       ARG 123   9.564   9.977   2.188
  722   1HD   ARG 123          2HD       ARG 123   9.447  11.557   3.790
  723   2HD   ARG 123          1HD       ARG 123   8.532  10.323   4.654
  724    HE   ARG 123           HE       ARG 123  11.081   9.805   5.378
  725   1HH1  ARG 123          1HH1      ARG 123   9.153  12.714   5.392
  726   2HH1  ARG 123          2HH1      ARG 123   9.973  13.400   6.754
  727   1HH2  ARG 123          1HH2      ARG 123  12.161  10.706   7.168
  728   2HH2  ARG 123          2HH2      ARG 123  11.682  12.261   7.762
  729    H    ALA 124           H        ALA 124   9.648   5.023   1.385
  730    HA   ALA 124           HA       ALA 124  12.477   5.253   1.814
  731   1HB   ALA 124          1HB       ALA 124  10.677   3.162   1.744
  732   2HB   ALA 124          2HB       ALA 124  12.431   3.025   1.852
  733   3HB   ALA 124          3HB       ALA 124  11.633   2.931   0.281
  734    H    LEU 125           H        LEU 125  10.840   4.031  -1.092
  735    HA   LEU 125           HA       LEU 125  12.993   4.906  -2.764
  736   1HB   LEU 125          2HB       LEU 125  10.297   3.867  -3.618
  737   2HB   LEU 125          1HB       LEU 125  11.774   3.893  -4.566
  738    HG   LEU 125           HG       LEU 125  11.715   2.354  -2.005
  739   1HD1  LEU 125          1HD1      LEU 125  10.329   1.645  -4.548
  740   2HD1  LEU 125          2HD1      LEU 125   9.826   1.383  -2.878
  741   3HD1  LEU 125          3HD1      LEU 125  11.092   0.380  -3.584
  742   1HD2  LEU 125          1HD2      LEU 125  13.010   1.418  -4.498
  743   2HD2  LEU 125          2HD2      LEU 125  13.559   1.318  -2.824
  744   3HD2  LEU 125          3HD2      LEU 125  13.701   2.836  -3.711
  745    H    LEU 126           H        LEU 126  10.026   6.281  -1.702
  746    HA   LEU 126           HA       LEU 126   8.942   8.222  -2.183
  747   1HB   LEU 126          2HB       LEU 126  11.751   8.736  -2.400
  748   2HB   LEU 126          1HB       LEU 126  10.904   9.702  -3.591
  749    HG   LEU 126           HG       LEU 126  10.301   9.686  -0.633
  750   1HD1  LEU 126          1HD1      LEU 126  11.154  12.167  -1.130
  751   2HD1  LEU 126          2HD1      LEU 126  12.120  11.294  -2.319
  752   3HD1  LEU 126          3HD1      LEU 126  12.229  10.870  -0.611
  753   1HD2  LEU 126          1HD2      LEU 126   9.271  11.470  -2.836
  754   2HD2  LEU 126          2HD2      LEU 126   8.872  11.582  -1.122
  755   3HD2  LEU 126          3HD2      LEU 126   8.357  10.178  -2.056
  756    H    GLY 127           H        GLY 127   8.359   9.788  -4.021
  757   1HA   GLY 127          2HA       GLY 127   8.347   8.291  -6.571
  758   2HA   GLY 127          1HA       GLY 127   6.936   9.144  -5.964
  759    H    SER 128           H        SER 128  10.122   9.494  -7.370
  760    HA   SER 128           HA       SER 128   9.458  12.290  -8.024
  761   1HB   SER 128          2HB       SER 128  11.339  12.321  -6.536
  762   2HB   SER 128          1HB       SER 128  12.149  11.042  -7.439
  763    HG   SER 128           HG       SER 128  11.635  13.697  -8.294
  764    H    LYS 129           H        LYS 129  10.824  13.035  -9.998
  765    HA   LYS 129           HA       LYS 129  10.859  10.896 -12.021
  766   1HB   LYS 129          2HB       LYS 129   9.952  12.508 -13.660
  767   2HB   LYS 129          1HB       LYS 129   8.829  12.182 -12.346
  768   1HG   LYS 129          2HG       LYS 129   8.619  14.397 -12.224
  769   2HG   LYS 129          1HG       LYS 129  10.182  14.359 -11.406
  770   1HD   LYS 129          2HD       LYS 129  10.851  15.761 -13.023
  771   2HD   LYS 129          1HD       LYS 129  10.907  14.324 -14.046
  772   1HE   LYS 129          2HE       LYS 129   8.318  15.765 -13.748
  773   2HE   LYS 129          1HE       LYS 129   9.567  16.481 -14.767
  774   1HZ   LYS 129          1HZ       LYS 129   9.624  14.031 -15.704
  775   2HZ   LYS 129          2HZ       LYS 129   8.533  15.184 -16.292
  776   3HZ   LYS 129          3HZ       LYS 129   8.021  14.034 -15.161
  777    H    HIS 130           H        HIS 130  12.484  10.973 -13.523
  778    HA   HIS 130           HA       HIS 130  14.153  13.267 -13.878
  779   1HB   HIS 130          2HB       HIS 130  14.952  11.144 -11.981
  780   2HB   HIS 130          1HB       HIS 130  16.189  11.640 -13.131
  781    HD1  HIS 130           1HD      HIS 130  15.449  14.685 -13.196
  782    HD2  HIS 130           2HD      HIS 130  15.954  12.405  -9.760
  783    HE1  HIS 130           1HE      HIS 130  16.021  16.327 -11.378
  784    HE2  HIS 130           2HE      HIS 130  16.404  14.914  -9.327
  785    H    LYS 131           H        LYS 131  14.677   9.740 -13.998
  786    HA   LYS 131           HA       LYS 131  15.875   9.854 -16.574
  787   1HB   LYS 131          2HB       LYS 131  14.712   7.414 -15.228
  788   2HB   LYS 131          1HB       LYS 131  15.965   7.458 -16.462
  789   1HG   LYS 131          2HG       LYS 131  17.597   7.953 -14.985
  790   2HG   LYS 131          1HG       LYS 131  16.537   8.942 -13.978
  791   1HD   LYS 131          2HD       LYS 131  15.620   7.043 -12.910
  792   2HD   LYS 131          1HD       LYS 131  16.309   5.945 -14.107
  793   1HE   LYS 131          2HE       LYS 131  17.841   5.641 -12.460
  794   2HE   LYS 131          1HE       LYS 131  18.567   7.052 -13.229
  795   1HZ   LYS 131          1HZ       LYS 131  17.183   6.837 -10.664
  796   2HZ   LYS 131          2HZ       LYS 131  16.988   8.277 -11.530
  797   3HZ   LYS 131          3HZ       LYS 131  18.537   7.760 -11.089
  Start of MODEL    3
    1   2H    ALA   1          HN2       ALA   1 -14.842  -1.404 -13.599
    2    H    ALA   1           H        ALA   1 -15.729  -0.790 -14.933
    3   3H    ALA   1          HN3       ALA   1 -15.424   0.211 -13.576
    4    HA   ALA   1           HA       ALA   1 -17.693  -0.799 -13.823
    5   1HB   ALA   1          1HB       ALA   1 -16.169  -3.189 -12.796
    6   2HB   ALA   1          2HB       ALA   1 -16.901  -3.047 -14.394
    7   3HB   ALA   1          3HB       ALA   1 -17.920  -3.058 -12.955
    8    H    SER   2           H        SER   2 -14.994  -1.078 -11.574
    9    HA   SER   2           HA       SER   2 -14.749  -0.484  -9.393
   10   1HB   SER   2          2HB       SER   2 -15.927   1.624 -10.497
   11   2HB   SER   2          1HB       SER   2 -17.254   1.144  -9.438
   12    HG   SER   2           HG       SER   2 -14.603   1.462  -8.502
   13    H    MET   3           H        MET   3 -16.054  -0.325  -7.217
   14    HA   MET   3           HA       MET   3 -18.486  -1.684  -6.925
   15   1HB   MET   3          2HB       MET   3 -16.191  -3.393  -7.312
   16   2HB   MET   3          1HB       MET   3 -16.877  -3.648  -5.714
   17   1HG   MET   3          2HG       MET   3 -18.311  -3.868  -8.350
   18   2HG   MET   3          1HG       MET   3 -17.855  -5.189  -7.275
   19   1HE   MET   3          1HE       MET   3 -19.888  -2.345  -8.163
   20   2HE   MET   3          2HE       MET   3 -21.126  -2.116  -6.926
   21   3HE   MET   3          3HE       MET   3 -21.315  -3.384  -8.139
   22    H    THR   4           H        THR   4 -15.322  -1.031  -5.505
   23    HA   THR   4           HA       THR   4 -16.683  -0.344  -2.985
   24    HB   THR   4           HB       THR   4 -14.691  -1.059  -1.765
   25    HG1  THR   4           1HG      THR   4 -13.713  -1.821  -4.315
   26   1HG2  THR   4          1HG2      THR   4 -15.232  -3.222  -1.689
   27   2HG2  THR   4          2HG2      THR   4 -14.991  -3.450  -3.421
   28   3HG2  THR   4          3HG2      THR   4 -16.504  -2.768  -2.824
   29    H    ASP   5           H        ASP   5 -16.663   1.782  -2.721
   30    HA   ASP   5           HA       ASP   5 -14.733   3.454  -4.046
   31   1HB   ASP   5          2HB       ASP   5 -15.968   5.308  -2.862
   32   2HB   ASP   5          1HB       ASP   5 -16.958   4.303  -3.923
   33    H    GLN   6           H        GLN   6 -14.539   1.668  -1.282
   34    HA   GLN   6           HA       GLN   6 -13.522   3.337   0.676
   35   1HB   GLN   6          2HB       GLN   6 -12.419   1.381   1.592
   36   2HB   GLN   6          1HB       GLN   6 -14.010   0.937   0.995
   37   1HG   GLN   6          2HG       GLN   6 -13.137  -0.204  -0.840
   38   2HG   GLN   6          1HG       GLN   6 -11.563   0.578  -0.691
   39   1HE2  GLN   6          1HE2      GLN   6 -10.666  -1.552  -0.776
   40   2HE2  GLN   6          2HE2      GLN   6 -10.631  -2.537   0.643
   41    H    GLN   7           H        GLN   7 -12.096   2.349  -2.314
   42    HA   GLN   7           HA       GLN   7  -9.389   2.964  -1.592
   43   1HB   GLN   7          2HB       GLN   7 -10.409   2.870  -4.416
   44   2HB   GLN   7          1HB       GLN   7  -8.819   2.438  -3.806
   45   1HG   GLN   7          2HG       GLN   7  -9.414   0.329  -3.535
   46   2HG   GLN   7          1HG       GLN   7 -10.838   0.781  -2.606
   47   1HE2  GLN   7          1HE2      GLN   7 -10.692  -1.375  -4.418
   48   2HE2  GLN   7          2HE2      GLN   7 -11.792  -1.058  -5.713
   49    H    ALA   8           H        ALA   8 -12.115   4.767  -2.652
   50    HA   ALA   8           HA       ALA   8 -10.601   6.976  -3.716
   51   1HB   ALA   8          1HB       ALA   8 -13.122   6.140  -4.148
   52   2HB   ALA   8          2HB       ALA   8 -12.576   7.789  -4.454
   53   3HB   ALA   8          3HB       ALA   8 -13.419   7.402  -2.954
   54    H    GLU   9           H        GLU   9 -12.606   6.421  -0.822
   55    HA   GLU   9           HA       GLU   9 -12.202   8.898   0.396
   56   1HB   GLU   9          2HB       GLU   9 -12.523   6.231   1.788
   57   2HB   GLU   9          1HB       GLU   9 -12.850   7.814   2.478
   58   1HG   GLU   9          2HG       GLU   9 -14.302   7.086   0.002
   59   2HG   GLU   9          1HG       GLU   9 -14.758   6.255   1.494
   60    H    ALA  10           H        ALA  10 -10.265   5.975   0.393
   61    HA   ALA  10           HA       ALA  10  -8.442   6.368   2.370
   62   1HB   ALA  10          1HB       ALA  10  -7.894   4.451   1.347
   63   2HB   ALA  10          2HB       ALA  10  -6.845   5.460   0.350
   64   3HB   ALA  10          3HB       ALA  10  -8.456   5.022  -0.227
   65    H    ARG  11           H        ARG  11  -8.062   7.573  -0.968
   66    HA   ARG  11           HA       ARG  11  -5.726   9.009  -0.616
   67   1HB   ARG  11          2HB       ARG  11  -7.736   8.764  -2.619
   68   2HB   ARG  11          1HB       ARG  11  -7.409  10.477  -2.394
   69   1HG   ARG  11          2HG       ARG  11  -4.983   9.976  -2.685
   70   2HG   ARG  11          1HG       ARG  11  -5.434   8.323  -3.104
   71   1HD   ARG  11          2HD       ARG  11  -5.105   9.626  -5.117
   72   2HD   ARG  11          1HD       ARG  11  -6.806   9.188  -4.953
   73    HE   ARG  11           HE       ARG  11  -6.621  11.655  -3.801
   74   1HH1  ARG  11          1HH1      ARG  11  -5.810  10.339  -6.929
   75   2HH1  ARG  11          2HH1      ARG  11  -6.092  11.827  -7.768
   76   1HH2  ARG  11          1HH2      ARG  11  -6.993  13.614  -4.902
   77   2HH2  ARG  11          2HH2      ARG  11  -6.764  13.687  -6.617
   78    H    ALA  12           H        ALA  12  -8.940   9.759   0.430
   79    HA   ALA  12           HA       ALA  12  -8.215  12.516   1.074
   80   1HB   ALA  12          1HB       ALA  12 -10.845  11.053   1.210
   81   2HB   ALA  12          2HB       ALA  12 -10.356  12.271   0.032
   82   3HB   ALA  12          3HB       ALA  12 -10.613  12.727   1.716
   83    H    PHE  13           H        PHE  13  -8.509   9.419   2.548
   84    HA   PHE  13           HA       PHE  13  -8.988  10.335   5.215
   85   1HB   PHE  13          2HB       PHE  13  -8.578   7.779   3.864
   86   2HB   PHE  13          1HB       PHE  13  -7.799   7.841   5.447
   87    HD1  PHE  13           1HD      PHE  13 -10.718   6.982   3.800
   88    HD2  PHE  13           2HD      PHE  13  -9.369   8.957   7.318
   89    HE1  PHE  13           1HE      PHE  13 -12.886   6.537   4.875
   90    HE2  PHE  13           2HE      PHE  13 -11.533   8.516   8.401
   91    HZ   PHE  13           HZ       PHE  13 -13.296   7.303   7.179
   92    H    LEU  14           H        LEU  14  -6.186   9.963   3.217
   93    HA   LEU  14           HA       LEU  14  -4.452  10.473   5.542
   94   1HB   LEU  14          2HB       LEU  14  -3.420   9.558   2.883
   95   2HB   LEU  14          1HB       LEU  14  -2.696   9.374   4.476
   96    HG   LEU  14           HG       LEU  14  -5.122   7.946   4.564
   97   1HD1  LEU  14          1HD1      LEU  14  -5.398   6.800   2.652
   98   2HD1  LEU  14          2HD1      LEU  14  -3.666   6.717   2.328
   99   3HD1  LEU  14          3HD1      LEU  14  -4.569   8.178   1.928
  100   1HD2  LEU  14          1HD2      LEU  14  -2.590   7.612   5.404
  101   2HD2  LEU  14          2HD2      LEU  14  -2.621   6.467   4.064
  102   3HD2  LEU  14          3HD2      LEU  14  -3.788   6.319   5.377
  103    H    SER  15           H        SER  15  -2.406  11.712   4.890
  104    HA   SER  15           HA       SER  15  -3.270  14.181   3.622
  105   1HB   SER  15          2HB       SER  15  -1.741  13.732   5.820
  106   2HB   SER  15          1HB       SER  15  -0.481  13.947   4.597
  107    HG   SER  15           HG       SER  15  -2.636  15.760   4.902
  108    H    GLU  16           H        GLU  16  -1.842  15.289   2.065
  109    HA   GLU  16           HA       GLU  16  -1.338  13.813  -0.212
  110   1HB   GLU  16          2HB       GLU  16  -0.533  16.490   0.769
  111   2HB   GLU  16          1HB       GLU  16   0.428  15.831  -0.548
  112   1HG   GLU  16          2HG       GLU  16  -1.111  16.696  -1.894
  113   2HG   GLU  16          1HG       GLU  16  -2.136  15.355  -1.386
  114    H    GLU  17           H        GLU  17   0.622  14.258   2.607
  115    HA   GLU  17           HA       GLU  17   3.142  13.550   1.615
  116   1HB   GLU  17          2HB       GLU  17   1.816  13.642   4.263
  117   2HB   GLU  17          1HB       GLU  17   3.228  12.598   4.147
  118   1HG   GLU  17          2HG       GLU  17   4.142  14.597   4.829
  119   2HG   GLU  17          1HG       GLU  17   4.370  14.657   3.081
  120    H    MET  18           H        MET  18   0.687  11.527   3.220
  121    HA   MET  18           HA       MET  18   2.015   9.084   2.945
  122   1HB   MET  18          2HB       MET  18  -0.343   9.925   4.078
  123   2HB   MET  18          1HB       MET  18  -0.909   8.921   2.743
  124   1HG   MET  18          2HG       MET  18  -0.763   7.410   4.467
  125   2HG   MET  18          1HG       MET  18   0.785   7.190   3.654
  126   1HE   MET  18          1HE       MET  18   1.371   6.671   7.550
  127   2HE   MET  18          2HE       MET  18   0.765   5.887   6.091
  128   3HE   MET  18          3HE       MET  18  -0.332   6.817   7.114
  129    H    ILE  19           H        ILE  19   0.168  10.945   0.664
  130    HA   ILE  19           HA       ILE  19  -0.286   8.816  -1.193
  131    HB   ILE  19           HB       ILE  19  -0.508  11.812  -1.393
  132   1HG1  ILE  19          2HG1      ILE  19  -2.538   9.570  -1.531
  133   2HG1  ILE  19          1HG1      ILE  19  -2.257  10.631  -0.147
  134   1HG2  ILE  19          1HG2      ILE  19  -0.754   9.776  -3.583
  135   2HG2  ILE  19          2HG2      ILE  19   0.140  11.298  -3.578
  136   3HG2  ILE  19          3HG2      ILE  19  -1.624  11.310  -3.644
  137   1HD1  ILE  19          1HD1      ILE  19  -3.272  11.483  -2.851
  138   2HD1  ILE  19          2HD1      ILE  19  -2.996  12.543  -1.469
  139   3HD1  ILE  19          3HD1      ILE  19  -4.236  11.292  -1.386
  140    H    ALA  20           H        ALA  20   1.738  11.739  -1.444
  141    HA   ALA  20           HA       ALA  20   3.181  11.084  -3.683
  142   1HB   ALA  20          1HB       ALA  20   3.603  13.216  -3.016
  143   2HB   ALA  20          2HB       ALA  20   5.057  12.438  -2.388
  144   3HB   ALA  20          3HB       ALA  20   3.704  12.781  -1.310
  145    H    GLU  21           H        GLU  21   3.476   9.767  -0.490
  146    HA   GLU  21           HA       GLU  21   6.014   8.478  -1.076
  147   1HB   GLU  21          2HB       GLU  21   4.271   8.241   1.384
  148   2HB   GLU  21          1HB       GLU  21   5.931   7.686   1.220
  149   1HG   GLU  21          2HG       GLU  21   6.792   9.838   1.256
  150   2HG   GLU  21          1HG       GLU  21   5.244  10.568   0.833
  151    H    PHE  22           H        PHE  22   2.602   7.791  -0.874
  152    HA   PHE  22           HA       PHE  22   2.684   4.987  -0.774
  153   1HB   PHE  22          2HB       PHE  22   0.704   7.050  -1.328
  154   2HB   PHE  22          1HB       PHE  22   0.460   5.629  -2.336
  155    HD1  PHE  22           1HD      PHE  22   1.041   3.381  -0.737
  156    HD2  PHE  22           2HD      PHE  22  -0.739   7.060   0.444
  157    HE1  PHE  22           1HE      PHE  22  -0.067   2.239   1.139
  158    HE2  PHE  22           2HE      PHE  22  -1.847   5.925   2.323
  159    HZ   PHE  22           HZ       PHE  22  -1.512   3.512   2.673
  160    H    LYS  23           H        LYS  23   3.052   7.274  -3.387
  161    HA   LYS  23           HA       LYS  23   2.969   5.285  -5.462
  162   1HB   LYS  23          2HB       LYS  23   2.379   7.810  -5.620
  163   2HB   LYS  23          1HB       LYS  23   4.119   8.041  -5.791
  164   1HG   LYS  23          2HG       LYS  23   3.359   7.950  -7.980
  165   2HG   LYS  23          1HG       LYS  23   3.952   6.314  -7.686
  166   1HD   LYS  23          2HD       LYS  23   1.874   5.402  -7.758
  167   2HD   LYS  23          1HD       LYS  23   1.107   6.831  -7.052
  168   1HE   LYS  23          2HE       LYS  23   0.341   7.184  -9.131
  169   2HE   LYS  23          1HE       LYS  23   1.963   7.797  -9.448
  170   1HZ   LYS  23          1HZ       LYS  23   1.117   6.118 -11.072
  171   2HZ   LYS  23          2HZ       LYS  23   1.199   4.960  -9.841
  172   3HZ   LYS  23          3HZ       LYS  23   2.608   5.732 -10.369
  173    H    ALA  24           H        ALA  24   5.247   6.170  -3.178
  174    HA   ALA  24           HA       ALA  24   7.684   6.295  -4.407
  175   1HB   ALA  24          1HB       ALA  24   6.980   4.814  -1.877
  176   2HB   ALA  24          2HB       ALA  24   7.456   6.508  -2.020
  177   3HB   ALA  24          3HB       ALA  24   8.619   5.231  -2.380
  178    H    ALA  25           H        ALA  25   6.628   3.215  -2.991
  179    HA   ALA  25           HA       ALA  25   8.346   1.726  -4.727
  180   1HB   ALA  25          1HB       ALA  25   7.610  -0.206  -3.522
  181   2HB   ALA  25          2HB       ALA  25   6.227   0.669  -2.869
  182   3HB   ALA  25          3HB       ALA  25   7.859   1.105  -2.370
  183    H    PHE  26           H        PHE  26   5.376   3.072  -5.317
  184    HA   PHE  26           HA       PHE  26   3.766   1.185  -6.453
  185   1HB   PHE  26          2HB       PHE  26   3.891   3.956  -6.483
  186   2HB   PHE  26          1HB       PHE  26   3.959   3.518  -8.185
  187    HD1  PHE  26           1HD      PHE  26   2.108   2.311  -9.231
  188    HD2  PHE  26           2HD      PHE  26   1.917   3.608  -5.181
  189    HE1  PHE  26           1HE      PHE  26  -0.330   1.979  -9.243
  190    HE2  PHE  26           2HE      PHE  26  -0.521   3.277  -5.187
  191    HZ   PHE  26           HZ       PHE  26  -1.648   2.461  -7.219
  192    H    ASP  27           H        ASP  27   6.807   2.356  -7.684
  193    HA   ASP  27           HA       ASP  27   6.426   1.134 -10.284
  194   1HB   ASP  27          2HB       ASP  27   8.337   2.986  -9.064
  195   2HB   ASP  27          1HB       ASP  27   9.104   1.792 -10.108
  196    H    MET  28           H        MET  28   8.767   0.714  -7.620
  197    HA   MET  28           HA       MET  28   9.935  -1.629  -8.596
  198   1HB   MET  28          2HB       MET  28  10.326   0.015  -6.418
  199   2HB   MET  28          1HB       MET  28   9.792  -1.486  -5.675
  200   1HG   MET  28          2HG       MET  28  12.152  -1.553  -5.766
  201   2HG   MET  28          1HG       MET  28  11.554  -2.668  -7.000
  202   1HE   MET  28          1HE       MET  28  11.836   1.314  -7.089
  203   2HE   MET  28          2HE       MET  28  13.444   1.460  -7.799
  204   3HE   MET  28          3HE       MET  28  13.246   0.717  -6.212
  205    H    PHE  29           H        PHE  29   6.966  -1.112  -6.858
  206    HA   PHE  29           HA       PHE  29   6.528  -3.669  -5.825
  207   1HB   PHE  29          2HB       PHE  29   4.935  -1.282  -6.354
  208   2HB   PHE  29          1HB       PHE  29   4.005  -2.769  -6.553
  209    HD1  PHE  29           1HD      PHE  29   5.265  -0.397  -4.241
  210    HD2  PHE  29           2HD      PHE  29   4.121  -4.471  -4.634
  211    HE1  PHE  29           1HE      PHE  29   4.995  -0.547  -1.803
  212    HE2  PHE  29           2HE      PHE  29   3.844  -4.631  -2.199
  213    HZ   PHE  29           HZ       PHE  29   4.281  -2.669  -0.777
  214    H    ASP  30           H        ASP  30   4.737  -2.422  -8.629
  215    HA   ASP  30           HA       ASP  30   3.927  -4.863  -9.624
  216   1HB   ASP  30          2HB       ASP  30   4.475  -2.272 -11.079
  217   2HB   ASP  30          1HB       ASP  30   3.696  -3.667 -11.831
  218    H    ALA  31           H        ALA  31   5.020  -6.532 -10.354
  219    HA   ALA  31           HA       ALA  31   7.754  -6.190 -11.314
  220   1HB   ALA  31          1HB       ALA  31   7.983  -8.560 -11.062
  221   2HB   ALA  31          2HB       ALA  31   6.242  -8.756 -10.858
  222   3HB   ALA  31          3HB       ALA  31   7.187  -7.929  -9.619
  223    H    ASP  32           H        ASP  32   4.703  -7.666 -12.379
  224    HA   ASP  32           HA       ASP  32   5.726  -8.137 -15.038
  225   1HB   ASP  32          2HB       ASP  32   3.359  -8.893 -15.485
  226   2HB   ASP  32          1HB       ASP  32   4.194  -9.772 -14.202
  227    H    GLY  33           H        GLY  33   4.028  -5.642 -13.375
  228   1HA   GLY  33          2HA       GLY  33   3.590  -3.489 -14.122
  229   2HA   GLY  33          1HA       GLY  33   4.101  -3.975 -15.731
  230    H    GLY  34           H        GLY  34   1.608  -5.527 -13.771
  231   1HA   GLY  34          2HA       GLY  34  -0.671  -4.290 -14.655
  232   2HA   GLY  34          1HA       GLY  34  -0.253  -5.411 -15.950
  233    H    GLY  35           H        GLY  35   0.083  -5.785 -12.432
  234   1HA   GLY  35          2HA       GLY  35  -2.077  -7.754 -12.427
  235   2HA   GLY  35          1HA       GLY  35  -0.464  -8.342 -12.030
  236    H    ASP  36           H        ASP  36  -1.259  -5.118 -11.098
  237    HA   ASP  36           HA       ASP  36  -1.449  -4.123  -9.062
  238   1HB   ASP  36          2HB       ASP  36  -3.197  -6.542  -8.809
  239   2HB   ASP  36          1HB       ASP  36  -2.927  -5.516  -7.395
  240    H    ILE  37           H        ILE  37  -1.366  -4.808  -6.507
  241    HA   ILE  37           HA       ILE  37   1.241  -6.119  -6.252
  242    HB   ILE  37           HB       ILE  37  -0.244  -4.232  -4.427
  243   1HG1  ILE  37          2HG1      ILE  37   2.423  -3.964  -5.826
  244   2HG1  ILE  37          1HG1      ILE  37   0.906  -3.285  -6.424
  245   1HG2  ILE  37          1HG2      ILE  37   1.714  -4.320  -2.946
  246   2HG2  ILE  37          2HG2      ILE  37   2.387  -5.617  -3.932
  247   3HG2  ILE  37          3HG2      ILE  37   0.886  -5.874  -3.044
  248   1HD1  ILE  37          1HD1      ILE  37   2.069  -2.603  -3.741
  249   2HD1  ILE  37          2HD1      ILE  37   0.766  -1.786  -4.603
  250   3HD1  ILE  37          3HD1      ILE  37   2.417  -1.697  -5.213
  251    H    SER  38           H        SER  38   1.330  -8.124  -5.524
  252    HA   SER  38           HA       SER  38  -0.917  -9.175  -3.947
  253   1HB   SER  38          2HB       SER  38  -0.461 -11.317  -4.810
  254   2HB   SER  38          1HB       SER  38  -0.201 -10.245  -6.192
  255    HG   SER  38           HG       SER  38   2.085 -10.273  -5.463
  256    H    THR  39           H        THR  39   0.365 -11.432  -2.907
  257    HA   THR  39           HA       THR  39   1.579 -10.343  -0.594
  258    HB   THR  39           HB       THR  39   2.165 -12.863  -0.223
  259    HG1  THR  39           1HG      THR  39   1.758 -13.299  -2.523
  260   1HG2  THR  39          1HG2      THR  39  -0.692 -11.951  -0.447
  261   2HG2  THR  39          2HG2      THR  39   0.351 -11.819   0.970
  262   3HG2  THR  39          3HG2      THR  39  -0.146 -13.407   0.387
  263    H    LYS  40           H        LYS  40   2.846 -11.587  -3.589
  264    HA   LYS  40           HA       LYS  40   5.542 -11.857  -2.603
  265   1HB   LYS  40          2HB       LYS  40   4.194 -12.188  -5.252
  266   2HB   LYS  40          1HB       LYS  40   5.948 -12.006  -5.202
  267   1HG   LYS  40          2HG       LYS  40   6.271 -14.031  -4.211
  268   2HG   LYS  40          1HG       LYS  40   4.702 -14.005  -3.391
  269   1HD   LYS  40          2HD       LYS  40   3.928 -14.076  -5.990
  270   2HD   LYS  40          1HD       LYS  40   5.431 -14.998  -6.065
  271   1HE   LYS  40          2HE       LYS  40   3.840 -16.628  -5.621
  272   2HE   LYS  40          1HE       LYS  40   4.494 -16.266  -4.025
  273   1HZ   LYS  40          1HZ       LYS  40   2.025 -16.408  -4.139
  274   2HZ   LYS  40          2HZ       LYS  40   2.028 -15.017  -5.102
  275   3HZ   LYS  40          3HZ       LYS  40   2.606 -14.946  -3.514
  276    H    GLU  41           H        GLU  41   3.708  -9.506  -4.485
  277    HA   GLU  41           HA       GLU  41   5.893  -7.882  -5.230
  278   1HB   GLU  41          2HB       GLU  41   2.962  -7.232  -4.913
  279   2HB   GLU  41          1HB       GLU  41   4.141  -6.128  -5.602
  280   1HG   GLU  41          2HG       GLU  41   4.551  -8.413  -7.053
  281   2HG   GLU  41          1HG       GLU  41   2.807  -8.427  -6.791
  282    H    LEU  42           H        LEU  42   4.351  -8.326  -2.214
  283    HA   LEU  42           HA       LEU  42   5.012  -5.707  -1.190
  284   1HB   LEU  42          2HB       LEU  42   3.350  -7.894  -0.381
  285   2HB   LEU  42          1HB       LEU  42   4.441  -7.488   0.937
  286    HG   LEU  42           HG       LEU  42   2.430  -6.253   1.261
  287   1HD1  LEU  42          1HD1      LEU  42   4.485  -5.036   1.747
  288   2HD1  LEU  42          2HD1      LEU  42   3.220  -3.945   1.183
  289   3HD1  LEU  42          3HD1      LEU  42   4.524  -4.422   0.095
  290   1HD2  LEU  42          1HD2      LEU  42   2.375  -6.179  -1.575
  291   2HD2  LEU  42          2HD2      LEU  42   2.304  -4.522  -0.974
  292   3HD2  LEU  42          3HD2      LEU  42   1.118  -5.709  -0.433
  293    H    GLY  43           H        GLY  43   5.953  -9.010  -0.205
  294   1HA   GLY  43          2HA       GLY  43   8.001  -8.399   1.511
  295   2HA   GLY  43          1HA       GLY  43   7.989  -9.834   0.490
  296    H    THR  44           H        THR  44   8.029  -8.171  -1.966
  297    HA   THR  44           HA       THR  44  10.786  -8.147  -2.425
  298    HB   THR  44           HB       THR  44   8.374  -7.166  -3.860
  299    HG1  THR  44           1HG      THR  44  10.611  -8.731  -4.617
  300   1HG2  THR  44          1HG2      THR  44   9.529  -5.298  -4.509
  301   2HG2  THR  44          2HG2      THR  44  10.027  -6.458  -5.744
  302   3HG2  THR  44          3HG2      THR  44  11.100  -6.094  -4.392
  303    H    VAL  45           H        VAL  45   8.800  -5.223  -2.661
  304    HA   VAL  45           HA       VAL  45  10.939  -3.459  -2.219
  305    HB   VAL  45           HB       VAL  45   8.919  -2.782  -3.397
  306   1HG1  VAL  45          1HG1      VAL  45   7.010  -2.149  -1.580
  307   2HG1  VAL  45          2HG1      VAL  45   7.646  -3.644  -0.894
  308   3HG1  VAL  45          3HG1      VAL  45   7.022  -3.626  -2.544
  309   1HG2  VAL  45          1HG2      VAL  45   9.394  -0.679  -2.850
  310   2HG2  VAL  45          2HG2      VAL  45  10.273  -1.275  -1.444
  311   3HG2  VAL  45          3HG2      VAL  45   8.567  -0.856  -1.303
  312    H    MET  46           H        MET  46   8.844  -5.120  -0.000
  313    HA   MET  46           HA       MET  46   9.330  -3.347   2.200
  314   1HB   MET  46          2HB       MET  46   7.955  -5.973   1.843
  315   2HB   MET  46          1HB       MET  46   8.402  -5.467   3.472
  316   1HG   MET  46          2HG       MET  46   6.650  -3.951   1.546
  317   2HG   MET  46          1HG       MET  46   6.115  -4.851   2.969
  318   1HE   MET  46          1HE       MET  46   4.790  -3.126   3.652
  319   2HE   MET  46          2HE       MET  46   5.248  -1.550   4.301
  320   3HE   MET  46          3HE       MET  46   5.495  -3.008   5.264
  321    H    ARG  47           H        ARG  47  10.799  -6.287   0.976
  322    HA   ARG  47           HA       ARG  47  12.427  -6.648   3.338
  323   1HB   ARG  47          2HB       ARG  47  12.337  -8.052   0.673
  324   2HB   ARG  47          1HB       ARG  47  13.526  -8.437   1.908
  325   1HG   ARG  47          2HG       ARG  47  11.909  -9.267   3.376
  326   2HG   ARG  47          1HG       ARG  47  10.587  -8.500   2.492
  327   1HD   ARG  47          2HD       ARG  47  10.393 -10.707   1.836
  328   2HD   ARG  47          1HD       ARG  47  11.365 -10.015   0.531
  329    HE   ARG  47           HE       ARG  47  13.121 -11.333   1.185
  330   1HH1  ARG  47          1HH1      ARG  47  10.724 -11.303   3.721
  331   2HH1  ARG  47          2HH1      ARG  47  11.502 -12.545   4.643
  332   1HH2  ARG  47          1HH2      ARG  47  14.146 -12.967   2.396
  333   2HH2  ARG  47          2HH2      ARG  47  13.445 -13.489   3.891
  334    H    MET  48           H        MET  48  12.760  -5.219   0.162
  335    HA   MET  48           HA       MET  48  15.627  -4.871   0.500
  336   1HB   MET  48          2HB       MET  48  15.590  -3.912  -1.743
  337   2HB   MET  48          1HB       MET  48  14.758  -5.467  -1.713
  338   1HG   MET  48          2HG       MET  48  12.870  -4.565  -2.436
  339   2HG   MET  48          1HG       MET  48  12.930  -3.289  -1.223
  340   1HE   MET  48          1HE       MET  48  12.193  -1.399  -2.134
  341   2HE   MET  48          2HE       MET  48  11.678  -1.873  -3.752
  342   3HE   MET  48          3HE       MET  48  12.777  -0.510  -3.539
  343    H    LEU  49           H        LEU  49  13.226  -3.393   1.947
  344    HA   LEU  49           HA       LEU  49  14.399  -0.707   1.642
  345   1HB   LEU  49          2HB       LEU  49  11.566  -1.579   2.067
  346   2HB   LEU  49          1HB       LEU  49  12.089   0.003   2.610
  347    HG   LEU  49           HG       LEU  49  12.113  -1.028  -0.224
  348   1HD1  LEU  49          1HD1      LEU  49  10.598   1.014  -0.488
  349   2HD1  LEU  49          2HD1      LEU  49  10.443   0.969   1.268
  350   3HD1  LEU  49          3HD1      LEU  49   9.919  -0.410   0.300
  351   1HD2  LEU  49          1HD2      LEU  49  13.582   1.155   1.052
  352   2HD2  LEU  49          2HD2      LEU  49  12.647   1.646  -0.361
  353   3HD2  LEU  49          3HD2      LEU  49  13.846   0.361  -0.500
  354    H    GLY  50           H        GLY  50  13.047  -3.077   3.880
  355   1HA   GLY  50          2HA       GLY  50  14.757  -2.873   5.936
  356   2HA   GLY  50          1HA       GLY  50  13.736  -1.459   6.192
  357    H    GLN  51           H        GLN  51  11.340  -2.768   5.162
  358    HA   GLN  51           HA       GLN  51  10.408  -3.899   7.589
  359   1HB   GLN  51          2HB       GLN  51   9.290  -2.971   5.138
  360   2HB   GLN  51          1HB       GLN  51   8.667  -4.593   5.435
  361   1HG   GLN  51          2HG       GLN  51   8.649  -2.725   7.724
  362   2HG   GLN  51          1HG       GLN  51   7.534  -2.377   6.403
  363   1HE2  GLN  51          1HE2      GLN  51   8.277  -4.436   9.048
  364   2HE2  GLN  51          2HE2      GLN  51   6.860  -5.421   8.967
  365    H    ASN  52           H        ASN  52   9.456  -6.062   7.830
  366    HA   ASN  52           HA       ASN  52  10.551  -8.107   6.054
  367   1HB   ASN  52          2HB       ASN  52  12.153  -7.633   7.988
  368   2HB   ASN  52          1HB       ASN  52  10.922  -8.345   9.035
  369   1HD2  ASN  52          1HD2      ASN  52  13.509  -8.933   6.934
  370   2HD2  ASN  52          2HD2      ASN  52  13.405 -10.656   6.897
  371    HA   PRO  53           HA       PRO  53   6.261  -8.921   7.914
  372   1HB   PRO  53          2HB       PRO  53   4.774  -8.537   5.689
  373   2HB   PRO  53          1HB       PRO  53   5.169  -7.223   6.802
  374   1HG   PRO  53          2HG       PRO  53   6.460  -7.951   4.198
  375   2HG   PRO  53          1HG       PRO  53   6.007  -6.349   4.812
  376   1HD   PRO  53          2HD       PRO  53   8.548  -7.293   4.923
  377   2HD   PRO  53          1HD       PRO  53   7.878  -6.192   6.147
  378    H    THR  54           H        THR  54   6.502 -11.093   8.106
  379    HA   THR  54           HA       THR  54   7.346 -12.876   6.145
  380    HB   THR  54           HB       THR  54   6.373 -14.640   7.565
  381    HG1  THR  54           1HG      THR  54   5.249 -12.476   9.012
  382   1HG2  THR  54          1HG2      THR  54   7.601 -14.276   9.552
  383   2HG2  THR  54          2HG2      THR  54   7.552 -12.525   9.339
  384   3HG2  THR  54          3HG2      THR  54   8.508 -13.520   8.241
  385    H    LYS  55           H        LYS  55   5.734 -14.871   5.645
  386    HA   LYS  55           HA       LYS  55   4.063 -14.000   3.592
  387   1HB   LYS  55          2HB       LYS  55   5.033 -16.422   4.405
  388   2HB   LYS  55          1HB       LYS  55   3.322 -16.583   4.800
  389   1HG   LYS  55          2HG       LYS  55   3.173 -15.553   2.300
  390   2HG   LYS  55          1HG       LYS  55   4.663 -16.492   2.191
  391   1HD   LYS  55          2HD       LYS  55   3.580 -18.464   2.343
  392   2HD   LYS  55          1HD       LYS  55   2.426 -17.852   3.530
  393   1HE   LYS  55          2HE       LYS  55   0.917 -17.283   1.958
  394   2HE   LYS  55          1HE       LYS  55   2.152 -16.727   0.829
  395   1HZ   LYS  55          1HZ       LYS  55   1.050 -18.645  -0.063
  396   2HZ   LYS  55          2HZ       LYS  55   1.365 -19.545   1.334
  397   3HZ   LYS  55          3HZ       LYS  55   2.639 -19.070   0.329
  398    H    CYS  56           H        CYS  56   3.180 -15.194   6.830
  399    HA   CYS  56           HA       CYS  56   0.406 -14.780   6.541
  400   1HB   CYS  56          2HB       CYS  56   1.567 -16.198   8.295
  401   2HB   CYS  56          1HB       CYS  56   1.935 -14.696   9.145
  402    HG   CYS  56           HG       CYS  56  -1.026 -14.909   8.682
  403    H    GLU  57           H        GLU  57   3.032 -12.675   7.458
  404    HA   GLU  57           HA       GLU  57   1.604 -10.614   8.691
  405   1HB   GLU  57          2HB       GLU  57   4.243 -11.073   7.987
  406   2HB   GLU  57          1HB       GLU  57   3.802  -9.670   7.013
  407   1HG   GLU  57          2HG       GLU  57   3.339  -9.832   9.979
  408   2HG   GLU  57          1HG       GLU  57   4.809  -9.178   9.258
  409    H    LEU  58           H        LEU  58   2.709 -10.767   5.300
  410    HA   LEU  58           HA       LEU  58   1.139  -8.535   4.498
  411   1HB   LEU  58          2HB       LEU  58   2.244 -10.678   2.691
  412   2HB   LEU  58          1HB       LEU  58   1.870  -9.010   2.278
  413    HG   LEU  58           HG       LEU  58   4.005  -9.693   4.285
  414   1HD1  LEU  58          1HD1      LEU  58   4.105  -9.803   1.314
  415   2HD1  LEU  58          2HD1      LEU  58   4.932 -10.799   2.512
  416   3HD1  LEU  58          3HD1      LEU  58   5.496  -9.160   2.187
  417   1HD2  LEU  58          1HD2      LEU  58   3.646  -7.447   4.476
  418   2HD2  LEU  58          2HD2      LEU  58   3.098  -7.279   2.809
  419   3HD2  LEU  58          3HD2      LEU  58   4.819  -7.447   3.158
  420    H    ASP  59           H        ASP  59   0.669 -12.018   4.451
  421    HA   ASP  59           HA       ASP  59  -1.636 -12.060   2.818
  422   1HB   ASP  59          2HB       ASP  59  -0.151 -14.029   3.524
  423   2HB   ASP  59          1HB       ASP  59  -1.077 -14.033   5.028
  424    H    ALA  60           H        ALA  60  -1.139 -11.244   6.144
  425    HA   ALA  60           HA       ALA  60  -3.871 -11.590   6.923
  426   1HB   ALA  60          1HB       ALA  60  -1.396 -10.605   8.191
  427   2HB   ALA  60          2HB       ALA  60  -2.646 -11.679   8.821
  428   3HB   ALA  60          3HB       ALA  60  -2.904  -9.936   8.815
  429    H    ILE  61           H        ILE  61  -1.921  -9.002   5.623
  430    HA   ILE  61           HA       ILE  61  -3.908  -6.968   6.090
  431    HB   ILE  61           HB       ILE  61  -1.255  -7.037   4.690
  432   1HG1  ILE  61          2HG1      ILE  61  -0.921  -5.058   6.275
  433   2HG1  ILE  61          1HG1      ILE  61  -2.457  -5.527   7.009
  434   1HG2  ILE  61          1HG2      ILE  61  -2.575  -5.746   3.170
  435   2HG2  ILE  61          2HG2      ILE  61  -1.576  -4.637   4.109
  436   3HG2  ILE  61          3HG2      ILE  61  -3.287  -4.823   4.493
  437   1HD1  ILE  61          1HD1      ILE  61  -1.486  -7.763   7.461
  438   2HD1  ILE  61          2HD1      ILE  61  -0.663  -6.444   8.294
  439   3HD1  ILE  61          3HD1      ILE  61   0.060  -7.167   6.858
  440    H    ILE  62           H        ILE  62  -2.480  -8.362   3.122
  441    HA   ILE  62           HA       ILE  62  -4.106  -7.328   1.207
  442    HB   ILE  62           HB       ILE  62  -3.130 -10.183   1.346
  443   1HG1  ILE  62          2HG1      ILE  62  -1.955  -7.666   0.147
  444   2HG1  ILE  62          1HG1      ILE  62  -1.306  -8.603   1.495
  445   1HG2  ILE  62          1HG2      ILE  62  -4.107  -8.586  -1.021
  446   2HG2  ILE  62          2HG2      ILE  62  -4.921  -9.967  -0.286
  447   3HG2  ILE  62          3HG2      ILE  62  -3.370 -10.187  -1.097
  448   1HD1  ILE  62          1HD1      ILE  62  -0.632  -8.827  -1.182
  449   2HD1  ILE  62          2HD1      ILE  62  -1.637 -10.238  -0.856
  450   3HD1  ILE  62          3HD1      ILE  62  -0.200  -9.936   0.119
  451    H    CYS  63           H        CYS  63  -4.837 -10.127   3.262
  452    HA   CYS  63           HA       CYS  63  -7.279 -10.837   2.092
  453   1HB   CYS  63          2HB       CYS  63  -5.829 -12.011   3.945
  454   2HB   CYS  63          1HB       CYS  63  -6.860 -11.098   5.049
  455    HG   CYS  63           HG       CYS  63  -7.649 -13.603   3.578
  456    H    GLU  64           H        GLU  64  -6.499  -8.532   4.651
  457    HA   GLU  64           HA       GLU  64  -9.232  -7.816   5.143
  458   1HB   GLU  64          2HB       GLU  64  -6.570  -6.959   6.116
  459   2HB   GLU  64          1HB       GLU  64  -7.833  -5.737   6.168
  460   1HG   GLU  64          2HG       GLU  64  -9.080  -6.891   7.715
  461   2HG   GLU  64          1HG       GLU  64  -8.376  -8.448   7.278
  462    H    VAL  65           H        VAL  65  -6.587  -6.590   3.189
  463    HA   VAL  65           HA       VAL  65  -7.764  -4.137   2.428
  464    HB   VAL  65           HB       VAL  65  -5.768  -5.827   0.905
  465   1HG1  VAL  65          1HG1      VAL  65  -6.289  -2.871   0.649
  466   2HG1  VAL  65          2HG1      VAL  65  -6.962  -4.087  -0.437
  467   3HG1  VAL  65          3HG1      VAL  65  -5.216  -3.865  -0.337
  468   1HG2  VAL  65          1HG2      VAL  65  -4.141  -4.121   1.883
  469   2HG2  VAL  65          2HG2      VAL  65  -4.773  -5.345   2.980
  470   3HG2  VAL  65          3HG2      VAL  65  -5.430  -3.712   3.015
  471    H    ASP  66           H        ASP  66  -7.497  -7.219   0.666
  472    HA   ASP  66           HA       ASP  66  -9.233  -6.434  -1.433
  473   1HB   ASP  66          2HB       ASP  66  -8.286  -9.160  -0.530
  474   2HB   ASP  66          1HB       ASP  66  -9.217  -8.878  -1.999
  475    H    GLU  67           H        GLU  67 -11.220  -5.768  -0.758
  476    HA   GLU  67           HA       GLU  67 -12.756  -7.202   1.186
  477   1HB   GLU  67          2HB       GLU  67 -13.167  -4.814  -0.544
  478   2HB   GLU  67          1HB       GLU  67 -14.606  -5.633   0.065
  479   1HG   GLU  67          2HG       GLU  67 -13.073  -5.436   2.314
  480   2HG   GLU  67          1HG       GLU  67 -12.665  -3.946   1.452
  481    H    ASP  68           H        ASP  68 -12.456  -7.246  -2.280
  482    HA   ASP  68           HA       ASP  68 -14.883  -8.745  -2.706
  483   1HB   ASP  68          2HB       ASP  68 -14.165  -8.841  -5.044
  484   2HB   ASP  68          1HB       ASP  68 -14.042  -7.197  -4.425
  485    H    GLY  69           H        GLY  69 -11.490  -9.418  -2.231
  486   1HA   GLY  69          2HA       GLY  69 -10.708 -11.508  -1.429
  487   2HA   GLY  69          1HA       GLY  69 -12.129 -12.275  -2.122
  488    H    SER  70           H        SER  70  -9.602 -10.161  -3.473
  489    HA   SER  70           HA       SER  70  -9.196 -12.170  -5.585
  490   1HB   SER  70          2HB       SER  70  -8.063  -9.996  -6.663
  491   2HB   SER  70          1HB       SER  70  -9.795 -10.327  -6.807
  492    HG   SER  70           HG       SER  70  -9.427  -8.198  -6.103
  493    H    GLY  71           H        GLY  71  -7.665 -10.348  -3.065
  494   1HA   GLY  71          2HA       GLY  71  -5.606 -10.747  -2.071
  495   2HA   GLY  71          1HA       GLY  71  -5.274 -11.945  -3.320
  496    H    THR  72           H        THR  72  -6.243  -9.235  -4.919
  497    HA   THR  72           HA       THR  72  -3.463  -8.328  -5.250
  498    HB   THR  72           HB       THR  72  -4.242  -7.531  -7.504
  499    HG1  THR  72           1HG      THR  72  -6.418  -7.445  -7.304
  500   1HG2  THR  72          1HG2      THR  72  -4.671 -10.480  -7.122
  501   2HG2  THR  72          2HG2      THR  72  -3.086  -9.711  -7.221
  502   3HG2  THR  72          3HG2      THR  72  -4.187  -9.644  -8.598
  503    H    ILE  73           H        ILE  73  -3.000  -6.145  -5.274
  504    HA   ILE  73           HA       ILE  73  -5.102  -4.423  -4.161
  505    HB   ILE  73           HB       ILE  73  -2.130  -3.911  -4.225
  506   1HG1  ILE  73          2HG1      ILE  73  -3.741  -4.845  -1.846
  507   2HG1  ILE  73          1HG1      ILE  73  -2.881  -5.964  -2.907
  508   1HG2  ILE  73          1HG2      ILE  73  -2.503  -2.015  -3.037
  509   2HG2  ILE  73          2HG2      ILE  73  -3.927  -2.668  -2.228
  510   3HG2  ILE  73          3HG2      ILE  73  -4.045  -2.084  -3.888
  511   1HD1  ILE  73          1HD1      ILE  73  -0.778  -4.975  -2.331
  512   2HD1  ILE  73          2HD1      ILE  73  -1.646  -5.375  -0.849
  513   3HD1  ILE  73          3HD1      ILE  73  -1.578  -3.704  -1.408
  514    H    ASP  74           H        ASP  74  -6.062  -3.042  -5.488
  515    HA   ASP  74           HA       ASP  74  -5.109  -2.518  -8.120
  516   1HB   ASP  74          2HB       ASP  74  -7.519  -2.049  -6.599
  517   2HB   ASP  74          1HB       ASP  74  -7.068  -0.596  -7.495
  518    H    PHE  75           H        PHE  75  -5.582   0.130  -8.598
  519    HA   PHE  75           HA       PHE  75  -3.146   1.329  -7.899
  520   1HB   PHE  75          2HB       PHE  75  -4.517   1.912  -9.902
  521   2HB   PHE  75          1HB       PHE  75  -5.655   2.739  -8.836
  522    HD1  PHE  75           1HD      PHE  75  -4.667   4.609  -7.342
  523    HD2  PHE  75           2HD      PHE  75  -2.748   3.074 -10.815
  524    HE1  PHE  75           1HE      PHE  75  -3.321   6.663  -7.500
  525    HE2  PHE  75           2HE      PHE  75  -1.397   5.124 -10.980
  526    HZ   PHE  75           HZ       PHE  75  -1.683   6.921  -9.321
  527    H    GLU  76           H        GLU  76  -6.325   2.702  -7.041
  528    HA   GLU  76           HA       GLU  76  -5.290   4.193  -4.878
  529   1HB   GLU  76          2HB       GLU  76  -8.145   3.353  -5.419
  530   2HB   GLU  76          1HB       GLU  76  -7.647   4.599  -4.283
  531   1HG   GLU  76          2HG       GLU  76  -6.531   5.132  -6.868
  532   2HG   GLU  76          1HG       GLU  76  -8.273   4.889  -6.997
  533    H    GLU  77           H        GLU  77  -6.510   0.955  -5.163
  534    HA   GLU  77           HA       GLU  77  -7.246   0.356  -2.574
  535   1HB   GLU  77          2HB       GLU  77  -6.307  -1.157  -4.905
  536   2HB   GLU  77          1HB       GLU  77  -5.969  -1.944  -3.369
  537   1HG   GLU  77          2HG       GLU  77  -8.407  -1.580  -2.800
  538   2HG   GLU  77          1HG       GLU  77  -8.631  -1.140  -4.498
  539    H    PHE  78           H        PHE  78  -4.062   0.908  -3.864
  540    HA   PHE  78           HA       PHE  78  -2.556  -0.352  -1.832
  541   1HB   PHE  78          2HB       PHE  78  -1.715   0.483  -4.090
  542   2HB   PHE  78          1HB       PHE  78  -1.683   2.097  -3.373
  543    HD1  PHE  78           1HD      PHE  78  -0.692  -1.269  -2.103
  544    HD2  PHE  78           2HD      PHE  78   0.488   2.725  -2.976
  545    HE1  PHE  78           1HE      PHE  78   1.537  -1.728  -1.170
  546    HE2  PHE  78           2HE      PHE  78   2.721   2.271  -2.047
  547    HZ   PHE  78           HZ       PHE  78   3.246   0.044  -1.140
  548    H    LEU  79           H        LEU  79  -4.474   2.464  -1.776
  549    HA   LEU  79           HA       LEU  79  -3.038   3.573   0.518
  550   1HB   LEU  79          2HB       LEU  79  -5.461   4.628  -0.951
  551   2HB   LEU  79          1HB       LEU  79  -4.597   5.459   0.328
  552    HG   LEU  79           HG       LEU  79  -2.606   4.952  -1.511
  553   1HD1  LEU  79          1HD1      LEU  79  -5.216   5.324  -2.907
  554   2HD1  LEU  79          2HD1      LEU  79  -3.853   4.284  -3.326
  555   3HD1  LEU  79          3HD1      LEU  79  -3.748   6.025  -3.589
  556   1HD2  LEU  79          1HD2      LEU  79  -2.995   7.017  -0.226
  557   2HD2  LEU  79          2HD2      LEU  79  -4.322   7.423  -1.315
  558   3HD2  LEU  79          3HD2      LEU  79  -2.671   7.334  -1.930
  559    H    VAL  80           H        VAL  80  -6.287   2.446  -0.375
  560    HA   VAL  80           HA       VAL  80  -7.440   2.635   2.169
  561    HB   VAL  80           HB       VAL  80  -8.647   2.238  -0.021
  562   1HG1  VAL  80          1HG1      VAL  80  -7.200   0.244  -0.610
  563   2HG1  VAL  80          2HG1      VAL  80  -8.933   0.061  -0.868
  564   3HG1  VAL  80          3HG1      VAL  80  -8.168  -0.673   0.541
  565   1HG2  VAL  80          1HG2      VAL  80  -9.632   0.251   1.959
  566   2HG2  VAL  80          2HG2      VAL  80 -10.508   1.508   1.086
  567   3HG2  VAL  80          3HG2      VAL  80  -9.487   1.937   2.458
  568    H    MET  81           H        MET  81  -5.382   0.216   0.736
  569    HA   MET  81           HA       MET  81  -5.843  -1.972   2.361
  570   1HB   MET  81          2HB       MET  81  -3.289  -2.356   2.035
  571   2HB   MET  81          1HB       MET  81  -4.344  -2.389   0.634
  572   1HG   MET  81          2HG       MET  81  -3.449  -0.559  -0.258
  573   2HG   MET  81          1HG       MET  81  -3.199   0.229   1.299
  574   1HE   MET  81          1HE       MET  81   0.067  -1.409   2.570
  575   2HE   MET  81          2HE       MET  81  -1.619  -1.781   2.948
  576   3HE   MET  81          3HE       MET  81  -1.094  -0.101   2.802
  577    H    MET  82           H        MET  82  -3.829   0.850   2.930
  578    HA   MET  82           HA       MET  82  -3.045  -0.082   5.555
  579   1HB   MET  82          2HB       MET  82  -2.157   1.948   3.664
  580   2HB   MET  82          1HB       MET  82  -2.207   2.544   5.327
  581   1HG   MET  82          2HG       MET  82  -0.594   1.087   6.048
  582   2HG   MET  82          1HG       MET  82  -0.945  -0.098   4.793
  583   1HE   MET  82          1HE       MET  82  -0.636   3.584   4.580
  584   2HE   MET  82          2HE       MET  82   0.768   3.914   3.563
  585   3HE   MET  82          3HE       MET  82   0.985   3.559   5.276
  586    H    VAL  83           H        VAL  83  -5.419   2.001   4.128
  587    HA   VAL  83           HA       VAL  83  -6.022   3.630   6.340
  588    HB   VAL  83           HB       VAL  83  -7.820   2.658   4.109
  589   1HG1  VAL  83          1HG1      VAL  83  -9.239   4.621   4.716
  590   2HG1  VAL  83          2HG1      VAL  83  -8.286   4.785   6.192
  591   3HG1  VAL  83          3HG1      VAL  83  -9.236   3.325   5.914
  592   1HG2  VAL  83          1HG2      VAL  83  -7.421   5.254   3.596
  593   2HG2  VAL  83          2HG2      VAL  83  -6.378   3.981   2.972
  594   3HG2  VAL  83          3HG2      VAL  83  -5.899   4.884   4.407
  595    H    ARG  84           H        ARG  84  -6.967   0.375   5.456
  596    HA   ARG  84           HA       ARG  84  -8.986   0.092   7.456
  597   1HB   ARG  84          2HB       ARG  84  -7.457  -2.102   6.052
  598   2HB   ARG  84          1HB       ARG  84  -9.020  -2.239   6.845
  599   1HG   ARG  84          2HG       ARG  84  -9.361  -0.220   4.962
  600   2HG   ARG  84          1HG       ARG  84  -8.384  -1.448   4.146
  601   1HD   ARG  84          2HD       ARG  84 -10.307  -2.511   3.755
  602   2HD   ARG  84          1HD       ARG  84 -10.294  -2.931   5.466
  603    HE   ARG  84           HE       ARG  84 -11.480  -0.372   4.908
  604   1HH1  ARG  84          1HH1      ARG  84 -12.058  -3.806   5.134
  605   2HH1  ARG  84          2HH1      ARG  84 -13.752  -3.628   5.439
  606   1HH2  ARG  84          1HH2      ARG  84 -13.710  -0.135   5.308
  607   2HH2  ARG  84          2HH2      ARG  84 -14.691  -1.544   5.537
  608    H    GLN  85           H        GLN  85  -5.590   0.091   7.553
  609    HA   GLN  85           HA       GLN  85  -5.549  -1.449  10.058
  610   1HB   GLN  85          2HB       GLN  85  -3.098  -0.515   8.586
  611   2HB   GLN  85          1HB       GLN  85  -3.259  -1.853   9.723
  612   1HG   GLN  85          2HG       GLN  85  -4.238  -3.244   8.137
  613   2HG   GLN  85          1HG       GLN  85  -4.670  -1.893   7.081
  614   1HE2  GLN  85          1HE2      GLN  85  -3.666  -3.022   5.357
  615   2HE2  GLN  85          2HE2      GLN  85  -1.948  -3.021   5.181
  616    H    MET  86           H        MET  86  -5.221   1.697   8.709
  617    HA   MET  86           HA       MET  86  -3.773   2.848  10.903
  618   1HB   MET  86          2HB       MET  86  -5.041   3.826   8.396
  619   2HB   MET  86          1HB       MET  86  -4.788   4.999   9.689
  620   1HG   MET  86          2HG       MET  86  -2.394   4.355   9.733
  621   2HG   MET  86          1HG       MET  86  -2.693   3.309   8.340
  622   1HE   MET  86          1HE       MET  86  -2.768   4.551   5.614
  623   2HE   MET  86          2HE       MET  86  -1.507   3.896   6.660
  624   3HE   MET  86          3HE       MET  86  -1.280   5.460   5.878
  625    H    LYS  87           H        LYS  87  -7.150   2.907   9.794
  626    HA   LYS  87           HA       LYS  87  -8.070   4.486  11.982
  627   1HB   LYS  87          2HB       LYS  87  -9.438   2.841   9.867
  628   2HB   LYS  87          1HB       LYS  87 -10.353   3.586  11.177
  629   1HG   LYS  87          2HG       LYS  87 -10.280   5.591  10.218
  630   2HG   LYS  87          1HG       LYS  87  -8.546   5.461   9.894
  631   1HD   LYS  87          2HD       LYS  87  -9.464   5.587   7.764
  632   2HD   LYS  87          1HD       LYS  87  -9.263   3.850   8.001
  633   1HE   LYS  87          2HE       LYS  87 -11.837   5.199   8.721
  634   2HE   LYS  87          1HE       LYS  87 -11.498   4.752   7.049
  635   1HZ   LYS  87          1HZ       LYS  87 -11.090   2.457   7.873
  636   2HZ   LYS  87          2HZ       LYS  87 -12.687   2.980   8.058
  637   3HZ   LYS  87          3HZ       LYS  87 -11.651   2.941   9.394
  638    H    GLU  88           H        GLU  88  -8.828   1.097  11.158
  639    HA   GLU  88           HA       GLU  88  -9.651   0.543  13.855
  640   1HB   GLU  88          2HB       GLU  88 -10.404  -0.511  11.524
  641   2HB   GLU  88          1HB       GLU  88  -9.135  -1.663  11.923
  642   1HG   GLU  88          2HG       GLU  88 -10.429  -1.643  14.254
  643   2HG   GLU  88          1HG       GLU  88 -11.767  -1.216  13.188
  644    H    ASP  89           H        ASP  89  -7.889   0.800  15.197
  645    HA   ASP  89           HA       ASP  89  -5.542  -0.887  14.681
  646   1HB   ASP  89          2HB       ASP  89  -5.986   1.659  16.155
  647   2HB   ASP  89          1HB       ASP  89  -4.757   0.562  16.791
  648    H    ALA  90           H        ALA  90  -4.657  -2.172  16.380
  649    HA   ALA  90           HA       ALA  90  -6.424  -2.716  18.651
  650   1HB   ALA  90          1HB       ALA  90  -6.356  -5.110  18.279
  651   2HB   ALA  90          2HB       ALA  90  -5.382  -4.880  16.827
  652   3HB   ALA  90          3HB       ALA  90  -7.047  -4.300  16.874
  653   2H    ARG 115          HN2       ARG 115   2.806  -1.958   9.214
  654    H    ARG 115           H        ARG 115   2.189  -2.461  10.734
  655   3H    ARG 115          HN3       ARG 115   2.133  -3.526   9.393
  656    HA   ARG 115           HA       ARG 115   0.690  -1.946   8.257
  657   1HB   ARG 115          2HB       ARG 115  -1.281  -2.487   9.779
  658   2HB   ARG 115          1HB       ARG 115  -0.314  -3.852   9.238
  659   1HG   ARG 115          2HG       ARG 115   0.700  -4.107  11.340
  660   2HG   ARG 115          1HG       ARG 115   0.158  -2.518  11.883
  661   1HD   ARG 115          2HD       ARG 115  -1.846  -3.293  12.520
  662   2HD   ARG 115          1HD       ARG 115  -2.021  -4.290  11.077
  663    HE   ARG 115           HE       ARG 115  -0.184  -5.636  12.531
  664   1HH1  ARG 115          1HH1      ARG 115  -3.350  -4.373  13.278
  665   2HH1  ARG 115          2HH1      ARG 115  -3.700  -5.597  14.451
  666   1HH2  ARG 115          1HH2      ARG 115  -0.641  -7.247  14.075
  667   2HH2  ARG 115          2HH2      ARG 115  -2.161  -7.228  14.905
  668    H    MET 116           H        MET 116  -1.036  -0.322   8.719
  669    HA   MET 116           HA       MET 116  -1.696   1.752   9.367
  670   1HB   MET 116          2HB       MET 116  -1.954   0.803  11.580
  671   2HB   MET 116          1HB       MET 116  -0.239   0.999  11.906
  672   1HG   MET 116          2HG       MET 116  -1.227   3.537  11.185
  673   2HG   MET 116          1HG       MET 116  -2.378   2.839  12.322
  674   1HE   MET 116          1HE       MET 116   0.549   4.821  11.768
  675   2HE   MET 116          2HE       MET 116   1.215   5.089  13.379
  676   3HE   MET 116          3HE       MET 116  -0.444   5.571  13.019
  677    H    SER 117           H        SER 117   1.413   1.691  11.091
  678    HA   SER 117           HA       SER 117   2.170   4.171   9.802
  679   1HB   SER 117          2HB       SER 117   4.307   3.681  11.285
  680   2HB   SER 117          1HB       SER 117   2.813   4.273  12.011
  681    HG   SER 117           HG       SER 117   3.591   1.548  11.833
  682    H    ALA 118           H        ALA 118   2.015   2.517   7.789
  683    HA   ALA 118           HA       ALA 118   4.563   1.220   7.291
  684   1HB   ALA 118          1HB       ALA 118   1.900   1.010   6.244
  685   2HB   ALA 118          2HB       ALA 118   3.262  -0.093   6.061
  686   3HB   ALA 118          3HB       ALA 118   3.051   1.242   4.929
  687    H    ASP 119           H        ASP 119   3.714   4.324   7.325
  688    HA   ASP 119           HA       ASP 119   4.291   5.458   4.883
  689   1HB   ASP 119          2HB       ASP 119   3.565   6.587   7.074
  690   2HB   ASP 119          1HB       ASP 119   5.280   6.641   7.471
  691    H    ALA 120           H        ALA 120   6.434   3.928   7.144
  692    HA   ALA 120           HA       ALA 120   8.889   5.017   6.458
  693   1HB   ALA 120          1HB       ALA 120   8.798   3.520   8.289
  694   2HB   ALA 120          2HB       ALA 120   9.819   2.749   7.076
  695   3HB   ALA 120          3HB       ALA 120   8.151   2.220   7.288
  696    H    MET 121           H        MET 121   7.699   1.898   5.177
  697    HA   MET 121           HA       MET 121   9.519   1.699   3.086
  698   1HB   MET 121          2HB       MET 121   8.178  -0.203   3.710
  699   2HB   MET 121          1HB       MET 121   6.693   0.651   3.320
  700   1HG   MET 121          2HG       MET 121   8.063   0.739   0.946
  701   2HG   MET 121          1HG       MET 121   8.511  -0.837   1.597
  702   1HE   MET 121          1HE       MET 121   4.731   0.723   2.312
  703   2HE   MET 121          2HE       MET 121   4.326   0.679   0.594
  704   3HE   MET 121          3HE       MET 121   5.716   1.614   1.149
  705    H    LEU 122           H        LEU 122   6.503   3.443   3.328
  706    HA   LEU 122           HA       LEU 122   6.182   4.053   0.590
  707   1HB   LEU 122          2HB       LEU 122   5.133   5.176   3.150
  708   2HB   LEU 122          1HB       LEU 122   4.897   6.083   1.669
  709    HG   LEU 122           HG       LEU 122   3.867   3.925   0.726
  710   1HD1  LEU 122          1HD1      LEU 122   3.302   3.265   3.583
  711   2HD1  LEU 122          2HD1      LEU 122   4.761   2.650   2.809
  712   3HD1  LEU 122          3HD1      LEU 122   3.176   2.245   2.150
  713   1HD2  LEU 122          1HD2      LEU 122   2.429   5.729   1.062
  714   2HD2  LEU 122          2HD2      LEU 122   2.625   5.678   2.815
  715   3HD2  LEU 122          3HD2      LEU 122   1.697   4.424   1.994
  716    H    ARG 123           H        ARG 123   7.878   5.648   3.244
  717    HA   ARG 123           HA       ARG 123   8.731   7.820   1.499
  718   1HB   ARG 123          2HB       ARG 123   8.046   8.071   3.967
  719   2HB   ARG 123          1HB       ARG 123   9.623   7.390   4.341
  720   1HG   ARG 123          2HG       ARG 123  10.618   9.235   2.938
  721   2HG   ARG 123          1HG       ARG 123   9.013   9.965   2.922
  722   1HD   ARG 123          2HD       ARG 123  10.605  10.804   4.699
  723   2HD   ARG 123          1HD       ARG 123   9.021  10.274   5.261
  724    HE   ARG 123           HE       ARG 123  10.061   8.659   6.488
  725   1HH1  ARG 123          1HH1      ARG 123  12.251   9.712   3.986
  726   2HH1  ARG 123          2HH1      ARG 123  13.574   8.760   4.570
  727   1HH2  ARG 123          1HH2      ARG 123  11.799   7.406   7.259
  728   2HH2  ARG 123          2HH2      ARG 123  13.318   7.450   6.428
  729    H    ALA 124           H        ALA 124   9.647   4.818   1.515
  730    HA   ALA 124           HA       ALA 124  12.471   5.004   2.009
  731   1HB   ALA 124          1HB       ALA 124  10.880   2.933   2.152
  732   2HB   ALA 124          2HB       ALA 124  12.552   2.738   1.629
  733   3HB   ALA 124          3HB       ALA 124  11.253   2.780   0.435
  734    H    LEU 125           H        LEU 125  10.743   4.036  -0.948
  735    HA   LEU 125           HA       LEU 125  12.965   4.851  -2.583
  736   1HB   LEU 125          2HB       LEU 125  10.238   3.919  -3.464
  737   2HB   LEU 125          1HB       LEU 125  11.707   3.945  -4.422
  738    HG   LEU 125           HG       LEU 125  11.595   2.309  -1.919
  739   1HD1  LEU 125          1HD1      LEU 125  10.312   1.687  -4.547
  740   2HD1  LEU 125          2HD1      LEU 125   9.685   1.462  -2.915
  741   3HD1  LEU 125          3HD1      LEU 125  10.955   0.403  -3.524
  742   1HD2  LEU 125          1HD2      LEU 125  13.505   1.413  -2.669
  743   2HD2  LEU 125          2HD2      LEU 125  13.580   2.835  -3.709
  744   3HD2  LEU 125          3HD2      LEU 125  12.924   1.321  -4.333
  745    H    LEU 126           H        LEU 126  10.035   6.280  -1.482
  746    HA   LEU 126           HA       LEU 126   9.050   8.295  -1.858
  747   1HB   LEU 126          2HB       LEU 126  11.669   9.034  -3.161
  748   2HB   LEU 126          1HB       LEU 126  10.462  10.141  -2.537
  749    HG   LEU 126           HG       LEU 126  11.955   8.184  -0.795
  750   1HD1  LEU 126          1HD1      LEU 126  13.281  10.176  -0.093
  751   2HD1  LEU 126          2HD1      LEU 126  12.597  11.050  -1.463
  752   3HD1  LEU 126          3HD1      LEU 126  13.606   9.629  -1.738
  753   1HD2  LEU 126          1HD2      LEU 126  10.148  10.530  -0.282
  754   2HD2  LEU 126          2HD2      LEU 126  11.250   9.903   0.944
  755   3HD2  LEU 126          3HD2      LEU 126   9.983   8.868   0.286
  756    H    GLY 127           H        GLY 127   8.167   9.722  -3.529
  757   1HA   GLY 127          2HA       GLY 127   8.269   8.475  -6.207
  758   2HA   GLY 127          1HA       GLY 127   6.763   9.010  -5.479
  759    H    SER 128           H        SER 128   7.842   9.842  -8.003
  760    HA   SER 128           HA       SER 128   8.570  12.639  -7.483
  761   1HB   SER 128          2HB       SER 128   8.886  10.873  -9.908
  762   2HB   SER 128          1HB       SER 128   9.086  12.622  -9.991
  763    HG   SER 128           HG       SER 128  10.808  12.488  -8.613
  764    H    LYS 129           H        LYS 129   7.718  14.092  -9.420
  765    HA   LYS 129           HA       LYS 129   4.874  14.144  -9.123
  766   1HB   LYS 129          2HB       LYS 129   6.933  15.864 -10.404
  767   2HB   LYS 129          1HB       LYS 129   5.282  16.018 -10.991
  768   1HG   LYS 129          2HG       LYS 129   5.737  16.092  -8.058
  769   2HG   LYS 129          1HG       LYS 129   6.197  17.500  -9.017
  770   1HD   LYS 129          2HD       LYS 129   4.009  17.994  -8.454
  771   2HD   LYS 129          1HD       LYS 129   3.818  17.246 -10.041
  772   1HE   LYS 129          2HE       LYS 129   3.003  15.260  -9.144
  773   2HE   LYS 129          1HE       LYS 129   3.674  15.594  -7.548
  774   1HZ   LYS 129          1HZ       LYS 129   1.186  16.522  -8.749
  775   2HZ   LYS 129          2HZ       LYS 129   2.002  17.620  -7.756
  776   3HZ   LYS 129          3HZ       LYS 129   1.528  16.118  -7.142
  777    H    HIS 130           H        HIS 130   6.879  14.093 -12.076
  778    HA   HIS 130           HA       HIS 130   4.734  12.550 -13.380
  779   1HB   HIS 130          2HB       HIS 130   6.783  14.311 -14.735
  780   2HB   HIS 130          1HB       HIS 130   5.387  13.540 -15.482
  781    HD1  HIS 130           1HD      HIS 130   3.121  14.340 -13.694
  782    HD2  HIS 130           2HD      HIS 130   6.194  16.946 -14.706
  783    HE1  HIS 130           1HE      HIS 130   2.179  16.649 -13.368
  784    HE2  HIS 130           2HE      HIS 130   4.085  18.208 -13.902
  785    H    LYS 131           H        LYS 131   5.228  10.688 -14.442
  786    HA   LYS 131           HA       LYS 131   7.908   9.619 -13.986
  787   1HB   LYS 131          2HB       LYS 131   5.266   8.362 -14.695
  788   2HB   LYS 131          1HB       LYS 131   6.773   7.463 -14.805
  789   1HG   LYS 131          2HG       LYS 131   6.432   8.835 -12.255
  790   2HG   LYS 131          1HG       LYS 131   5.172   7.646 -12.592
  791   1HD   LYS 131          2HD       LYS 131   6.673   6.220 -11.683
  792   2HD   LYS 131          1HD       LYS 131   7.344   6.233 -13.315
  793   1HE   LYS 131          2HE       LYS 131   8.681   8.299 -12.415
  794   2HE   LYS 131          1HE       LYS 131   8.328   7.584 -10.843
  795   1HZ   LYS 131          1HZ       LYS 131  10.102   6.655 -12.946
  796   2HZ   LYS 131          2HZ       LYS 131   9.203   5.452 -12.167
  797   3HZ   LYS 131          3HZ       LYS 131  10.215   6.465 -11.267
  Start of MODEL    4
    1   2H    ALA   1          HN2       ALA   1 -25.899   1.705  -6.900
    2    H    ALA   1           H        ALA   1 -25.855   2.018  -8.587
    3   3H    ALA   1          HN3       ALA   1 -26.923   0.831  -7.964
    4    HA   ALA   1           HA       ALA   1 -25.282  -0.642  -7.530
    5   1HB   ALA   1          1HB       ALA   1 -24.548  -1.100  -9.615
    6   2HB   ALA   1          2HB       ALA   1 -23.883   0.516  -9.853
    7   3HB   ALA   1          3HB       ALA   1 -25.614   0.238 -10.047
    8    H    SER   2           H        SER   2 -23.258  -1.160  -6.774
    9    HA   SER   2           HA       SER   2 -21.038   0.598  -6.827
   10   1HB   SER   2          2HB       SER   2 -22.795   1.497  -5.016
   11   2HB   SER   2          1HB       SER   2 -21.965   0.305  -4.016
   12    HG   SER   2           HG       SER   2 -20.299   1.576  -3.931
   13    H    MET   3           H        MET   3 -19.162  -0.309  -5.851
   14    HA   MET   3           HA       MET   3 -19.477  -3.107  -4.983
   15   1HB   MET   3          2HB       MET   3 -17.248  -2.029  -6.717
   16   2HB   MET   3          1HB       MET   3 -17.454  -3.697  -6.199
   17   1HG   MET   3          2HG       MET   3 -19.096  -4.114  -7.707
   18   2HG   MET   3          1HG       MET   3 -19.686  -2.453  -7.694
   19   1HE   MET   3          1HE       MET   3 -19.277  -0.825  -8.948
   20   2HE   MET   3          2HE       MET   3 -19.211  -1.330 -10.636
   21   3HE   MET   3          3HE       MET   3 -17.852  -0.463  -9.921
   22    H    THR   4           H        THR   4 -17.222  -0.353  -5.049
   23    HA   THR   4           HA       THR   4 -16.801  -0.324  -2.278
   24    HB   THR   4           HB       THR   4 -15.655  -2.463  -2.694
   25    HG1  THR   4           1HG      THR   4 -13.769  -0.432  -2.123
   26   1HG2  THR   4          1HG2      THR   4 -14.206  -2.845  -4.324
   27   2HG2  THR   4          2HG2      THR   4 -13.299  -1.376  -3.963
   28   3HG2  THR   4          3HG2      THR   4 -14.714  -1.304  -5.014
   29    H    ASP   5           H        ASP   5 -16.603   1.817  -2.135
   30    HA   ASP   5           HA       ASP   5 -14.840   3.200  -4.037
   31   1HB   ASP   5          2HB       ASP   5 -17.056   4.293  -2.293
   32   2HB   ASP   5          1HB       ASP   5 -16.041   5.260  -3.367
   33    H    GLN   6           H        GLN   6 -14.626   1.906  -1.055
   34    HA   GLN   6           HA       GLN   6 -13.669   3.861   0.647
   35   1HB   GLN   6          2HB       GLN   6 -12.354   2.043   1.722
   36   2HB   GLN   6          1HB       GLN   6 -14.033   1.614   1.431
   37   1HG   GLN   6          2HG       GLN   6 -13.503   0.121  -0.244
   38   2HG   GLN   6          1HG       GLN   6 -11.942   0.873  -0.565
   39   1HE2  GLN   6          1HE2      GLN   6 -10.925  -1.146  -0.426
   40   2HE2  GLN   6          2HE2      GLN   6 -10.636  -1.911   1.096
   41    H    GLN   7           H        GLN   7 -12.194   2.498  -2.169
   42    HA   GLN   7           HA       GLN   7  -9.497   3.121  -1.655
   43   1HB   GLN   7          2HB       GLN   7  -9.435   3.303  -4.262
   44   2HB   GLN   7          1HB       GLN   7  -9.702   1.741  -3.496
   45   1HG   GLN   7          2HG       GLN   7 -11.870   1.623  -4.198
   46   2HG   GLN   7          1HG       GLN   7 -12.078   3.375  -4.207
   47   1HE2  GLN   7          1HE2      GLN   7  -9.584   1.406  -5.744
   48   2HE2  GLN   7          2HE2      GLN   7  -9.956   1.881  -7.364
   49    H    ALA   8           H        ALA   8 -12.174   5.012  -2.831
   50    HA   ALA   8           HA       ALA   8 -10.608   7.204  -3.734
   51   1HB   ALA   8          1HB       ALA   8 -13.166   8.174  -3.175
   52   2HB   ALA   8          2HB       ALA   8 -13.400   6.489  -3.643
   53   3HB   ALA   8          3HB       ALA   8 -12.560   7.598  -4.728
   54    H    GLU   9           H        GLU   9 -12.640   6.693  -0.846
   55    HA   GLU   9           HA       GLU   9 -12.109   9.123   0.420
   56   1HB   GLU   9          2HB       GLU   9 -12.473   6.524   1.903
   57   2HB   GLU   9          1HB       GLU   9 -12.956   8.138   2.406
   58   1HG   GLU   9          2HG       GLU   9 -14.277   7.638  -0.023
   59   2HG   GLU   9          1HG       GLU   9 -14.435   6.171   0.950
   60    H    ALA  10           H        ALA  10 -10.313   6.129   0.301
   61    HA   ALA  10           HA       ALA  10  -8.469   6.362   2.298
   62   1HB   ALA  10          1HB       ALA  10  -8.171   4.428   1.158
   63   2HB   ALA  10          2HB       ALA  10  -6.904   5.369   0.371
   64   3HB   ALA  10          3HB       ALA  10  -8.476   5.176  -0.410
   65    H    ARG  11           H        ARG  11  -7.999   7.591  -1.021
   66    HA   ARG  11           HA       ARG  11  -5.603   8.910  -0.628
   67   1HB   ARG  11          2HB       ARG  11  -7.719   8.917  -2.613
   68   2HB   ARG  11          1HB       ARG  11  -7.020  10.519  -2.425
   69   1HG   ARG  11          2HG       ARG  11  -4.761   9.441  -2.715
   70   2HG   ARG  11          1HG       ARG  11  -5.619   7.972  -3.180
   71   1HD   ARG  11          2HD       ARG  11  -4.915   9.331  -5.119
   72   2HD   ARG  11          1HD       ARG  11  -6.663   9.112  -5.031
   73    HE   ARG  11           HE       ARG  11  -5.836  11.521  -3.756
   74   1HH1  ARG  11          1HH1      ARG  11  -6.461  10.091  -6.878
   75   2HH1  ARG  11          2HH1      ARG  11  -6.835  11.603  -7.635
   76   1HH2  ARG  11          1HH2      ARG  11  -6.328  13.510  -4.751
   77   2HH2  ARG  11          2HH2      ARG  11  -6.760  13.544  -6.427
   78    H    ALA  12           H        ALA  12  -8.801   9.827   0.357
   79    HA   ALA  12           HA       ALA  12  -7.955  12.538   1.030
   80   1HB   ALA  12          1HB       ALA  12 -10.317  12.892   1.627
   81   2HB   ALA  12          2HB       ALA  12 -10.649  11.202   1.247
   82   3HB   ALA  12          3HB       ALA  12 -10.121  12.305  -0.024
   83    H    PHE  13           H        PHE  13  -8.333   9.453   2.500
   84    HA   PHE  13           HA       PHE  13  -8.806  10.359   5.165
   85   1HB   PHE  13          2HB       PHE  13  -8.695   7.870   3.824
   86   2HB   PHE  13          1HB       PHE  13  -7.499   7.800   5.120
   87    HD1  PHE  13           1HD      PHE  13  -8.602   9.195   7.313
   88    HD2  PHE  13           2HD      PHE  13 -10.619   6.796   4.436
   89    HE1  PHE  13           1HE      PHE  13 -10.393   8.755   8.942
   90    HE2  PHE  13           2HE      PHE  13 -12.414   6.351   6.059
   91    HZ   PHE  13           HZ       PHE  13 -12.302   7.332   8.315
   92    H    LEU  14           H        LEU  14  -5.989   9.972   3.187
   93    HA   LEU  14           HA       LEU  14  -4.271  10.482   5.525
   94   1HB   LEU  14          2HB       LEU  14  -3.289   9.512   2.856
   95   2HB   LEU  14          1HB       LEU  14  -2.485   9.425   4.418
   96    HG   LEU  14           HG       LEU  14  -5.013   7.893   3.862
   97   1HD1  LEU  14          1HD1      LEU  14  -2.174   7.042   3.326
   98   2HD1  LEU  14          2HD1      LEU  14  -3.476   7.204   2.149
   99   3HD1  LEU  14          3HD1      LEU  14  -3.555   5.948   3.384
  100   1HD2  LEU  14          1HD2      LEU  14  -2.757   7.538   5.832
  101   2HD2  LEU  14          2HD2      LEU  14  -4.150   6.469   5.665
  102   3HD2  LEU  14          3HD2      LEU  14  -4.377   8.137   6.192
  103    H    SER  15           H        SER  15  -2.303  11.803   5.030
  104    HA   SER  15           HA       SER  15  -3.124  14.240   3.706
  105   1HB   SER  15          2HB       SER  15  -0.345  13.980   4.725
  106   2HB   SER  15          1HB       SER  15  -1.520  15.282   4.957
  107    HG   SER  15           HG       SER  15  -1.856  14.434   6.838
  108    H    GLU  16           H        GLU  16  -1.690  15.360   2.168
  109    HA   GLU  16           HA       GLU  16  -1.160  13.906  -0.116
  110   1HB   GLU  16          2HB       GLU  16  -0.288  16.561   0.907
  111   2HB   GLU  16          1HB       GLU  16   0.590  15.903  -0.466
  112   1HG   GLU  16          2HG       GLU  16  -1.416  15.775  -1.767
  113   2HG   GLU  16          1HG       GLU  16  -2.397  16.234  -0.376
  114    H    GLU  17           H        GLU  17   0.777  14.337   2.723
  115    HA   GLU  17           HA       GLU  17   3.299  13.606   1.746
  116   1HB   GLU  17          2HB       GLU  17   1.963  13.733   4.388
  117   2HB   GLU  17          1HB       GLU  17   3.373  12.684   4.288
  118   1HG   GLU  17          2HG       GLU  17   4.682  14.584   3.413
  119   2HG   GLU  17          1HG       GLU  17   3.270  15.619   3.626
  120    H    MET  18           H        MET  18   0.840  11.618   3.390
  121    HA   MET  18           HA       MET  18   2.162   9.165   3.099
  122   1HB   MET  18          2HB       MET  18  -0.054   9.965   4.413
  123   2HB   MET  18          1HB       MET  18  -0.800   9.139   3.047
  124   1HG   MET  18          2HG       MET  18  -0.642   7.473   4.631
  125   2HG   MET  18          1HG       MET  18   0.790   7.201   3.640
  126   1HE   MET  18          1HE       MET  18  -0.259   6.869   7.134
  127   2HE   MET  18          2HE       MET  18   1.387   6.491   7.643
  128   3HE   MET  18          3HE       MET  18   0.720   5.746   6.189
  129    H    ILE  19           H        ILE  19   0.494  11.080   0.791
  130    HA   ILE  19           HA       ILE  19  -0.139   8.891  -0.987
  131    HB   ILE  19           HB       ILE  19  -0.333  11.886  -1.250
  132   1HG1  ILE  19          2HG1      ILE  19  -2.423   9.697  -1.334
  133   2HG1  ILE  19          1HG1      ILE  19  -2.049  10.689   0.078
  134   1HG2  ILE  19          1HG2      ILE  19   0.014  11.589  -3.454
  135   2HG2  ILE  19          2HG2      ILE  19  -1.648  10.991  -3.442
  136   3HG2  ILE  19          3HG2      ILE  19  -0.299   9.854  -3.376
  137   1HD1  ILE  19          1HD1      ILE  19  -2.555  12.513  -1.953
  138   2HD1  ILE  19          2HD1      ILE  19  -3.623  12.078  -0.620
  139   3HD1  ILE  19          3HD1      ILE  19  -3.763  11.247  -2.169
  140    H    ALA  20           H        ALA  20   1.898  11.795  -1.364
  141    HA   ALA  20           HA       ALA  20   3.275  11.072  -3.623
  142   1HB   ALA  20          1HB       ALA  20   4.341  12.604  -1.255
  143   2HB   ALA  20          2HB       ALA  20   3.432  13.273  -2.610
  144   3HB   ALA  20          3HB       ALA  20   5.040  12.599  -2.876
  145    H    GLU  21           H        GLU  21   3.639   9.834  -0.410
  146    HA   GLU  21           HA       GLU  21   6.172   8.546  -0.966
  147   1HB   GLU  21          2HB       GLU  21   4.334   8.493   1.433
  148   2HB   GLU  21          1HB       GLU  21   5.838   7.591   1.340
  149   1HG   GLU  21          2HG       GLU  21   7.131   9.439   1.580
  150   2HG   GLU  21          1HG       GLU  21   5.961  10.496   0.790
  151    H    PHE  22           H        PHE  22   2.761   7.788  -0.801
  152    HA   PHE  22           HA       PHE  22   2.920   4.987  -0.769
  153   1HB   PHE  22          2HB       PHE  22   0.683   5.184  -0.735
  154   2HB   PHE  22          1HB       PHE  22   0.883   6.921  -0.918
  155    HD1  PHE  22           1HD      PHE  22  -0.014   7.996  -2.758
  156    HD2  PHE  22           2HD      PHE  22   0.618   3.791  -2.913
  157    HE1  PHE  22           1HE      PHE  22  -1.182   7.904  -4.920
  158    HE2  PHE  22           2HE      PHE  22  -0.550   3.692  -5.076
  159    HZ   PHE  22           HZ       PHE  22  -1.452   5.750  -6.083
  160    H    LYS  23           H        LYS  23   3.220   7.341  -3.325
  161    HA   LYS  23           HA       LYS  23   3.124   5.464  -5.478
  162   1HB   LYS  23          2HB       LYS  23   2.659   7.998  -5.545
  163   2HB   LYS  23          1HB       LYS  23   4.412   8.181  -5.605
  164   1HG   LYS  23          2HG       LYS  23   4.052   8.140  -7.824
  165   2HG   LYS  23          1HG       LYS  23   4.079   6.393  -7.577
  166   1HD   LYS  23          2HD       LYS  23   1.830   6.177  -7.868
  167   2HD   LYS  23          1HD       LYS  23   1.484   7.785  -7.215
  168   1HE   LYS  23          2HE       LYS  23   0.994   7.694  -9.598
  169   2HE   LYS  23          1HE       LYS  23   2.327   8.800  -9.274
  170   1HZ   LYS  23          1HZ       LYS  23   3.015   7.565 -11.106
  171   2HZ   LYS  23          2HZ       LYS  23   2.430   6.106 -10.483
  172   3HZ   LYS  23          3HZ       LYS  23   3.808   6.819  -9.811
  173    H    ALA  24           H        ALA  24   5.478   6.346  -3.187
  174    HA   ALA  24           HA       ALA  24   7.903   6.275  -4.410
  175   1HB   ALA  24          1HB       ALA  24   7.141   4.908  -1.833
  176   2HB   ALA  24          2HB       ALA  24   7.680   6.576  -2.029
  177   3HB   ALA  24          3HB       ALA  24   8.793   5.246  -2.349
  178    H    ALA  25           H        ALA  25   6.807   3.284  -2.850
  179    HA   ALA  25           HA       ALA  25   8.418   1.689  -4.594
  180   1HB   ALA  25          1HB       ALA  25   8.118   1.120  -2.240
  181   2HB   ALA  25          2HB       ALA  25   7.597  -0.198  -3.292
  182   3HB   ALA  25          3HB       ALA  25   6.400   0.844  -2.523
  183    H    PHE  26           H        PHE  26   5.487   3.087  -5.161
  184    HA   PHE  26           HA       PHE  26   3.805   1.149  -6.154
  185   1HB   PHE  26          2HB       PHE  26   3.732   3.836  -6.103
  186   2HB   PHE  26          1HB       PHE  26   4.071   3.590  -7.812
  187    HD1  PHE  26           1HD      PHE  26   2.105   4.069  -8.926
  188    HD2  PHE  26           2HD      PHE  26   1.981   1.597  -5.464
  189    HE1  PHE  26           1HE      PHE  26  -0.281   3.625  -9.334
  190    HE2  PHE  26           2HE      PHE  26  -0.404   1.148  -5.865
  191    HZ   PHE  26           HZ       PHE  26  -1.539   2.162  -7.802
  192    H    ASP  27           H        ASP  27   6.775   2.344  -7.532
  193    HA   ASP  27           HA       ASP  27   6.313   1.173 -10.124
  194   1HB   ASP  27          2HB       ASP  27   7.917   3.183  -9.287
  195   2HB   ASP  27          1HB       ASP  27   9.078   1.859  -9.319
  196    H    MET  28           H        MET  28   8.787   0.559  -7.620
  197    HA   MET  28           HA       MET  28   9.712  -1.848  -8.675
  198   1HB   MET  28          2HB       MET  28   9.863  -0.486  -6.053
  199   2HB   MET  28          1HB       MET  28  10.172  -2.216  -6.038
  200   1HG   MET  28          2HG       MET  28  12.158  -2.000  -7.039
  201   2HG   MET  28          1HG       MET  28  11.573  -0.764  -8.158
  202   1HE   MET  28          1HE       MET  28  11.313   1.959  -7.286
  203   2HE   MET  28          2HE       MET  28  12.618   1.285  -8.262
  204   3HE   MET  28          3HE       MET  28  12.989   2.375  -6.926
  205    H    PHE  29           H        PHE  29   6.872  -1.156  -6.805
  206    HA   PHE  29           HA       PHE  29   6.291  -3.646  -5.714
  207   1HB   PHE  29          2HB       PHE  29   4.729  -1.252  -6.490
  208   2HB   PHE  29          1HB       PHE  29   3.811  -2.750  -6.328
  209    HD1  PHE  29           1HD      PHE  29   4.997  -4.103  -4.099
  210    HD2  PHE  29           2HD      PHE  29   4.336   0.062  -4.657
  211    HE1  PHE  29           1HE      PHE  29   4.920  -3.787  -1.660
  212    HE2  PHE  29           2HE      PHE  29   4.260   0.384  -2.221
  213    HZ   PHE  29           HZ       PHE  29   4.552  -1.545  -0.718
  214    H    ASP  30           H        ASP  30   4.721  -2.358  -8.640
  215    HA   ASP  30           HA       ASP  30   3.744  -4.812  -9.537
  216   1HB   ASP  30          2HB       ASP  30   4.295  -2.198 -10.924
  217   2HB   ASP  30          1HB       ASP  30   3.667  -3.592 -11.810
  218    H    ALA  31           H        ALA  31   4.764  -6.519 -10.279
  219    HA   ALA  31           HA       ALA  31   7.526  -6.316 -11.166
  220   1HB   ALA  31          1HB       ALA  31   6.837  -8.087  -9.586
  221   2HB   ALA  31          2HB       ALA  31   7.554  -8.729 -11.063
  222   3HB   ALA  31          3HB       ALA  31   5.806  -8.772 -10.842
  223    H    ASP  32           H        ASP  32   4.458  -7.614 -12.418
  224    HA   ASP  32           HA       ASP  32   5.589  -7.876 -15.079
  225   1HB   ASP  32          2HB       ASP  32   3.363  -8.802 -15.668
  226   2HB   ASP  32          1HB       ASP  32   4.109  -9.641 -14.305
  227    H    GLY  33           H        GLY  33   3.532  -5.720 -13.283
  228   1HA   GLY  33          2HA       GLY  33   2.963  -3.535 -13.831
  229   2HA   GLY  33          1HA       GLY  33   3.654  -3.784 -15.426
  230    H    GLY  34           H        GLY  34   1.153  -5.735 -13.864
  231   1HA   GLY  34          2HA       GLY  34  -1.091  -4.543 -15.029
  232   2HA   GLY  34          1HA       GLY  34  -0.492  -5.755 -16.160
  233    H    GLY  35           H        GLY  35  -0.404  -5.934 -12.630
  234   1HA   GLY  35          2HA       GLY  35  -2.655  -7.764 -12.563
  235   2HA   GLY  35          1HA       GLY  35  -1.086  -8.507 -12.251
  236    H    ASP  36           H        ASP  36  -1.672  -5.230 -11.263
  237    HA   ASP  36           HA       ASP  36  -1.706  -4.239  -9.215
  238   1HB   ASP  36          2HB       ASP  36  -3.362  -6.699  -8.650
  239   2HB   ASP  36          1HB       ASP  36  -3.138  -5.403  -7.470
  240    H    ILE  37           H        ILE  37  -1.427  -4.910  -6.684
  241    HA   ILE  37           HA       ILE  37   1.175  -6.243  -6.617
  242    HB   ILE  37           HB       ILE  37  -0.199  -4.428  -4.639
  243   1HG1  ILE  37          2HG1      ILE  37   2.306  -4.063  -6.293
  244   2HG1  ILE  37          1HG1      ILE  37   0.731  -3.351  -6.658
  245   1HG2  ILE  37          1HG2      ILE  37   2.479  -5.785  -4.413
  246   2HG2  ILE  37          2HG2      ILE  37   1.066  -6.057  -3.394
  247   3HG2  ILE  37          3HG2      ILE  37   1.898  -4.503  -3.351
  248   1HD1  ILE  37          1HD1      ILE  37   2.271  -1.770  -5.591
  249   2HD1  ILE  37          2HD1      ILE  37   2.339  -2.816  -4.173
  250   3HD1  ILE  37          3HD1      ILE  37   0.819  -2.048  -4.632
  251    H    SER  38           H        SER  38   1.416  -8.206  -5.784
  252    HA   SER  38           HA       SER  38  -0.814  -9.377  -4.277
  253   1HB   SER  38          2HB       SER  38   1.385 -11.147  -5.141
  254   2HB   SER  38          1HB       SER  38  -0.365 -11.366  -5.274
  255    HG   SER  38           HG       SER  38   1.320 -10.665  -7.175
  256    H    THR  39           H        THR  39   0.553 -11.481  -3.064
  257    HA   THR  39           HA       THR  39   1.561 -10.190  -0.740
  258    HB   THR  39           HB       THR  39   2.027 -12.515   0.042
  259    HG1  THR  39           1HG      THR  39   1.331 -14.208  -1.343
  260   1HG2  THR  39          1HG2      THR  39  -0.363 -13.390  -0.281
  261   2HG2  THR  39          2HG2      THR  39  -0.659 -11.846  -1.080
  262   3HG2  THR  39          3HG2      THR  39  -0.126 -11.882   0.601
  263    H    LYS  40           H        LYS  40   3.055 -11.872  -3.450
  264    HA   LYS  40           HA       LYS  40   5.683 -11.881  -2.333
  265   1HB   LYS  40          2HB       LYS  40   4.719 -13.392  -4.188
  266   2HB   LYS  40          1HB       LYS  40   5.073 -12.049  -5.274
  267   1HG   LYS  40          2HG       LYS  40   7.425 -12.155  -4.667
  268   2HG   LYS  40          1HG       LYS  40   7.083 -13.473  -3.536
  269   1HD   LYS  40          2HD       LYS  40   6.935 -15.010  -5.180
  270   2HD   LYS  40          1HD       LYS  40   6.121 -13.900  -6.284
  271   1HE   LYS  40          2HE       LYS  40   9.066 -13.831  -5.640
  272   2HE   LYS  40          1HE       LYS  40   8.370 -14.609  -7.062
  273   1HZ   LYS  40          1HZ       LYS  40   9.095 -12.467  -7.709
  274   2HZ   LYS  40          2HZ       LYS  40   8.340 -11.721  -6.393
  275   3HZ   LYS  40          3HZ       LYS  40   7.406 -12.392  -7.632
  276    H    GLU  41           H        GLU  41   3.888  -9.725  -4.451
  277    HA   GLU  41           HA       GLU  41   6.039  -8.121  -5.298
  278   1HB   GLU  41          2HB       GLU  41   3.093  -7.552  -5.003
  279   2HB   GLU  41          1HB       GLU  41   4.221  -6.383  -5.674
  280   1HG   GLU  41          2HG       GLU  41   4.792  -8.605  -7.140
  281   2HG   GLU  41          1HG       GLU  41   3.060  -8.786  -6.867
  282    H    LEU  42           H        LEU  42   4.320  -8.268  -2.298
  283    HA   LEU  42           HA       LEU  42   5.073  -5.638  -1.425
  284   1HB   LEU  42          2HB       LEU  42   3.320  -7.698  -0.538
  285   2HB   LEU  42          1HB       LEU  42   4.408  -7.303   0.786
  286    HG   LEU  42           HG       LEU  42   2.395  -5.981   0.964
  287   1HD1  LEU  42          1HD1      LEU  42   4.894  -4.520   0.186
  288   2HD1  LEU  42          2HD1      LEU  42   4.223  -4.799   1.793
  289   3HD1  LEU  42          3HD1      LEU  42   3.445  -3.655   0.700
  290   1HD2  LEU  42          1HD2      LEU  42   2.079  -4.200  -0.898
  291   2HD2  LEU  42          2HD2      LEU  42   1.463  -5.833  -1.145
  292   3HD2  LEU  42          3HD2      LEU  42   2.981  -5.340  -1.896
  293    H    GLY  43           H        GLY  43   5.992  -8.919  -0.354
  294   1HA   GLY  43          2HA       GLY  43   7.951  -8.274   1.461
  295   2HA   GLY  43          1HA       GLY  43   7.994  -9.718   0.453
  296    H    THR  44           H        THR  44   8.138  -8.051  -2.011
  297    HA   THR  44           HA       THR  44  10.907  -8.044  -2.355
  298    HB   THR  44           HB       THR  44   8.584  -6.945  -3.876
  299    HG1  THR  44           1HG      THR  44  10.656  -8.803  -4.347
  300   1HG2  THR  44          1HG2      THR  44  10.359  -6.387  -5.700
  301   2HG2  THR  44          2HG2      THR  44  11.406  -6.096  -4.311
  302   3HG2  THR  44          3HG2      THR  44   9.909  -5.180  -4.494
  303    H    VAL  45           H        VAL  45   9.014  -5.083  -2.712
  304    HA   VAL  45           HA       VAL  45  11.139  -3.352  -2.170
  305    HB   VAL  45           HB       VAL  45   9.184  -2.641  -3.411
  306   1HG1  VAL  45          1HG1      VAL  45   7.770  -3.307  -0.867
  307   2HG1  VAL  45          2HG1      VAL  45   7.348  -3.711  -2.532
  308   3HG1  VAL  45          3HG1      VAL  45   7.112  -2.066  -1.937
  309   1HG2  VAL  45          1HG2      VAL  45   8.761  -0.778  -1.244
  310   2HG2  VAL  45          2HG2      VAL  45   9.545  -0.532  -2.805
  311   3HG2  VAL  45          3HG2      VAL  45  10.474  -1.153  -1.439
  312    H    MET  46           H        MET  46   8.866  -4.905  -0.019
  313    HA   MET  46           HA       MET  46   9.343  -3.159   2.189
  314   1HB   MET  46          2HB       MET  46   7.935  -5.767   1.808
  315   2HB   MET  46          1HB       MET  46   8.310  -5.228   3.447
  316   1HG   MET  46          2HG       MET  46   7.224  -2.982   2.405
  317   2HG   MET  46          1HG       MET  46   6.333  -4.224   1.520
  318   1HE   MET  46          1HE       MET  46   4.789  -2.304   4.693
  319   2HE   MET  46          2HE       MET  46   6.309  -1.932   3.878
  320   3HE   MET  46          3HE       MET  46   6.324  -2.626   5.500
  321    H    ARG  47           H        ARG  47  10.799  -6.142   1.046
  322    HA   ARG  47           HA       ARG  47  12.326  -6.514   3.473
  323   1HB   ARG  47          2HB       ARG  47  12.313  -7.928   0.812
  324   2HB   ARG  47          1HB       ARG  47  13.465  -8.317   2.080
  325   1HG   ARG  47          2HG       ARG  47  11.733  -9.024   3.549
  326   2HG   ARG  47          1HG       ARG  47  10.484  -8.410   2.465
  327   1HD   ARG  47          2HD       ARG  47  11.415 -10.038   0.739
  328   2HD   ARG  47          1HD       ARG  47  12.303 -10.773   2.080
  329    HE   ARG  47           HE       ARG  47   9.745 -10.709   2.973
  330   1HH1  ARG  47          1HH1      ARG  47  11.243 -11.939   0.072
  331   2HH1  ARG  47          2HH1      ARG  47  10.083 -13.207  -0.140
  332   1HH2  ARG  47          1HH2      ARG  47   8.218 -12.376   2.698
  333   2HH2  ARG  47          2HH2      ARG  47   8.365 -13.455   1.351
  334    H    MET  48           H        MET  48  12.776  -5.015   0.361
  335    HA   MET  48           HA       MET  48  15.645  -4.734   0.796
  336   1HB   MET  48          2HB       MET  48  15.708  -3.774  -1.444
  337   2HB   MET  48          1HB       MET  48  14.857  -5.318  -1.451
  338   1HG   MET  48          2HG       MET  48  13.014  -4.391  -2.254
  339   2HG   MET  48          1HG       MET  48  13.033  -3.125  -1.028
  340   1HE   MET  48          1HE       MET  48  11.856  -1.783  -3.534
  341   2HE   MET  48          2HE       MET  48  12.936  -0.387  -3.478
  342   3HE   MET  48          3HE       MET  48  12.390  -1.142  -1.981
  343    H    LEU  49           H        LEU  49  13.203  -3.234   2.149
  344    HA   LEU  49           HA       LEU  49  14.409  -0.560   1.888
  345   1HB   LEU  49          2HB       LEU  49  11.556  -1.414   2.190
  346   2HB   LEU  49          1HB       LEU  49  12.062   0.161   2.769
  347    HG   LEU  49           HG       LEU  49  12.210  -0.850  -0.068
  348   1HD1  LEU  49          1HD1      LEU  49  10.748   1.279  -0.323
  349   2HD1  LEU  49          2HD1      LEU  49  10.445   1.061   1.400
  350   3HD1  LEU  49          3HD1      LEU  49  10.017  -0.213   0.261
  351   1HD2  LEU  49          1HD2      LEU  49  13.669   1.276   1.285
  352   2HD2  LEU  49          2HD2      LEU  49  12.759   1.843  -0.114
  353   3HD2  LEU  49          3HD2      LEU  49  13.937   0.545  -0.297
  354    H    GLY  50           H        GLY  50  12.915  -2.887   4.095
  355   1HA   GLY  50          2HA       GLY  50  14.609  -2.580   6.209
  356   2HA   GLY  50          1HA       GLY  50  13.443  -1.277   6.426
  357    H    GLN  51           H        GLN  51  11.153  -2.645   5.451
  358    HA   GLN  51           HA       GLN  51  10.370  -4.007   7.811
  359   1HB   GLN  51          2HB       GLN  51   8.947  -4.079   5.147
  360   2HB   GLN  51          1HB       GLN  51   8.245  -4.313   6.748
  361   1HG   GLN  51          2HG       GLN  51   9.604  -1.746   6.386
  362   2HG   GLN  51          1HG       GLN  51   8.203  -1.989   5.343
  363   1HE2  GLN  51          1HE2      GLN  51   7.720  -0.045   6.862
  364   2HE2  GLN  51          2HE2      GLN  51   6.793  -0.436   8.267
  365    H    ASN  52           H        ASN  52   9.600  -6.214   7.968
  366    HA   ASN  52           HA       ASN  52  10.644  -8.073   5.977
  367   1HB   ASN  52          2HB       ASN  52  12.165  -7.519   8.172
  368   2HB   ASN  52          1HB       ASN  52  11.225  -8.900   8.743
  369   1HD2  ASN  52          1HD2      ASN  52  14.057  -8.748   8.230
  370   2HD2  ASN  52          2HD2      ASN  52  14.407  -9.932   7.021
  371    HA   PRO  53           HA       PRO  53   6.583  -9.234   8.155
  372   1HB   PRO  53          2HB       PRO  53   4.858  -8.707   6.138
  373   2HB   PRO  53          1HB       PRO  53   5.312  -7.495   7.340
  374   1HG   PRO  53          2HG       PRO  53   6.339  -7.881   4.557
  375   2HG   PRO  53          1HG       PRO  53   5.905  -6.381   5.393
  376   1HD   PRO  53          2HD       PRO  53   8.472  -7.225   5.119
  377   2HD   PRO  53          1HD       PRO  53   7.912  -6.270   6.512
  378    H    THR  54           H        THR  54   6.610 -11.394   8.121
  379    HA   THR  54           HA       THR  54   7.471 -12.999   6.006
  380    HB   THR  54           HB       THR  54   6.386 -14.868   7.253
  381    HG1  THR  54           1HG      THR  54   5.540 -12.823   9.022
  382   1HG2  THR  54          1HG2      THR  54   8.489 -14.569   8.098
  383   2HG2  THR  54          2HG2      THR  54   7.504 -14.296   9.537
  384   3HG2  THR  54          3HG2      THR  54   8.157 -12.924   8.641
  385    H    LYS  55           H        LYS  55   5.879 -14.895   5.260
  386    HA   LYS  55           HA       LYS  55   4.185 -13.784   3.337
  387   1HB   LYS  55          2HB       LYS  55   5.258 -16.191   3.603
  388   2HB   LYS  55          1HB       LYS  55   3.686 -16.562   4.311
  389   1HG   LYS  55          2HG       LYS  55   3.174 -15.147   1.937
  390   2HG   LYS  55          1HG       LYS  55   4.428 -16.329   1.558
  391   1HD   LYS  55          2HD       LYS  55   3.071 -18.123   2.032
  392   2HD   LYS  55          1HD       LYS  55   2.071 -17.203   3.158
  393   1HE   LYS  55          2HE       LYS  55   0.571 -17.084   1.512
  394   2HE   LYS  55          1HE       LYS  55   1.659 -15.924   0.751
  395   1HZ   LYS  55          1HZ       LYS  55   0.831 -18.145  -0.437
  396   2HZ   LYS  55          2HZ       LYS  55   2.250 -18.730   0.276
  397   3HZ   LYS  55          3HZ       LYS  55   2.317 -17.413  -0.784
  398    H    CYS  56           H        CYS  56   3.380 -15.372   6.417
  399    HA   CYS  56           HA       CYS  56   0.590 -15.074   6.196
  400   1HB   CYS  56          2HB       CYS  56   2.093 -16.469   7.866
  401   2HB   CYS  56          1HB       CYS  56   1.909 -15.035   8.879
  402    HG   CYS  56           HG       CYS  56  -0.046 -16.483   9.552
  403    H    GLU  57           H        GLU  57   3.110 -12.922   7.291
  404    HA   GLU  57           HA       GLU  57   1.561 -11.070   8.710
  405   1HB   GLU  57          2HB       GLU  57   4.240 -11.308   7.907
  406   2HB   GLU  57          1HB       GLU  57   3.684  -9.778   7.229
  407   1HG   GLU  57          2HG       GLU  57   2.771  -9.993   9.924
  408   2HG   GLU  57          1HG       GLU  57   4.499 -10.335   9.868
  409    H    LEU  58           H        LEU  58   2.806 -10.692   5.386
  410    HA   LEU  58           HA       LEU  58   1.138  -8.515   4.751
  411   1HB   LEU  58          2HB       LEU  58   2.307 -10.485   2.787
  412   2HB   LEU  58          1HB       LEU  58   1.855  -8.812   2.482
  413    HG   LEU  58           HG       LEU  58   3.954  -9.355   4.531
  414   1HD1  LEU  58          1HD1      LEU  58   4.945 -10.682   2.939
  415   2HD1  LEU  58          2HD1      LEU  58   5.572  -9.093   2.497
  416   3HD1  LEU  58          3HD1      LEU  58   4.228  -9.794   1.595
  417   1HD2  LEU  58          1HD2      LEU  58   3.526  -7.103   4.404
  418   2HD2  LEU  58          2HD2      LEU  58   3.163  -7.156   2.680
  419   3HD2  LEU  58          3HD2      LEU  58   4.835  -7.257   3.232
  420    H    ASP  59           H        ASP  59   0.668 -11.969   4.587
  421    HA   ASP  59           HA       ASP  59  -1.574 -11.998   2.870
  422   1HB   ASP  59          2HB       ASP  59  -0.340 -13.891   4.804
  423   2HB   ASP  59          1HB       ASP  59  -2.018 -14.189   4.344
  424    H    ALA  60           H        ALA  60  -1.192 -11.277   6.245
  425    HA   ALA  60           HA       ALA  60  -3.957 -11.564   6.900
  426   1HB   ALA  60          1HB       ALA  60  -2.805 -11.714   8.841
  427   2HB   ALA  60          2HB       ALA  60  -3.042  -9.966   8.861
  428   3HB   ALA  60          3HB       ALA  60  -1.519 -10.643   8.285
  429    H    ILE  61           H        ILE  61  -1.922  -9.012   5.679
  430    HA   ILE  61           HA       ILE  61  -3.847  -6.923   6.129
  431    HB   ILE  61           HB       ILE  61  -1.228  -7.060   4.648
  432   1HG1  ILE  61          2HG1      ILE  61  -0.925  -5.094   6.428
  433   2HG1  ILE  61          1HG1      ILE  61  -2.209  -5.987   7.249
  434   1HG2  ILE  61          1HG2      ILE  61  -1.693  -4.434   4.646
  435   2HG2  ILE  61          2HG2      ILE  61  -3.350  -5.011   4.473
  436   3HG2  ILE  61          3HG2      ILE  61  -2.125  -5.485   3.298
  437   1HD1  ILE  61          1HD1      ILE  61   0.322  -6.489   7.711
  438   2HD1  ILE  61          2HD1      ILE  61   0.160  -7.487   6.266
  439   3HD1  ILE  61          3HD1      ILE  61  -0.871  -7.787   7.664
  440    H    ILE  62           H        ILE  62  -2.425  -8.342   3.173
  441    HA   ILE  62           HA       ILE  62  -4.016  -7.247   1.253
  442    HB   ILE  62           HB       ILE  62  -3.055 -10.107   1.356
  443   1HG1  ILE  62          2HG1      ILE  62  -1.857  -7.579   0.203
  444   2HG1  ILE  62          1HG1      ILE  62  -1.230  -8.529   1.553
  445   1HG2  ILE  62          1HG2      ILE  62  -3.210  -9.148  -1.298
  446   2HG2  ILE  62          2HG2      ILE  62  -4.760  -8.812  -0.529
  447   3HG2  ILE  62          3HG2      ILE  62  -4.127 -10.457  -0.554
  448   1HD1  ILE  62          1HD1      ILE  62  -1.548 -10.077  -0.888
  449   2HD1  ILE  62          2HD1      ILE  62  -0.166  -9.931   0.198
  450   3HD1  ILE  62          3HD1      ILE  62  -0.436  -8.720  -1.056
  451    H    CYS  63           H        CYS  63  -4.779 -10.100   3.226
  452    HA   CYS  63           HA       CYS  63  -7.207 -10.782   2.026
  453   1HB   CYS  63          2HB       CYS  63  -5.804 -11.994   3.871
  454   2HB   CYS  63          1HB       CYS  63  -6.804 -11.061   4.989
  455    HG   CYS  63           HG       CYS  63  -8.236 -12.886   2.938
  456    H    GLU  64           H        GLU  64  -6.443  -8.425   4.526
  457    HA   GLU  64           HA       GLU  64  -9.196  -7.742   5.013
  458   1HB   GLU  64          2HB       GLU  64  -7.142  -7.505   6.606
  459   2HB   GLU  64          1HB       GLU  64  -6.875  -5.989   5.757
  460   1HG   GLU  64          2HG       GLU  64  -8.111  -5.389   7.630
  461   2HG   GLU  64          1HG       GLU  64  -9.300  -5.445   6.330
  462    H    VAL  65           H        VAL  65  -6.562  -6.574   3.031
  463    HA   VAL  65           HA       VAL  65  -7.732  -4.101   2.276
  464    HB   VAL  65           HB       VAL  65  -5.701  -5.777   0.787
  465   1HG1  VAL  65          1HG1      VAL  65  -6.799  -4.123  -0.644
  466   2HG1  VAL  65          2HG1      VAL  65  -5.107  -3.713  -0.362
  467   3HG1  VAL  65          3HG1      VAL  65  -6.378  -2.851   0.503
  468   1HG2  VAL  65          1HG2      VAL  65  -4.102  -4.069   1.786
  469   2HG2  VAL  65          2HG2      VAL  65  -4.755  -5.280   2.885
  470   3HG2  VAL  65          3HG2      VAL  65  -5.412  -3.646   2.887
  471    H    ASP  66           H        ASP  66  -7.455  -7.208   0.558
  472    HA   ASP  66           HA       ASP  66  -9.144  -6.430  -1.587
  473   1HB   ASP  66          2HB       ASP  66  -8.017  -9.047  -0.636
  474   2HB   ASP  66          1HB       ASP  66  -9.211  -9.009  -1.930
  475    H    GLU  67           H        GLU  67 -11.238  -6.028  -1.389
  476    HA   GLU  67           HA       GLU  67 -12.801  -7.485   0.616
  477   1HB   GLU  67          2HB       GLU  67 -13.370  -4.973  -0.964
  478   2HB   GLU  67          1HB       GLU  67 -14.560  -5.755   0.076
  479   1HG   GLU  67          2HG       GLU  67 -11.878  -4.786   1.038
  480   2HG   GLU  67          1HG       GLU  67 -13.358  -3.822   1.101
  481    H    ASP  68           H        ASP  68 -11.920  -8.665  -1.935
  482    HA   ASP  68           HA       ASP  68 -14.523  -9.627  -2.798
  483   1HB   ASP  68          2HB       ASP  68 -14.034  -9.298  -5.180
  484   2HB   ASP  68          1HB       ASP  68 -14.081  -7.759  -4.326
  485    H    GLY  69           H        GLY  69 -11.995 -10.589  -1.423
  486   1HA   GLY  69          2HA       GLY  69 -10.675 -12.468  -1.392
  487   2HA   GLY  69          1HA       GLY  69 -11.994 -13.218  -2.277
  488    H    SER  70           H        SER  70  -9.679 -10.670  -3.183
  489    HA   SER  70           HA       SER  70  -8.948 -12.315  -5.514
  490   1HB   SER  70          2HB       SER  70  -8.102  -9.894  -6.274
  491   2HB   SER  70          1HB       SER  70  -9.769 -10.428  -6.524
  492    HG   SER  70           HG       SER  70  -8.946  -9.048  -4.194
  493    H    GLY  71           H        GLY  71  -7.747 -10.555  -2.761
  494   1HA   GLY  71          2HA       GLY  71  -5.676 -10.553  -1.766
  495   2HA   GLY  71          1HA       GLY  71  -5.248 -11.893  -2.826
  496    H    THR  72           H        THR  72  -6.343  -9.122  -4.479
  497    HA   THR  72           HA       THR  72  -3.558  -8.370  -5.075
  498    HB   THR  72           HB       THR  72  -4.249  -7.800  -7.317
  499    HG1  THR  72           1HG      THR  72  -6.840  -8.352  -6.343
  500   1HG2  THR  72          1HG2      THR  72  -5.432 -10.472  -6.607
  501   2HG2  THR  72          2HG2      THR  72  -3.737 -10.161  -6.977
  502   3HG2  THR  72          3HG2      THR  72  -4.967  -9.927  -8.219
  503    H    ILE  73           H        ILE  73  -3.031  -6.206  -5.221
  504    HA   ILE  73           HA       ILE  73  -4.995  -4.377  -4.025
  505    HB   ILE  73           HB       ILE  73  -2.013  -3.997  -4.292
  506   1HG1  ILE  73          2HG1      ILE  73  -3.604  -4.860  -1.861
  507   2HG1  ILE  73          1HG1      ILE  73  -2.617  -5.938  -2.852
  508   1HG2  ILE  73          1HG2      ILE  73  -4.138  -2.499  -2.770
  509   2HG2  ILE  73          2HG2      ILE  73  -3.125  -1.895  -4.082
  510   3HG2  ILE  73          3HG2      ILE  73  -2.406  -2.278  -2.517
  511   1HD1  ILE  73          1HD1      ILE  73  -1.604  -5.077  -0.694
  512   2HD1  ILE  73          2HD1      ILE  73  -1.468  -3.518  -1.506
  513   3HD1  ILE  73          3HD1      ILE  73  -0.626  -4.926  -2.154
  514    H    ASP  74           H        ASP  74  -6.105  -3.298  -5.534
  515    HA   ASP  74           HA       ASP  74  -5.199  -2.778  -8.154
  516   1HB   ASP  74          2HB       ASP  74  -7.622  -2.693  -6.927
  517   2HB   ASP  74          1HB       ASP  74  -7.265  -0.968  -7.061
  518    H    PHE  75           H        PHE  75  -5.789  -0.146  -8.688
  519    HA   PHE  75           HA       PHE  75  -3.364   1.142  -8.167
  520   1HB   PHE  75          2HB       PHE  75  -6.017   2.053  -9.227
  521   2HB   PHE  75          1HB       PHE  75  -4.756   3.240  -8.888
  522    HD1  PHE  75           1HD      PHE  75  -3.789   3.951 -10.838
  523    HD2  PHE  75           2HD      PHE  75  -4.725  -0.177 -10.395
  524    HE1  PHE  75           1HE      PHE  75  -2.767   3.489 -13.028
  525    HE2  PHE  75           2HE      PHE  75  -3.703  -0.646 -12.585
  526    HZ   PHE  75           HZ       PHE  75  -2.721   1.187 -13.903
  527    H    GLU  76           H        GLU  76  -6.431   2.629  -7.183
  528    HA   GLU  76           HA       GLU  76  -5.244   4.025  -5.033
  529   1HB   GLU  76          2HB       GLU  76  -8.120   3.472  -5.748
  530   2HB   GLU  76          1HB       GLU  76  -7.660   4.448  -4.358
  531   1HG   GLU  76          2HG       GLU  76  -7.938   6.098  -5.883
  532   2HG   GLU  76          1HG       GLU  76  -6.241   5.727  -6.185
  533    H    GLU  77           H        GLU  77  -6.496   0.831  -5.308
  534    HA   GLU  77           HA       GLU  77  -7.376   0.271  -2.749
  535   1HB   GLU  77          2HB       GLU  77  -6.591  -1.222  -5.054
  536   2HB   GLU  77          1HB       GLU  77  -5.855  -1.967  -3.641
  537   1HG   GLU  77          2HG       GLU  77  -8.211  -1.814  -2.609
  538   2HG   GLU  77          1HG       GLU  77  -8.751  -1.575  -4.275
  539    H    PHE  78           H        PHE  78  -4.139   0.836  -3.882
  540    HA   PHE  78           HA       PHE  78  -2.772  -0.347  -1.683
  541   1HB   PHE  78          2HB       PHE  78  -1.747   0.201  -3.919
  542   2HB   PHE  78          1HB       PHE  78  -1.771   1.901  -3.439
  543    HD1  PHE  78           1HD      PHE  78  -0.382   2.667  -1.549
  544    HD2  PHE  78           2HD      PHE  78  -0.120  -1.300  -3.067
  545    HE1  PHE  78           1HE      PHE  78   1.778   2.377  -0.408
  546    HE2  PHE  78           2HE      PHE  78   2.041  -1.597  -1.930
  547    HZ   PHE  78           HZ       PHE  78   2.993   0.243  -0.597
  548    H    LEU  79           H        LEU  79  -4.627   2.480  -1.982
  549    HA   LEU  79           HA       LEU  79  -3.260   3.843   0.210
  550   1HB   LEU  79          2HB       LEU  79  -5.552   4.657  -1.574
  551   2HB   LEU  79          1HB       LEU  79  -4.978   5.630  -0.232
  552    HG   LEU  79           HG       LEU  79  -2.701   5.054  -1.781
  553   1HD1  LEU  79          1HD1      LEU  79  -3.606   6.240  -3.927
  554   2HD1  LEU  79          2HD1      LEU  79  -5.141   5.530  -3.427
  555   3HD1  LEU  79          3HD1      LEU  79  -3.751   4.492  -3.744
  556   1HD2  LEU  79          1HD2      LEU  79  -3.080   7.573  -2.373
  557   2HD2  LEU  79          2HD2      LEU  79  -2.719   7.090  -0.716
  558   3HD2  LEU  79          3HD2      LEU  79  -4.381   7.445  -1.188
  559    H    VAL  80           H        VAL  80  -6.214   2.112  -0.520
  560    HA   VAL  80           HA       VAL  80  -7.488   2.788   1.970
  561    HB   VAL  80           HB       VAL  80  -8.696   2.197  -0.189
  562   1HG1  VAL  80          1HG1      VAL  80  -8.033  -0.608   0.696
  563   2HG1  VAL  80          2HG1      VAL  80  -7.449   0.190  -0.764
  564   3HG1  VAL  80          3HG1      VAL  80  -9.165  -0.170  -0.584
  565   1HG2  VAL  80          1HG2      VAL  80 -10.566   1.716   0.998
  566   2HG2  VAL  80          2HG2      VAL  80  -9.511   2.148   2.344
  567   3HG2  VAL  80          3HG2      VAL  80  -9.780   0.451   1.942
  568    H    MET  81           H        MET  81  -5.441   0.240   0.775
  569    HA   MET  81           HA       MET  81  -5.899  -1.805   2.585
  570   1HB   MET  81          2HB       MET  81  -3.351  -2.194   2.291
  571   2HB   MET  81          1HB       MET  81  -4.384  -2.308   0.876
  572   1HG   MET  81          2HG       MET  81  -3.571  -0.399  -0.047
  573   2HG   MET  81          1HG       MET  81  -3.152   0.321   1.510
  574   1HE   MET  81          1HE       MET  81  -0.178  -0.621   2.660
  575   2HE   MET  81          2HE       MET  81  -0.612  -2.332   2.569
  576   3HE   MET  81          3HE       MET  81  -1.822  -1.138   3.042
  577    H    MET  82           H        MET  82  -3.953   1.077   2.857
  578    HA   MET  82           HA       MET  82  -2.943   0.494   5.472
  579   1HB   MET  82          2HB       MET  82  -2.797   2.736   3.513
  580   2HB   MET  82          1HB       MET  82  -2.363   3.057   5.194
  581   1HG   MET  82          2HG       MET  82  -0.642   1.392   5.118
  582   2HG   MET  82          1HG       MET  82  -1.151   0.886   3.508
  583   1HE   MET  82          1HE       MET  82   2.118   2.171   4.333
  584   2HE   MET  82          2HE       MET  82   0.985   2.617   5.607
  585   3HE   MET  82          3HE       MET  82   1.838   3.872   4.707
  586    H    VAL  83           H        VAL  83  -5.587   2.316   4.084
  587    HA   VAL  83           HA       VAL  83  -6.306   3.780   6.399
  588    HB   VAL  83           HB       VAL  83  -8.060   2.945   4.083
  589   1HG1  VAL  83          1HG1      VAL  83  -9.487   4.786   4.696
  590   2HG1  VAL  83          2HG1      VAL  83  -8.393   5.248   6.001
  591   3HG1  VAL  83          3HG1      VAL  83  -9.281   3.727   6.092
  592   1HG2  VAL  83          1HG2      VAL  83  -7.155   4.555   2.817
  593   2HG2  VAL  83          2HG2      VAL  83  -5.799   4.486   3.946
  594   3HG2  VAL  83          3HG2      VAL  83  -7.067   5.693   4.161
  595    H    ARG  84           H        ARG  84  -6.803   0.508   5.426
  596    HA   ARG  84           HA       ARG  84  -9.051   0.044   7.174
  597   1HB   ARG  84          2HB       ARG  84  -7.295  -1.862   5.620
  598   2HB   ARG  84          1HB       ARG  84  -8.717  -2.341   6.537
  599   1HG   ARG  84          2HG       ARG  84  -9.657  -0.317   4.916
  600   2HG   ARG  84          1HG       ARG  84  -8.510  -1.182   3.884
  601   1HD   ARG  84          2HD       ARG  84  -9.983  -2.815   3.581
  602   2HD   ARG  84          1HD       ARG  84 -10.068  -3.091   5.320
  603    HE   ARG  84           HE       ARG  84 -12.011  -1.786   3.696
  604   1HH1  ARG  84          1HH1      ARG  84 -10.614  -1.819   6.894
  605   2HH1  ARG  84          2HH1      ARG  84 -12.024  -1.160   7.654
  606   1HH2  ARG  84          1HH2      ARG  84 -13.866  -0.920   4.693
  607   2HH2  ARG  84          2HH2      ARG  84 -13.871  -0.650   6.405
  608    H    GLN  85           H        GLN  85  -5.655   0.147   7.506
  609    HA   GLN  85           HA       GLN  85  -5.781  -1.412   9.999
  610   1HB   GLN  85          2HB       GLN  85  -3.214  -0.559   8.697
  611   2HB   GLN  85          1HB       GLN  85  -3.509  -1.919   9.780
  612   1HG   GLN  85          2HG       GLN  85  -4.271  -1.674   6.881
  613   2HG   GLN  85          1HG       GLN  85  -3.106  -2.788   7.608
  614   1HE2  GLN  85          1HE2      GLN  85  -5.720  -3.049   6.044
  615   2HE2  GLN  85          2HE2      GLN  85  -6.624  -4.204   6.957
  616    H    MET  86           H        MET  86  -4.852   1.647   8.568
  617    HA   MET  86           HA       MET  86  -3.606   2.821  10.783
  618   1HB   MET  86          2HB       MET  86  -4.993   3.859   8.345
  619   2HB   MET  86          1HB       MET  86  -4.559   4.990   9.629
  620   1HG   MET  86          2HG       MET  86  -2.208   3.956   9.441
  621   2HG   MET  86          1HG       MET  86  -2.776   3.336   7.886
  622   1HE   MET  86          1HE       MET  86  -1.362   4.328   6.316
  623   2HE   MET  86          2HE       MET  86  -1.487   5.994   5.746
  624   3HE   MET  86          3HE       MET  86  -2.884   4.919   5.640
  625    H    LYS  87           H        LYS  87  -6.959   3.280   9.645
  626    HA   LYS  87           HA       LYS  87  -7.827   4.701  11.910
  627   1HB   LYS  87          2HB       LYS  87  -9.211   3.209   9.709
  628   2HB   LYS  87          1HB       LYS  87 -10.145   3.812  11.077
  629   1HG   LYS  87          2HG       LYS  87 -10.335   5.516   9.535
  630   2HG   LYS  87          1HG       LYS  87  -9.003   6.070  10.559
  631   1HD   LYS  87          2HD       LYS  87  -8.106   4.414   8.340
  632   2HD   LYS  87          1HD       LYS  87  -8.970   5.857   7.805
  633   1HE   LYS  87          2HE       LYS  87  -7.415   6.971   9.661
  634   2HE   LYS  87          1HE       LYS  87  -6.389   5.602   9.238
  635   1HZ   LYS  87          1HZ       LYS  87  -5.677   7.002   7.651
  636   2HZ   LYS  87          2HZ       LYS  87  -7.078   7.950   7.680
  637   3HZ   LYS  87          3HZ       LYS  87  -7.061   6.493   6.821
  638    H    GLU  88           H        GLU  88  -6.941   3.463  13.668
  639    HA   GLU  88           HA       GLU  88  -8.827   1.506  14.666
  640   1HB   GLU  88          2HB       GLU  88  -7.115   0.216  13.333
  641   2HB   GLU  88          1HB       GLU  88  -5.905   0.764  14.485
  642   1HG   GLU  88          2HG       GLU  88  -6.956  -0.413  16.267
  643   2HG   GLU  88          1HG       GLU  88  -8.357  -0.789  15.265
  644    H    ASP  89           H        ASP  89  -8.312   0.888  16.946
  645    HA   ASP  89           HA       ASP  89  -7.915   3.158  18.524
  646   1HB   ASP  89          2HB       ASP  89  -7.834   0.214  19.192
  647   2HB   ASP  89          1HB       ASP  89  -7.681   1.474  20.420
  648    H    ALA  90           H        ALA  90  -5.979   4.168  17.962
  649    HA   ALA  90           HA       ALA  90  -3.471   2.751  18.200
  650   1HB   ALA  90          1HB       ALA  90  -3.522   4.369  16.486
  651   2HB   ALA  90          2HB       ALA  90  -2.512   5.057  17.758
  652   3HB   ALA  90          3HB       ALA  90  -4.177   5.603  17.563
  653   2H    ARG 115          HN2       ARG 115   2.325  -2.977   9.811
  654    H    ARG 115           H        ARG 115   1.117  -3.217  11.006
  655   3H    ARG 115          HN3       ARG 115   1.579  -4.512   9.985
  656    HA   ARG 115           HA       ARG 115   0.717  -3.410   8.097
  657   1HB   ARG 115          2HB       ARG 115  -1.631  -3.600   8.671
  658   2HB   ARG 115          1HB       ARG 115  -0.723  -4.853   9.506
  659   1HG   ARG 115          2HG       ARG 115  -0.752  -3.452  11.547
  660   2HG   ARG 115          1HG       ARG 115  -1.773  -2.293  10.693
  661   1HD   ARG 115          2HD       ARG 115  -3.602  -3.633  10.784
  662   2HD   ARG 115          1HD       ARG 115  -2.656  -5.116  10.666
  663    HE   ARG 115           HE       ARG 115  -2.111  -4.005  13.147
  664   1HH1  ARG 115          1HH1      ARG 115  -4.875  -5.295  11.450
  665   2HH1  ARG 115          2HH1      ARG 115  -5.666  -5.835  12.893
  666   1HH2  ARG 115          1HH2      ARG 115  -3.150  -4.713  15.045
  667   2HH2  ARG 115          2HH2      ARG 115  -4.688  -5.504  14.934
  668    H    MET 116           H        MET 116   0.165  -1.512  11.060
  669    HA   MET 116           HA       MET 116  -0.613   0.802   9.479
  670   1HB   MET 116          2HB       MET 116  -1.844   0.290  11.545
  671   2HB   MET 116          1HB       MET 116  -0.362   0.471  12.474
  672   1HG   MET 116          2HG       MET 116  -0.242   2.806  11.937
  673   2HG   MET 116          1HG       MET 116  -1.614   2.663  10.840
  674   1HE   MET 116          1HE       MET 116  -2.208   4.993  12.709
  675   2HE   MET 116          2HE       MET 116  -0.779   4.424  13.570
  676   3HE   MET 116          3HE       MET 116  -2.302   4.636  14.432
  677    H    SER 117           H        SER 117   0.396   2.924   9.944
  678    HA   SER 117           HA       SER 117   2.205   4.297   9.884
  679   1HB   SER 117          2HB       SER 117   3.714   4.175  11.669
  680   2HB   SER 117          1HB       SER 117   2.287   3.355  12.302
  681    HG   SER 117           HG       SER 117   3.271   1.406  11.995
  682    H    ALA 118           H        ALA 118   1.999   2.255   7.913
  683    HA   ALA 118           HA       ALA 118   4.609   1.134   7.457
  684   1HB   ALA 118          1HB       ALA 118   1.966   1.021   6.164
  685   2HB   ALA 118          2HB       ALA 118   3.142  -0.259   6.467
  686   3HB   ALA 118          3HB       ALA 118   3.355   0.825   5.094
  687    H    ASP 119           H        ASP 119   3.556   4.224   7.244
  688    HA   ASP 119           HA       ASP 119   4.181   5.250   4.795
  689   1HB   ASP 119          2HB       ASP 119   3.378   6.472   6.890
  690   2HB   ASP 119          1HB       ASP 119   5.075   6.582   7.346
  691    H    ALA 120           H        ALA 120   6.382   3.942   7.155
  692    HA   ALA 120           HA       ALA 120   8.787   5.090   6.470
  693   1HB   ALA 120          1HB       ALA 120   8.561   3.518   8.309
  694   2HB   ALA 120          2HB       ALA 120   9.851   3.009   7.221
  695   3HB   ALA 120          3HB       ALA 120   8.285   2.200   7.171
  696    H    MET 121           H        MET 121   7.745   1.926   5.176
  697    HA   MET 121           HA       MET 121   9.610   1.797   3.118
  698   1HB   MET 121          2HB       MET 121   8.353  -0.161   3.724
  699   2HB   MET 121          1HB       MET 121   6.833   0.623   3.322
  700   1HG   MET 121          2HG       MET 121   8.177   0.774   0.951
  701   2HG   MET 121          1HG       MET 121   8.757  -0.757   1.607
  702   1HE   MET 121          1HE       MET 121   5.032   0.520   2.489
  703   2HE   MET 121          2HE       MET 121   4.331   0.265   0.890
  704   3HE   MET 121          3HE       MET 121   5.652   1.415   1.100
  705    H    LEU 122           H        LEU 122   6.542   3.448   3.310
  706    HA   LEU 122           HA       LEU 122   6.252   4.006   0.550
  707   1HB   LEU 122          2HB       LEU 122   5.102   5.200   3.052
  708   2HB   LEU 122          1HB       LEU 122   4.787   5.926   1.488
  709    HG   LEU 122           HG       LEU 122   3.923   3.632   0.766
  710   1HD1  LEU 122          1HD1      LEU 122   3.673   3.190   3.727
  711   2HD1  LEU 122          2HD1      LEU 122   4.963   2.483   2.760
  712   3HD1  LEU 122          3HD1      LEU 122   3.281   2.072   2.421
  713   1HD2  LEU 122          1HD2      LEU 122   2.238   4.749   2.958
  714   2HD2  LEU 122          2HD2      LEU 122   1.778   4.226   1.338
  715   3HD2  LEU 122          3HD2      LEU 122   2.624   5.758   1.564
  716    H    ARG 123           H        ARG 123   7.835   5.659   3.226
  717    HA   ARG 123           HA       ARG 123   8.608   7.886   1.513
  718   1HB   ARG 123          2HB       ARG 123   7.893   8.208   3.904
  719   2HB   ARG 123          1HB       ARG 123   9.367   7.384   4.394
  720   1HG   ARG 123          2HG       ARG 123  10.714   9.115   3.374
  721   2HG   ARG 123          1HG       ARG 123   9.263   9.919   2.773
  722   1HD   ARG 123          2HD       ARG 123   9.238   9.404   5.654
  723   2HD   ARG 123          1HD       ARG 123  10.529  10.484   5.130
  724    HE   ARG 123           HE       ARG 123   8.348  11.490   3.892
  725   1HH1  ARG 123          1HH1      ARG 123   9.027  10.649   7.209
  726   2HH1  ARG 123          2HH1      ARG 123   7.968  11.851   7.862
  727   1HH2  ARG 123          1HH2      ARG 123   6.953  13.073   4.749
  728   2HH2  ARG 123          2HH2      ARG 123   6.789  13.228   6.466
  729    H    ALA 124           H        ALA 124   9.703   4.837   1.910
  730    HA   ALA 124           HA       ALA 124  12.481   5.159   2.298
  731   1HB   ALA 124          1HB       ALA 124  11.322   2.911   0.699
  732   2HB   ALA 124          2HB       ALA 124  11.014   3.034   2.432
  733   3HB   ALA 124          3HB       ALA 124  12.668   2.898   1.838
  734    H    LEU 125           H        LEU 125  10.935   4.083  -0.721
  735    HA   LEU 125           HA       LEU 125  13.159   4.991  -2.279
  736   1HB   LEU 125          2HB       LEU 125  10.477   4.069  -3.291
  737   2HB   LEU 125          1HB       LEU 125  12.003   4.071  -4.156
  738    HG   LEU 125           HG       LEU 125  11.719   2.446  -1.662
  739   1HD1  LEU 125          1HD1      LEU 125   9.999   1.368  -2.601
  740   2HD1  LEU 125          2HD1      LEU 125  11.245   0.623  -3.601
  741   3HD1  LEU 125          3HD1      LEU 125  10.335   2.006  -4.209
  742   1HD2  LEU 125          1HD2      LEU 125  13.516   1.237  -2.497
  743   2HD2  LEU 125          2HD2      LEU 125  13.892   2.893  -2.976
  744   3HD2  LEU 125          3HD2      LEU 125  13.227   1.763  -4.155
  745    H    LEU 126           H        LEU 126  10.101   6.306  -1.332
  746    HA   LEU 126           HA       LEU 126   9.059   8.282  -1.750
  747   1HB   LEU 126          2HB       LEU 126  11.941   8.871  -2.132
  748   2HB   LEU 126          1HB       LEU 126  10.804  10.071  -2.715
  749    HG   LEU 126           HG       LEU 126  10.850   9.023   0.114
  750   1HD1  LEU 126          1HD1      LEU 126  12.241  10.691   0.747
  751   2HD1  LEU 126          2HD1      LEU 126  11.681  11.788  -0.514
  752   3HD1  LEU 126          3HD1      LEU 126  12.825  10.504  -0.907
  753   1HD2  LEU 126          1HD2      LEU 126   8.755   9.871  -0.026
  754   2HD2  LEU 126          2HD2      LEU 126   9.150  10.914  -1.393
  755   3HD2  LEU 126          3HD2      LEU 126   9.612  11.390   0.241
  756    H    GLY 127           H        GLY 127   8.643   9.989  -3.520
  757   1HA   GLY 127          2HA       GLY 127   9.060   8.865  -6.203
  758   2HA   GLY 127          1HA       GLY 127   7.417   9.172  -5.661
  759    H    SER 128           H        SER 128  10.412  10.594  -6.712
  760    HA   SER 128           HA       SER 128   9.473  13.308  -6.408
  761   1HB   SER 128          2HB       SER 128  11.636  13.690  -7.869
  762   2HB   SER 128          1HB       SER 128  11.774  13.245  -6.167
  763    HG   SER 128           HG       SER 128  13.074  12.011  -7.747
  764    H    LYS 129           H        LYS 129   9.703  14.779  -8.401
  765    HA   LYS 129           HA       LYS 129   8.797  13.482 -10.858
  766   1HB   LYS 129          2HB       LYS 129   6.835  14.252  -9.363
  767   2HB   LYS 129          1HB       LYS 129   7.316  15.882  -9.814
  768   1HG   LYS 129          2HG       LYS 129   7.061  15.217 -12.205
  769   2HG   LYS 129          1HG       LYS 129   6.393  13.682 -11.646
  770   1HD   LYS 129          2HD       LYS 129   4.897  15.439 -10.226
  771   2HD   LYS 129          1HD       LYS 129   5.189  16.367 -11.698
  772   1HE   LYS 129          2HE       LYS 129   4.142  14.776 -13.050
  773   2HE   LYS 129          1HE       LYS 129   4.265  13.518 -11.821
  774   1HZ   LYS 129          1HZ       LYS 129   2.655  14.776 -10.480
  775   2HZ   LYS 129          2HZ       LYS 129   2.011  14.292 -11.967
  776   3HZ   LYS 129          3HZ       LYS 129   2.490  15.897 -11.736
  777    H    HIS 130           H        HIS 130   8.957  14.842 -12.743
  778    HA   HIS 130           HA       HIS 130  11.253  16.566 -12.625
  779   1HB   HIS 130          2HB       HIS 130  10.565  14.927 -14.515
  780   2HB   HIS 130          1HB       HIS 130   9.507  16.230 -15.048
  781    HD1  HIS 130           1HD      HIS 130  12.941  16.873 -13.662
  782    HD2  HIS 130           2HD      HIS 130  10.978  16.819 -17.324
  783    HE1  HIS 130           1HE      HIS 130  14.552  17.891 -15.304
  784    HE2  HIS 130           2HE      HIS 130  13.377  17.764 -17.528
  785    H    LYS 131           H        LYS 131  11.296  18.747 -13.491
  786    HA   LYS 131           HA       LYS 131   8.888  20.231 -12.727
  787   1HB   LYS 131          2HB       LYS 131  10.487  22.215 -12.827
  788   2HB   LYS 131          1HB       LYS 131  10.764  21.038 -11.550
  789   1HG   LYS 131          2HG       LYS 131  12.759  20.417 -12.374
  790   2HG   LYS 131          1HG       LYS 131  12.225  20.541 -14.052
  791   1HD   LYS 131          2HD       LYS 131  12.568  23.034 -12.449
  792   2HD   LYS 131          1HD       LYS 131  13.999  22.215 -13.077
  793   1HE   LYS 131          2HE       LYS 131  13.600  23.508 -14.883
  794   2HE   LYS 131          1HE       LYS 131  12.467  22.219 -15.284
  795   1HZ   LYS 131          1HZ       LYS 131  11.745  24.736 -15.236
  796   2HZ   LYS 131          2HZ       LYS 131  11.496  24.399 -13.597
  797   3HZ   LYS 131          3HZ       LYS 131  10.682  23.501 -14.778
  Start of MODEL    5
    1   2H    ALA   1          HN2       ALA   1 -21.708  -0.297 -11.940
    2    H    ALA   1           H        ALA   1 -21.814  -1.396 -10.625
    3   3H    ALA   1          HN3       ALA   1 -22.696   0.073 -10.586
    4    HA   ALA   1           HA       ALA   1 -19.822  -0.383 -10.305
    5   1HB   ALA   1          1HB       ALA   1 -19.283   1.793 -10.837
    6   2HB   ALA   1          2HB       ALA   1 -20.936   2.369 -10.624
    7   3HB   ALA   1          3HB       ALA   1 -20.507   1.426 -12.052
    8    H    SER   2           H        SER   2 -20.688  -1.340  -8.307
    9    HA   SER   2           HA       SER   2 -20.606   0.536  -6.172
   10   1HB   SER   2          2HB       SER   2 -23.255  -0.498  -7.064
   11   2HB   SER   2          1HB       SER   2 -22.961  -0.391  -5.329
   12    HG   SER   2           HG       SER   2 -22.263   1.848  -5.836
   13    H    MET   3           H        MET   3 -18.967  -0.774  -5.409
   14    HA   MET   3           HA       MET   3 -19.866  -3.224  -4.096
   15   1HB   MET   3          2HB       MET   3 -17.667  -3.039  -6.126
   16   2HB   MET   3          1HB       MET   3 -17.580  -4.232  -4.838
   17   1HG   MET   3          2HG       MET   3 -20.049  -4.041  -6.494
   18   2HG   MET   3          1HG       MET   3 -18.620  -4.842  -7.145
   19   1HE   MET   3          1HE       MET   3 -21.262  -4.519  -4.700
   20   2HE   MET   3          2HE       MET   3 -20.590  -5.364  -3.305
   21   3HE   MET   3          3HE       MET   3 -21.737  -6.185  -4.365
   22    H    THR   4           H        THR   4 -17.155  -0.986  -4.605
   23    HA   THR   4           HA       THR   4 -16.853  -0.589  -1.783
   24    HB   THR   4           HB       THR   4 -15.665  -2.722  -2.030
   25    HG1  THR   4           1HG      THR   4 -13.823  -0.598  -1.687
   26   1HG2  THR   4          1HG2      THR   4 -14.329  -3.222  -3.714
   27   2HG2  THR   4          2HG2      THR   4 -13.337  -1.796  -3.412
   28   3HG2  THR   4          3HG2      THR   4 -14.753  -1.680  -4.456
   29    H    ASP   5           H        ASP   5 -16.569   1.532  -1.697
   30    HA   ASP   5           HA       ASP   5 -14.905   2.819  -3.758
   31   1HB   ASP   5          2HB       ASP   5 -17.142   3.977  -2.082
   32   2HB   ASP   5          1HB       ASP   5 -16.145   4.902  -3.209
   33    H    GLN   6           H        GLN   6 -14.646   1.745  -0.694
   34    HA   GLN   6           HA       GLN   6 -13.736   3.816   0.877
   35   1HB   GLN   6          2HB       GLN   6 -12.205   2.030   1.903
   36   2HB   GLN   6          1HB       GLN   6 -13.938   1.742   1.936
   37   1HG   GLN   6          2HG       GLN   6 -13.815   0.150   0.213
   38   2HG   GLN   6          1HG       GLN   6 -12.178   0.634  -0.225
   39   1HE2  GLN   6          1HE2      GLN   6 -10.966  -1.095   0.151
   40   2HE2  GLN   6          2HE2      GLN   6 -10.910  -1.979   1.633
   41    H    GLN   7           H        GLN   7 -12.210   2.360  -1.873
   42    HA   GLN   7           HA       GLN   7  -9.540   3.102  -1.399
   43   1HB   GLN   7          2HB       GLN   7  -9.526   3.225  -4.031
   44   2HB   GLN   7          1HB       GLN   7  -9.658   1.679  -3.201
   45   1HG   GLN   7          2HG       GLN   7 -12.216   2.995  -3.783
   46   2HG   GLN   7          1HG       GLN   7 -11.280   2.524  -5.198
   47   1HE2  GLN   7          1HE2      GLN   7 -11.121   0.791  -2.166
   48   2HE2  GLN   7          2HE2      GLN   7 -11.922  -0.634  -2.719
   49    H    ALA   8           H        ALA   8 -12.278   4.848  -2.660
   50    HA   ALA   8           HA       ALA   8 -10.813   7.083  -3.616
   51   1HB   ALA   8          1HB       ALA   8 -13.411   7.949  -3.041
   52   2HB   ALA   8          2HB       ALA   8 -13.567   6.249  -3.488
   53   3HB   ALA   8          3HB       ALA   8 -12.790   7.384  -4.593
   54    H    GLU   9           H        GLU   9 -12.814   6.583  -0.705
   55    HA   GLU   9           HA       GLU   9 -12.338   9.061   0.491
   56   1HB   GLU   9          2HB       GLU   9 -12.664   6.498   2.044
   57   2HB   GLU   9          1HB       GLU   9 -13.176   8.118   2.500
   58   1HG   GLU   9          2HG       GLU   9 -14.742   8.000   0.487
   59   2HG   GLU   9          1HG       GLU   9 -14.396   6.266   0.483
   60    H    ALA  10           H        ALA  10 -10.481   6.102   0.451
   61    HA   ALA  10           HA       ALA  10  -8.649   6.470   2.459
   62   1HB   ALA  10          1HB       ALA  10  -7.076   5.372   0.595
   63   2HB   ALA  10          2HB       ALA  10  -8.649   5.105  -0.162
   64   3HB   ALA  10          3HB       ALA  10  -8.327   4.468   1.450
   65    H    ARG  11           H        ARG  11  -8.234   7.500  -0.932
   66    HA   ARG  11           HA       ARG  11  -5.847   8.870  -0.656
   67   1HB   ARG  11          2HB       ARG  11  -7.523   8.386  -2.720
   68   2HB   ARG  11          1HB       ARG  11  -7.849  10.094  -2.463
   69   1HG   ARG  11          2HG       ARG  11  -5.855  10.730  -3.270
   70   2HG   ARG  11          1HG       ARG  11  -5.004   9.381  -2.515
   71   1HD   ARG  11          2HD       ARG  11  -4.905   8.373  -4.490
   72   2HD   ARG  11          1HD       ARG  11  -6.665   8.284  -4.514
   73    HE   ARG  11           HE       ARG  11  -6.091  10.815  -5.366
   74   1HH1  ARG  11          1HH1      ARG  11  -5.192   7.605  -6.397
   75   2HH1  ARG  11          2HH1      ARG  11  -5.022   8.051  -8.062
   76   1HH2  ARG  11          1HH2      ARG  11  -5.866  11.405  -7.555
   77   2HH2  ARG  11          2HH2      ARG  11  -5.403  10.208  -8.719
   78    H    ALA  12           H        ALA  12  -9.041   9.786   0.329
   79    HA   ALA  12           HA       ALA  12  -8.245  12.550   0.820
   80   1HB   ALA  12          1HB       ALA  12 -10.909  11.188   1.200
   81   2HB   ALA  12          2HB       ALA  12 -10.429  12.165  -0.188
   82   3HB   ALA  12          3HB       ALA  12 -10.594  12.912   1.402
   83    H    PHE  13           H        PHE  13  -8.564   9.553   2.488
   84    HA   PHE  13           HA       PHE  13  -8.975  10.650   5.100
   85   1HB   PHE  13          2HB       PHE  13  -9.590   8.313   4.434
   86   2HB   PHE  13          1HB       PHE  13  -7.867   7.929   4.375
   87    HD1  PHE  13           1HD      PHE  13  -6.926   6.970   6.230
   88    HD2  PHE  13           2HD      PHE  13 -10.355   9.442   6.711
   89    HE1  PHE  13           1HE      PHE  13  -6.958   6.450   8.635
   90    HE2  PHE  13           2HE      PHE  13 -10.393   8.929   9.117
   91    HZ   PHE  13           HZ       PHE  13  -8.692   7.432  10.082
   92    H    LEU  14           H        LEU  14  -6.216  10.003   3.095
   93    HA   LEU  14           HA       LEU  14  -4.414  10.595   5.343
   94   1HB   LEU  14          2HB       LEU  14  -3.597   9.520   2.652
   95   2HB   LEU  14          1HB       LEU  14  -2.673   9.514   4.150
   96    HG   LEU  14           HG       LEU  14  -5.230   7.954   3.842
   97   1HD1  LEU  14          1HD1      LEU  14  -3.956   6.018   3.259
   98   2HD1  LEU  14          2HD1      LEU  14  -2.441   6.908   3.402
   99   3HD1  LEU  14          3HD1      LEU  14  -3.572   7.294   2.105
  100   1HD2  LEU  14          1HD2      LEU  14  -2.875   7.633   5.698
  101   2HD2  LEU  14          2HD2      LEU  14  -4.373   6.700   5.719
  102   3HD2  LEU  14          3HD2      LEU  14  -4.398   8.417   6.118
  103    H    SER  15           H        SER  15  -2.418  11.841   4.703
  104    HA   SER  15           HA       SER  15  -3.261  14.268   3.356
  105   1HB   SER  15          2HB       SER  15  -1.734  13.890   5.550
  106   2HB   SER  15          1HB       SER  15  -0.463  13.996   4.324
  107    HG   SER  15           HG       SER  15  -2.536  15.904   4.709
  108    H    GLU  16           H        GLU  16  -1.785  15.335   1.786
  109    HA   GLU  16           HA       GLU  16  -1.360  13.825  -0.484
  110   1HB   GLU  16          2HB       GLU  16  -0.073  16.390   0.442
  111   2HB   GLU  16          1HB       GLU  16   0.265  15.691  -1.136
  112   1HG   GLU  16          2HG       GLU  16  -1.394  17.199  -1.626
  113   2HG   GLU  16          1HG       GLU  16  -2.312  15.708  -1.414
  114    H    GLU  17           H        GLU  17   0.635  14.198   2.318
  115    HA   GLU  17           HA       GLU  17   3.120  13.397   1.325
  116   1HB   GLU  17          2HB       GLU  17   1.801  13.530   3.969
  117   2HB   GLU  17          1HB       GLU  17   3.155  12.410   3.853
  118   1HG   GLU  17          2HG       GLU  17   3.611  15.091   2.726
  119   2HG   GLU  17          1HG       GLU  17   3.401  15.011   4.475
  120    H    MET  18           H        MET  18   0.723  11.403   3.065
  121    HA   MET  18           HA       MET  18   1.936   8.941   2.707
  122   1HB   MET  18          2HB       MET  18  -0.412   9.840   3.839
  123   2HB   MET  18          1HB       MET  18  -0.986   8.829   2.513
  124   1HG   MET  18          2HG       MET  18  -0.850   7.479   4.459
  125   2HG   MET  18          1HG       MET  18   0.456   6.993   3.380
  126   1HE   MET  18          1HE       MET  18  -0.287   7.137   6.882
  127   2HE   MET  18          2HE       MET  18   1.375   6.898   7.424
  128   3HE   MET  18          3HE       MET  18   0.711   5.887   6.139
  129    H    ILE  19           H        ILE  19   0.237  10.891   0.410
  130    HA   ILE  19           HA       ILE  19  -0.272   8.751  -1.450
  131    HB   ILE  19           HB       ILE  19  -0.503  11.750  -1.656
  132   1HG1  ILE  19          2HG1      ILE  19  -2.578   9.550  -1.758
  133   2HG1  ILE  19          1HG1      ILE  19  -2.200  10.519  -0.331
  134   1HG2  ILE  19          1HG2      ILE  19  -1.738  11.106  -3.861
  135   2HG2  ILE  19          2HG2      ILE  19  -0.702   9.679  -3.799
  136   3HG2  ILE  19          3HG2      ILE  19   0.018  11.290  -3.851
  137   1HD1  ILE  19          1HD1      ILE  19  -3.227  12.383  -1.162
  138   2HD1  ILE  19          2HD1      ILE  19  -4.225  11.114  -1.874
  139   3HD1  ILE  19          3HD1      ILE  19  -2.983  11.907  -2.843
  140    H    ALA  20           H        ALA  20   1.715  11.704  -1.689
  141    HA   ALA  20           HA       ALA  20   3.164  11.043  -3.934
  142   1HB   ALA  20          1HB       ALA  20   4.362  12.902  -3.496
  143   2HB   ALA  20          2HB       ALA  20   4.668  12.442  -1.819
  144   3HB   ALA  20          3HB       ALA  20   3.116  13.149  -2.271
  145    H    GLU  21           H        GLU  21   3.487   9.836  -0.702
  146    HA   GLU  21           HA       GLU  21   6.063   8.600  -1.227
  147   1HB   GLU  21          2HB       GLU  21   4.260   8.473   1.200
  148   2HB   GLU  21          1HB       GLU  21   5.871   7.777   1.097
  149   1HG   GLU  21          2HG       GLU  21   6.433  10.305   0.413
  150   2HG   GLU  21          1HG       GLU  21   5.037  10.578   1.449
  151    H    PHE  22           H        PHE  22   2.679   7.827  -1.168
  152    HA   PHE  22           HA       PHE  22   2.849   5.018  -0.977
  153   1HB   PHE  22          2HB       PHE  22   0.813   7.000  -1.507
  154   2HB   PHE  22          1HB       PHE  22   0.633   5.634  -2.602
  155    HD1  PHE  22           1HD      PHE  22   1.453   3.380  -0.965
  156    HD2  PHE  22           2HD      PHE  22  -0.858   6.797   0.068
  157    HE1  PHE  22           1HE      PHE  22   0.351   2.089   0.816
  158    HE2  PHE  22           2HE      PHE  22  -1.964   5.514   1.852
  159    HZ   PHE  22           HZ       PHE  22  -1.360   3.158   2.226
  160    H    LYS  23           H        LYS  23   2.858   7.243  -3.714
  161    HA   LYS  23           HA       LYS  23   2.928   5.242  -5.726
  162   1HB   LYS  23          2HB       LYS  23   2.189   7.581  -6.114
  163   2HB   LYS  23          1HB       LYS  23   3.852   8.118  -5.878
  164   1HG   LYS  23          2HG       LYS  23   3.468   6.016  -7.902
  165   2HG   LYS  23          1HG       LYS  23   2.765   7.590  -8.281
  166   1HD   LYS  23          2HD       LYS  23   5.213   8.315  -7.350
  167   2HD   LYS  23          1HD       LYS  23   5.582   6.761  -8.110
  168   1HE   LYS  23          2HE       LYS  23   4.156   9.070  -9.432
  169   2HE   LYS  23          1HE       LYS  23   5.852   8.648  -9.663
  170   1HZ   LYS  23          1HZ       LYS  23   4.849   6.354 -10.312
  171   2HZ   LYS  23          2HZ       LYS  23   4.876   7.615 -11.439
  172   3HZ   LYS  23          3HZ       LYS  23   3.447   7.254 -10.609
  173    H    ALA  24           H        ALA  24   5.249   6.388  -3.540
  174    HA   ALA  24           HA       ALA  24   7.644   6.393  -4.865
  175   1HB   ALA  24          1HB       ALA  24   8.685   6.046  -2.807
  176   2HB   ALA  24          2HB       ALA  24   7.367   5.041  -2.202
  177   3HB   ALA  24          3HB       ALA  24   7.139   6.781  -2.386
  178    H    ALA  25           H        ALA  25   6.528   3.508  -3.086
  179    HA   ALA  25           HA       ALA  25   8.281   1.823  -4.623
  180   1HB   ALA  25          1HB       ALA  25   7.690   0.089  -3.138
  181   2HB   ALA  25          2HB       ALA  25   6.204   0.909  -2.656
  182   3HB   ALA  25          3HB       ALA  25   7.768   1.557  -2.164
  183    H    PHE  26           H        PHE  26   5.302   3.076  -5.315
  184    HA   PHE  26           HA       PHE  26   3.757   0.965  -6.217
  185   1HB   PHE  26          2HB       PHE  26   3.042   3.349  -6.129
  186   2HB   PHE  26          1HB       PHE  26   4.017   3.661  -7.561
  187    HD1  PHE  26           1HD      PHE  26   3.471   2.277  -9.659
  188    HD2  PHE  26           2HD      PHE  26   0.839   2.672  -6.339
  189    HE1  PHE  26           1HE      PHE  26   1.577   1.624 -11.089
  190    HE2  PHE  26           2HE      PHE  26  -1.060   2.019  -7.761
  191    HZ   PHE  26           HZ       PHE  26  -0.691   1.493 -10.139
  192    H    ASP  27           H        ASP  27   6.679   2.255  -7.557
  193    HA   ASP  27           HA       ASP  27   6.296   1.037 -10.151
  194   1HB   ASP  27          2HB       ASP  27   7.624   3.189  -9.636
  195   2HB   ASP  27          1HB       ASP  27   8.906   2.108  -9.100
  196    H    MET  28           H        MET  28   8.770   0.633  -7.605
  197    HA   MET  28           HA       MET  28   9.906  -1.702  -8.583
  198   1HB   MET  28          2HB       MET  28   9.603  -0.917  -5.679
  199   2HB   MET  28          1HB       MET  28  10.776  -2.055  -6.328
  200   1HG   MET  28          2HG       MET  28  10.774   0.675  -7.468
  201   2HG   MET  28          1HG       MET  28  11.355   0.488  -5.810
  202   1HE   MET  28          1HE       MET  28  14.671   0.870  -7.333
  203   2HE   MET  28          2HE       MET  28  14.340   0.183  -5.744
  204   3HE   MET  28          3HE       MET  28  13.337   1.495  -6.363
  205    H    PHE  29           H        PHE  29   6.932  -1.236  -6.853
  206    HA   PHE  29           HA       PHE  29   6.501  -3.789  -5.821
  207   1HB   PHE  29          2HB       PHE  29   4.790  -1.491  -6.597
  208   2HB   PHE  29          1HB       PHE  29   3.984  -3.054  -6.442
  209    HD1  PHE  29           1HD      PHE  29   5.147  -4.345  -4.218
  210    HD2  PHE  29           2HD      PHE  29   4.400  -0.192  -4.759
  211    HE1  PHE  29           1HE      PHE  29   5.042  -4.046  -1.779
  212    HE2  PHE  29           2HE      PHE  29   4.296   0.112  -2.322
  213    HZ   PHE  29           HZ       PHE  29   4.617  -1.818  -0.828
  214    H    ASP  30           H        ASP  30   4.750  -2.583  -8.664
  215    HA   ASP  30           HA       ASP  30   4.040  -5.072  -9.661
  216   1HB   ASP  30          2HB       ASP  30   4.317  -2.365 -10.940
  217   2HB   ASP  30          1HB       ASP  30   3.859  -3.777 -11.897
  218    H    ALA  31           H        ALA  31   5.205  -6.651 -10.465
  219    HA   ALA  31           HA       ALA  31   7.932  -6.180 -11.347
  220   1HB   ALA  31          1HB       ALA  31   6.442  -8.795 -11.189
  221   2HB   ALA  31          2HB       ALA  31   7.341  -8.082  -9.850
  222   3HB   ALA  31          3HB       ALA  31   8.186  -8.564 -11.320
  223    H    ASP  32           H        ASP  32   4.989  -7.687 -12.666
  224    HA   ASP  32           HA       ASP  32   6.119  -7.782 -15.325
  225   1HB   ASP  32          2HB       ASP  32   3.907  -8.724 -15.958
  226   2HB   ASP  32          1HB       ASP  32   4.668  -9.600 -14.627
  227    H    GLY  33           H        GLY  33   4.021  -5.716 -13.474
  228   1HA   GLY  33          2HA       GLY  33   3.265  -3.589 -13.937
  229   2HA   GLY  33          1HA       GLY  33   4.189  -3.642 -15.430
  230    H    GLY  34           H        GLY  34   1.097  -4.134 -13.946
  231   1HA   GLY  34          2HA       GLY  34  -0.552  -3.479 -15.928
  232   2HA   GLY  34          1HA       GLY  34  -0.100  -5.110 -16.420
  233    H    GLY  35           H        GLY  35   0.109  -5.914 -13.529
  234   1HA   GLY  35          2HA       GLY  35  -2.759  -6.431 -13.183
  235   2HA   GLY  35          1HA       GLY  35  -1.446  -7.349 -12.449
  236    H    ASP  36           H        ASP  36  -1.033  -6.978 -10.376
  237    HA   ASP  36           HA       ASP  36  -1.334  -4.365  -9.203
  238   1HB   ASP  36          2HB       ASP  36  -3.325  -6.537  -8.718
  239   2HB   ASP  36          1HB       ASP  36  -2.864  -5.505  -7.359
  240    H    ILE  37           H        ILE  37  -1.245  -4.864  -6.584
  241    HA   ILE  37           HA       ILE  37   1.297  -6.265  -6.295
  242    HB   ILE  37           HB       ILE  37  -0.186  -4.415  -4.426
  243   1HG1  ILE  37          2HG1      ILE  37   2.368  -4.064  -6.009
  244   2HG1  ILE  37          1HG1      ILE  37   0.809  -3.328  -6.390
  245   1HG2  ILE  37          1HG2      ILE  37   1.047  -6.047  -3.128
  246   2HG2  ILE  37          2HG2      ILE  37   1.823  -4.468  -3.024
  247   3HG2  ILE  37          3HG2      ILE  37   2.506  -5.719  -4.063
  248   1HD1  ILE  37          1HD1      ILE  37   0.892  -2.053  -4.330
  249   2HD1  ILE  37          2HD1      ILE  37   2.329  -1.759  -5.308
  250   3HD1  ILE  37          3HD1      ILE  37   2.422  -2.818  -3.901
  251    H    SER  38           H        SER  38   1.407  -8.249  -5.510
  252    HA   SER  38           HA       SER  38  -0.878  -9.304  -3.989
  253   1HB   SER  38          2HB       SER  38  -0.354 -11.462  -4.794
  254   2HB   SER  38          1HB       SER  38  -0.109 -10.405  -6.189
  255    HG   SER  38           HG       SER  38   1.601 -12.007  -5.656
  256    H    THR  39           H        THR  39   0.385 -11.531  -2.873
  257    HA   THR  39           HA       THR  39   1.539 -10.383  -0.551
  258    HB   THR  39           HB       THR  39   1.902 -12.726   0.159
  259    HG1  THR  39           1HG      THR  39   0.850 -13.425  -2.376
  260   1HG2  THR  39          1HG2      THR  39  -0.532 -13.538  -0.334
  261   2HG2  THR  39          2HG2      THR  39  -0.736 -11.887  -0.919
  262   3HG2  THR  39          3HG2      THR  39  -0.233 -12.177   0.746
  263    H    LYS  40           H        LYS  40   2.867 -11.778  -3.461
  264    HA   LYS  40           HA       LYS  40   5.533 -12.033  -2.416
  265   1HB   LYS  40          2HB       LYS  40   4.138 -12.653  -4.913
  266   2HB   LYS  40          1HB       LYS  40   5.777 -12.054  -5.166
  267   1HG   LYS  40          2HG       LYS  40   5.017 -14.373  -3.396
  268   2HG   LYS  40          1HG       LYS  40   5.689 -14.495  -5.028
  269   1HD   LYS  40          2HD       LYS  40   7.584 -12.986  -4.015
  270   2HD   LYS  40          1HD       LYS  40   7.002 -13.646  -2.485
  271   1HE   LYS  40          2HE       LYS  40   7.160 -15.902  -3.948
  272   2HE   LYS  40          1HE       LYS  40   8.448 -14.959  -4.697
  273   1HZ   LYS  40          1HZ       LYS  40   8.393 -15.000  -1.787
  274   2HZ   LYS  40          2HZ       LYS  40   9.711 -15.045  -2.846
  275   3HZ   LYS  40          3HZ       LYS  40   8.820 -16.450  -2.548
  276    H    GLU  41           H        GLU  41   3.800  -9.724  -4.455
  277    HA   GLU  41           HA       GLU  41   6.008  -8.126  -5.146
  278   1HB   GLU  41          2HB       GLU  41   3.080  -7.427  -4.898
  279   2HB   GLU  41          1HB       GLU  41   4.291  -6.362  -5.598
  280   1HG   GLU  41          2HG       GLU  41   4.652  -8.730  -6.962
  281   2HG   GLU  41          1HG       GLU  41   2.904  -8.627  -6.760
  282    H    LEU  42           H        LEU  42   4.150  -8.354  -2.230
  283    HA   LEU  42           HA       LEU  42   4.959  -5.787  -1.214
  284   1HB   LEU  42          2HB       LEU  42   2.982  -7.642  -0.578
  285   2HB   LEU  42          1HB       LEU  42   4.069  -7.666   0.805
  286    HG   LEU  42           HG       LEU  42   2.337  -6.077   1.249
  287   1HD1  LEU  42          1HD1      LEU  42   4.885  -4.670   0.461
  288   2HD1  LEU  42          2HD1      LEU  42   4.539  -5.428   2.017
  289   3HD1  LEU  42          3HD1      LEU  42   3.634  -4.003   1.510
  290   1HD2  LEU  42          1HD2      LEU  42   1.907  -4.162  -0.214
  291   2HD2  LEU  42          2HD2      LEU  42   1.595  -5.691  -1.037
  292   3HD2  LEU  42          3HD2      LEU  42   3.074  -4.792  -1.378
  293    H    GLY  43           H        GLY  43   5.759  -9.167  -0.415
  294   1HA   GLY  43          2HA       GLY  43   7.656  -8.630   1.563
  295   2HA   GLY  43          1HA       GLY  43   7.625 -10.080   0.562
  296    H    THR  44           H        THR  44   7.876  -8.194  -1.846
  297    HA   THR  44           HA       THR  44  10.666  -8.454  -2.169
  298    HB   THR  44           HB       THR  44   8.457  -7.157  -3.716
  299    HG1  THR  44           1HG      THR  44   8.652  -9.163  -4.361
  300   1HG2  THR  44          1HG2      THR  44  10.294  -6.772  -5.515
  301   2HG2  THR  44          2HG2      THR  44  11.358  -6.605  -4.118
  302   3HG2  THR  44          3HG2      THR  44   9.969  -5.532  -4.302
  303    H    VAL  45           H        VAL  45   8.987  -5.373  -2.554
  304    HA   VAL  45           HA       VAL  45  11.176  -3.767  -2.012
  305    HB   VAL  45           HB       VAL  45   9.292  -2.855  -3.151
  306   1HG1  VAL  45          1HG1      VAL  45   7.757  -3.549  -0.663
  307   2HG1  VAL  45          2HG1      VAL  45   7.472  -4.088  -2.317
  308   3HG1  VAL  45          3HG1      VAL  45   7.153  -2.412  -1.868
  309   1HG2  VAL  45          1HG2      VAL  45   9.043  -1.341  -0.613
  310   2HG2  VAL  45          2HG2      VAL  45   9.318  -0.765  -2.255
  311   3HG2  VAL  45          3HG2      VAL  45  10.645  -1.473  -1.336
  312    H    MET  46           H        MET  46   8.717  -4.996   0.225
  313    HA   MET  46           HA       MET  46   9.487  -3.408   2.421
  314   1HB   MET  46          2HB       MET  46   7.902  -5.920   2.099
  315   2HB   MET  46          1HB       MET  46   8.416  -5.440   3.717
  316   1HG   MET  46          2HG       MET  46   6.757  -3.801   1.810
  317   2HG   MET  46          1HG       MET  46   6.181  -4.642   3.254
  318   1HE   MET  46          1HE       MET  46   5.876  -2.732   5.636
  319   2HE   MET  46          2HE       MET  46   5.047  -2.951   4.095
  320   3HE   MET  46          3HE       MET  46   5.574  -1.341   4.590
  321    H    ARG  47           H        ARG  47  10.880  -6.267   1.052
  322    HA   ARG  47           HA       ARG  47  12.423  -6.850   3.446
  323   1HB   ARG  47          2HB       ARG  47  12.132  -8.162   0.764
  324   2HB   ARG  47          1HB       ARG  47  13.477  -8.582   1.814
  325   1HG   ARG  47          2HG       ARG  47  12.034  -9.404   3.495
  326   2HG   ARG  47          1HG       ARG  47  10.614  -8.706   2.715
  327   1HD   ARG  47          2HD       ARG  47  10.361 -10.818   1.952
  328   2HD   ARG  47          1HD       ARG  47  11.494 -10.261   0.716
  329    HE   ARG  47           HE       ARG  47  12.021 -12.134   2.865
  330   1HH1  ARG  47          1HH1      ARG  47  13.378 -10.063   0.401
  331   2HH1  ARG  47          2HH1      ARG  47  14.885 -10.912   0.344
  332   1HH2  ARG  47          1HH2      ARG  47  14.004 -13.246   2.790
  333   2HH2  ARG  47          2HH2      ARG  47  15.241 -12.718   1.699
  334    H    MET  48           H        MET  48  12.826  -5.261   0.371
  335    HA   MET  48           HA       MET  48  15.715  -5.064   0.742
  336   1HB   MET  48          2HB       MET  48  15.755  -4.071  -1.485
  337   2HB   MET  48          1HB       MET  48  14.869  -5.596  -1.498
  338   1HG   MET  48          2HG       MET  48  13.096  -4.596  -2.351
  339   2HG   MET  48          1HG       MET  48  13.038  -3.473  -0.994
  340   1HE   MET  48          1HE       MET  48  11.790  -2.231  -3.126
  341   2HE   MET  48          2HE       MET  48  12.688  -0.822  -3.697
  342   3HE   MET  48          3HE       MET  48  12.475  -1.089  -1.966
  343    H    LEU  49           H        LEU  49  13.333  -3.529   2.163
  344    HA   LEU  49           HA       LEU  49  14.552  -0.861   1.880
  345   1HB   LEU  49          2HB       LEU  49  11.729  -1.702   2.469
  346   2HB   LEU  49          1HB       LEU  49  12.308  -0.100   2.884
  347    HG   LEU  49           HG       LEU  49  12.207  -1.281   0.108
  348   1HD1  LEU  49          1HD1      LEU  49  10.588   0.905   1.409
  349   2HD1  LEU  49          2HD1      LEU  49  10.010  -0.702   0.974
  350   3HD1  LEU  49          3HD1      LEU  49  10.500   0.430  -0.287
  351   1HD2  LEU  49          1HD2      LEU  49  12.600   1.440  -0.101
  352   2HD2  LEU  49          2HD2      LEU  49  13.816   0.190  -0.355
  353   3HD2  LEU  49          3HD2      LEU  49  13.671   0.972   1.219
  354    H    GLY  50           H        GLY  50  13.206  -3.214   4.144
  355   1HA   GLY  50          2HA       GLY  50  14.997  -3.058   6.149
  356   2HA   GLY  50          1HA       GLY  50  13.994  -1.638   6.448
  357    H    GLN  51           H        GLN  51  11.542  -2.850   5.521
  358    HA   GLN  51           HA       GLN  51  10.698  -4.056   7.944
  359   1HB   GLN  51          2HB       GLN  51   9.414  -2.775   5.942
  360   2HB   GLN  51          1HB       GLN  51   9.042  -4.445   5.514
  361   1HG   GLN  51          2HG       GLN  51   7.300  -4.138   6.887
  362   2HG   GLN  51          1HG       GLN  51   8.479  -4.479   8.152
  363   1HE2  GLN  51          1HE2      GLN  51   8.059  -3.190   9.796
  364   2HE2  GLN  51          2HE2      GLN  51   7.759  -1.491   9.704
  365    H    ASN  52           H        ASN  52   9.463  -6.201   7.919
  366    HA   ASN  52           HA       ASN  52  10.649  -8.166   6.118
  367   1HB   ASN  52          2HB       ASN  52  11.780  -7.772   8.577
  368   2HB   ASN  52          1HB       ASN  52  10.632  -9.071   8.914
  369   1HD2  ASN  52          1HD2      ASN  52  11.202 -11.074   8.427
  370   2HD2  ASN  52          2HD2      ASN  52  12.562 -11.528   7.462
  371    HA   PRO  53           HA       PRO  53   6.041  -8.663   7.552
  372   1HB   PRO  53          2HB       PRO  53   5.741  -8.466   4.596
  373   2HB   PRO  53          1HB       PRO  53   4.689  -7.851   5.875
  374   1HG   PRO  53          2HG       PRO  53   6.268  -6.207   4.499
  375   2HG   PRO  53          1HG       PRO  53   6.006  -5.981   6.239
  376   1HD   PRO  53          2HD       PRO  53   8.379  -7.078   4.803
  377   2HD   PRO  53          1HD       PRO  53   8.296  -6.098   6.283
  378    H    THR  54           H        THR  54   6.202 -10.795   8.068
  379    HA   THR  54           HA       THR  54   7.320 -12.803   6.466
  380    HB   THR  54           HB       THR  54   5.126 -13.407   8.419
  381    HG1  THR  54           1HG      THR  54   6.146 -12.388   9.918
  382   1HG2  THR  54          1HG2      THR  54   5.947 -15.438   7.994
  383   2HG2  THR  54          2HG2      THR  54   7.254 -14.952   9.074
  384   3HG2  THR  54          3HG2      THR  54   7.451 -14.803   7.328
  385    H    LYS  55           H        LYS  55   6.057 -14.752   5.678
  386    HA   LYS  55           HA       LYS  55   4.395 -14.021   3.566
  387   1HB   LYS  55          2HB       LYS  55   5.710 -16.188   3.890
  388   2HB   LYS  55          1HB       LYS  55   4.345 -16.742   4.862
  389   1HG   LYS  55          2HG       LYS  55   3.939 -17.618   2.746
  390   2HG   LYS  55          1HG       LYS  55   2.905 -16.190   2.823
  391   1HD   LYS  55          2HD       LYS  55   5.551 -15.561   1.811
  392   2HD   LYS  55          1HD       LYS  55   4.751 -16.798   0.840
  393   1HE   LYS  55          2HE       LYS  55   3.762 -15.077  -0.195
  394   2HE   LYS  55          1HE       LYS  55   2.735 -14.999   1.237
  395   1HZ   LYS  55          1HZ       LYS  55   4.181 -12.950   0.312
  396   2HZ   LYS  55          2HZ       LYS  55   5.255 -13.588   1.453
  397   3HZ   LYS  55          3HZ       LYS  55   3.702 -13.113   1.927
  398    H    CYS  56           H        CYS  56   3.639 -14.760   6.881
  399    HA   CYS  56           HA       CYS  56   0.796 -15.007   6.371
  400   1HB   CYS  56          2HB       CYS  56   0.638 -15.213   8.853
  401   2HB   CYS  56          1HB       CYS  56   1.720 -16.396   8.115
  402    HG   CYS  56           HG       CYS  56   3.357 -14.090   9.054
  403    H    GLU  57           H        GLU  57   3.066 -12.617   7.557
  404    HA   GLU  57           HA       GLU  57   1.294 -10.793   8.705
  405   1HB   GLU  57          2HB       GLU  57   3.857 -10.224   7.199
  406   2HB   GLU  57          1HB       GLU  57   3.033  -9.100   8.282
  407   1HG   GLU  57          2HG       GLU  57   3.304 -11.048  10.011
  408   2HG   GLU  57          1HG       GLU  57   4.599 -11.549   8.923
  409    H    LEU  58           H        LEU  58   2.695 -10.657   5.432
  410    HA   LEU  58           HA       LEU  58   1.017  -8.590   4.523
  411   1HB   LEU  58          2HB       LEU  58   2.306 -10.693   2.791
  412   2HB   LEU  58          1HB       LEU  58   1.874  -9.046   2.343
  413    HG   LEU  58           HG       LEU  58   3.844  -9.399   4.549
  414   1HD1  LEU  58          1HD1      LEU  58   4.564  -9.733   1.639
  415   2HD1  LEU  58          2HD1      LEU  58   4.574 -11.019   2.846
  416   3HD1  LEU  58          3HD1      LEU  58   5.686  -9.659   2.998
  417   1HD2  LEU  58          1HD2      LEU  58   3.587  -7.178   4.198
  418   2HD2  LEU  58          2HD2      LEU  58   3.091  -7.387   2.519
  419   3HD2  LEU  58          3HD2      LEU  58   4.799  -7.474   2.950
  420    H    ASP  59           H        ASP  59   0.657 -12.068   4.600
  421    HA   ASP  59           HA       ASP  59  -1.555 -12.235   2.830
  422   1HB   ASP  59          2HB       ASP  59  -0.120 -14.173   3.470
  423   2HB   ASP  59          1HB       ASP  59  -0.831 -14.119   5.085
  424    H    ALA  60           H        ALA  60  -1.217 -11.346   6.154
  425    HA   ALA  60           HA       ALA  60  -3.994 -11.744   6.796
  426   1HB   ALA  60          1HB       ALA  60  -1.777 -11.604   8.326
  427   2HB   ALA  60          2HB       ALA  60  -3.409 -11.330   8.937
  428   3HB   ALA  60          3HB       ALA  60  -2.388  -9.959   8.505
  429    H    ILE  61           H        ILE  61  -1.945  -9.118   5.720
  430    HA   ILE  61           HA       ILE  61  -3.925  -7.083   6.149
  431    HB   ILE  61           HB       ILE  61  -1.244  -7.133   4.788
  432   1HG1  ILE  61          2HG1      ILE  61  -1.166  -5.124   6.587
  433   2HG1  ILE  61          1HG1      ILE  61  -2.389  -6.151   7.341
  434   1HG2  ILE  61          1HG2      ILE  61  -1.565  -4.635   4.505
  435   2HG2  ILE  61          2HG2      ILE  61  -3.289  -4.935   4.725
  436   3HG2  ILE  61          3HG2      ILE  61  -2.431  -5.675   3.375
  437   1HD1  ILE  61          1HD1      ILE  61  -0.904  -7.796   7.817
  438   2HD1  ILE  61          2HD1      ILE  61   0.192  -6.415   7.847
  439   3HD1  ILE  61          3HD1      ILE  61   0.110  -7.445   6.418
  440    H    ILE  62           H        ILE  62  -2.440  -8.499   3.219
  441    HA   ILE  62           HA       ILE  62  -3.977  -7.332   1.277
  442    HB   ILE  62           HB       ILE  62  -2.970 -10.176   1.364
  443   1HG1  ILE  62          2HG1      ILE  62  -1.876  -7.638   0.128
  444   2HG1  ILE  62          1HG1      ILE  62  -1.213  -8.496   1.522
  445   1HG2  ILE  62          1HG2      ILE  62  -4.686  -8.874  -0.556
  446   2HG2  ILE  62          2HG2      ILE  62  -4.156 -10.554  -0.480
  447   3HG2  ILE  62          3HG2      ILE  62  -3.157  -9.352  -1.295
  448   1HD1  ILE  62          1HD1      ILE  62  -0.232  -8.768  -0.916
  449   2HD1  ILE  62          2HD1      ILE  62  -1.486 -10.005  -1.009
  450   3HD1  ILE  62          3HD1      ILE  62  -0.248 -10.095   0.245
  451    H    CYS  63           H        CYS  63  -4.779 -10.227   3.173
  452    HA   CYS  63           HA       CYS  63  -7.204 -10.845   1.916
  453   1HB   CYS  63          2HB       CYS  63  -5.794 -12.116   3.752
  454   2HB   CYS  63          1HB       CYS  63  -6.879 -11.273   4.862
  455    HG   CYS  63           HG       CYS  63  -8.590 -12.643   2.883
  456    H    GLU  64           H        GLU  64  -6.391  -8.537   4.418
  457    HA   GLU  64           HA       GLU  64  -9.150  -7.861   4.962
  458   1HB   GLU  64          2HB       GLU  64  -6.489  -7.035   6.002
  459   2HB   GLU  64          1HB       GLU  64  -7.796  -5.867   6.142
  460   1HG   GLU  64          2HG       GLU  64  -9.131  -7.771   7.209
  461   2HG   GLU  64          1HG       GLU  64  -7.578  -8.591   7.366
  462    H    VAL  65           H        VAL  65  -6.474  -6.662   3.061
  463    HA   VAL  65           HA       VAL  65  -7.573  -4.132   2.405
  464    HB   VAL  65           HB       VAL  65  -5.515  -5.822   0.972
  465   1HG1  VAL  65          1HG1      VAL  65  -4.893  -3.722  -0.193
  466   2HG1  VAL  65          2HG1      VAL  65  -6.334  -2.962   0.481
  467   3HG1  VAL  65          3HG1      VAL  65  -6.494  -4.319  -0.633
  468   1HG2  VAL  65          1HG2      VAL  65  -5.320  -3.563   2.949
  469   2HG2  VAL  65          2HG2      VAL  65  -3.966  -4.055   1.930
  470   3HG2  VAL  65          3HG2      VAL  65  -4.665  -5.193   3.082
  471    H    ASP  66           H        ASP  66  -7.465  -7.230   0.663
  472    HA   ASP  66           HA       ASP  66  -9.071  -6.295  -1.505
  473   1HB   ASP  66          2HB       ASP  66  -8.113  -9.017  -0.642
  474   2HB   ASP  66          1HB       ASP  66  -9.197  -8.809  -2.015
  475    H    GLU  67           H        GLU  67 -11.178  -5.943  -1.433
  476    HA   GLU  67           HA       GLU  67 -12.794  -7.367   0.561
  477   1HB   GLU  67          2HB       GLU  67 -12.997  -4.711  -0.771
  478   2HB   GLU  67          1HB       GLU  67 -14.501  -5.521  -0.331
  479   1HG   GLU  67          2HG       GLU  67 -12.291  -5.165   1.659
  480   2HG   GLU  67          1HG       GLU  67 -13.456  -3.876   1.334
  481    H    ASP  68           H        ASP  68 -11.903  -8.509  -2.012
  482    HA   ASP  68           HA       ASP  68 -14.519  -9.393  -2.923
  483   1HB   ASP  68          2HB       ASP  68 -13.988  -9.034  -5.292
  484   2HB   ASP  68          1HB       ASP  68 -14.013  -7.511  -4.410
  485    H    GLY  69           H        GLY  69 -12.020 -10.439  -1.542
  486   1HA   GLY  69          2HA       GLY  69 -10.730 -12.340  -1.542
  487   2HA   GLY  69          1HA       GLY  69 -12.081 -13.056  -2.408
  488    H    SER  70           H        SER  70  -9.504 -10.710  -3.185
  489    HA   SER  70           HA       SER  70  -8.928 -12.318  -5.587
  490   1HB   SER  70          2HB       SER  70  -8.031 -10.015  -6.452
  491   2HB   SER  70          1HB       SER  70  -9.768 -10.345  -6.489
  492    HG   SER  70           HG       SER  70  -9.905  -9.214  -4.475
  493    H    GLY  71           H        GLY  71  -7.595 -10.393  -2.961
  494   1HA   GLY  71          2HA       GLY  71  -5.545 -10.633  -1.906
  495   2HA   GLY  71          1HA       GLY  71  -5.137 -11.895  -3.067
  496    H    THR  72           H        THR  72  -6.190  -9.215  -4.750
  497    HA   THR  72           HA       THR  72  -3.415  -8.336  -5.181
  498    HB   THR  72           HB       THR  72  -4.011  -7.760  -7.421
  499    HG1  THR  72           1HG      THR  72  -5.988  -6.952  -7.435
  500   1HG2  THR  72          1HG2      THR  72  -3.639  -9.948  -7.747
  501   2HG2  THR  72          2HG2      THR  72  -5.372  -9.976  -8.079
  502   3HG2  THR  72          3HG2      THR  72  -4.770 -10.441  -6.487
  503    H    ILE  73           H        ILE  73  -2.923  -6.159  -5.243
  504    HA   ILE  73           HA       ILE  73  -4.962  -4.398  -4.067
  505    HB   ILE  73           HB       ILE  73  -1.986  -3.937  -4.177
  506   1HG1  ILE  73          2HG1      ILE  73  -3.579  -4.937  -1.808
  507   2HG1  ILE  73          1HG1      ILE  73  -2.678  -6.006  -2.889
  508   1HG2  ILE  73          1HG2      ILE  73  -2.873  -1.868  -3.759
  509   2HG2  ILE  73          2HG2      ILE  73  -2.747  -2.490  -2.114
  510   3HG2  ILE  73          3HG2      ILE  73  -4.299  -2.520  -2.952
  511   1HD1  ILE  73          1HD1      ILE  73  -1.402  -3.726  -1.407
  512   2HD1  ILE  73          2HD1      ILE  73  -0.613  -5.071  -2.231
  513   3HD1  ILE  73          3HD1      ILE  73  -1.528  -5.359  -0.751
  514    H    ASP  74           H        ASP  74  -5.902  -2.980  -5.375
  515    HA   ASP  74           HA       ASP  74  -4.864  -2.427  -7.995
  516   1HB   ASP  74          2HB       ASP  74  -7.375  -2.476  -6.962
  517   2HB   ASP  74          1HB       ASP  74  -7.060  -0.739  -6.961
  518    H    PHE  75           H        PHE  75  -5.443   0.195  -8.463
  519    HA   PHE  75           HA       PHE  75  -3.121   1.515  -7.648
  520   1HB   PHE  75          2HB       PHE  75  -5.552   2.203  -9.147
  521   2HB   PHE  75          1HB       PHE  75  -4.810   3.575  -8.321
  522    HD1  PHE  75           1HD      PHE  75  -4.268   0.931 -10.828
  523    HD2  PHE  75           2HD      PHE  75  -2.762   4.502  -9.071
  524    HE1  PHE  75           1HE      PHE  75  -2.619   1.124 -12.644
  525    HE2  PHE  75           2HE      PHE  75  -1.110   4.702 -10.883
  526    HZ   PHE  75           HZ       PHE  75  -1.037   3.012 -12.673
  527    H    GLU  76           H        GLU  76  -6.294   2.914  -6.915
  528    HA   GLU  76           HA       GLU  76  -5.398   4.278  -4.635
  529   1HB   GLU  76          2HB       GLU  76  -8.185   3.483  -5.487
  530   2HB   GLU  76          1HB       GLU  76  -7.849   4.541  -4.124
  531   1HG   GLU  76          2HG       GLU  76  -8.203   6.108  -5.717
  532   2HG   GLU  76          1HG       GLU  76  -6.474   5.862  -5.956
  533    H    GLU  77           H        GLU  77  -6.627   1.051  -5.076
  534    HA   GLU  77           HA       GLU  77  -7.454   0.392  -2.522
  535   1HB   GLU  77          2HB       GLU  77  -6.791  -0.996  -4.922
  536   2HB   GLU  77          1HB       GLU  77  -6.016  -1.832  -3.585
  537   1HG   GLU  77          2HG       GLU  77  -8.290  -1.742  -2.437
  538   2HG   GLU  77          1HG       GLU  77  -8.930  -1.305  -4.025
  539    H    PHE  78           H        PHE  78  -4.232   0.936  -3.709
  540    HA   PHE  78           HA       PHE  78  -2.863  -0.410  -1.595
  541   1HB   PHE  78          2HB       PHE  78  -1.923   0.252  -3.890
  542   2HB   PHE  78          1HB       PHE  78  -1.732   1.874  -3.214
  543    HD1  PHE  78           1HD      PHE  78   0.311   2.399  -2.326
  544    HD2  PHE  78           2HD      PHE  78  -0.955  -1.663  -2.302
  545    HE1  PHE  78           1HE      PHE  78   2.463   1.736  -1.331
  546    HE2  PHE  78           2HE      PHE  78   1.192  -2.331  -1.307
  547    HZ   PHE  78           HZ       PHE  78   2.903  -0.629  -0.817
  548    H    LEU  79           H        LEU  79  -4.641   2.457  -1.687
  549    HA   LEU  79           HA       LEU  79  -3.143   3.681   0.509
  550   1HB   LEU  79          2HB       LEU  79  -5.491   4.646  -1.128
  551   2HB   LEU  79          1HB       LEU  79  -4.837   5.527   0.239
  552    HG   LEU  79           HG       LEU  79  -2.649   4.991  -1.455
  553   1HD1  LEU  79          1HD1      LEU  79  -3.669   6.378  -3.449
  554   2HD1  LEU  79          2HD1      LEU  79  -5.158   5.588  -2.931
  555   3HD1  LEU  79          3HD1      LEU  79  -3.765   4.618  -3.410
  556   1HD2  LEU  79          1HD2      LEU  79  -2.666   7.453  -1.727
  557   2HD2  LEU  79          2HD2      LEU  79  -2.840   6.936  -0.050
  558   3HD2  LEU  79          3HD2      LEU  79  -4.248   7.496  -0.951
  559    H    VAL  80           H        VAL  80  -6.367   2.441  -0.270
  560    HA   VAL  80           HA       VAL  80  -7.522   2.855   2.256
  561    HB   VAL  80           HB       VAL  80  -8.730   2.282   0.102
  562   1HG1  VAL  80          1HG1      VAL  80  -7.976  -0.527   0.891
  563   2HG1  VAL  80          2HG1      VAL  80  -7.421   0.337  -0.541
  564   3HG1  VAL  80          3HG1      VAL  80  -9.124  -0.081  -0.372
  565   1HG2  VAL  80          1HG2      VAL  80  -9.482   0.670   2.536
  566   2HG2  VAL  80          2HG2      VAL  80 -10.562   1.196   1.244
  567   3HG2  VAL  80          3HG2      VAL  80  -9.817   2.387   2.310
  568    H    MET  81           H        MET  81  -5.453   0.338   1.011
  569    HA   MET  81           HA       MET  81  -5.901  -1.711   2.822
  570   1HB   MET  81          2HB       MET  81  -3.340  -2.112   2.487
  571   2HB   MET  81          1HB       MET  81  -4.432  -2.294   1.125
  572   1HG   MET  81          2HG       MET  81  -3.660  -0.459   0.068
  573   2HG   MET  81          1HG       MET  81  -3.196   0.356   1.561
  574   1HE   MET  81          1HE       MET  81  -0.206  -0.412   2.659
  575   2HE   MET  81          2HE       MET  81  -0.489  -2.155   2.670
  576   3HE   MET  81          3HE       MET  81  -1.781  -1.050   3.142
  577    H    MET  82           H        MET  82  -3.862   1.143   3.111
  578    HA   MET  82           HA       MET  82  -2.963   0.455   5.756
  579   1HB   MET  82          2HB       MET  82  -2.086   2.171   3.728
  580   2HB   MET  82          1HB       MET  82  -2.598   3.240   5.033
  581   1HG   MET  82          2HG       MET  82  -1.167   1.921   6.586
  582   2HG   MET  82          1HG       MET  82  -0.569   1.023   5.192
  583   1HE   MET  82          1HE       MET  82   0.978   3.274   2.971
  584   2HE   MET  82          2HE       MET  82   0.675   1.633   3.541
  585   3HE   MET  82          3HE       MET  82   2.155   2.470   4.009
  586    H    VAL  83           H        VAL  83  -5.509   2.335   4.313
  587    HA   VAL  83           HA       VAL  83  -6.196   3.944   6.522
  588    HB   VAL  83           HB       VAL  83  -7.919   2.899   4.265
  589   1HG1  VAL  83          1HG1      VAL  83  -9.424   3.484   5.997
  590   2HG1  VAL  83          2HG1      VAL  83  -9.406   4.843   4.873
  591   3HG1  VAL  83          3HG1      VAL  83  -8.515   4.942   6.392
  592   1HG2  VAL  83          1HG2      VAL  83  -6.835   5.680   4.603
  593   2HG2  VAL  83          2HG2      VAL  83  -7.503   4.925   3.154
  594   3HG2  VAL  83          3HG2      VAL  83  -5.931   4.415   3.770
  595    H    ARG  84           H        ARG  84  -6.894   0.625   5.694
  596    HA   ARG  84           HA       ARG  84  -8.961   0.286   7.658
  597   1HB   ARG  84          2HB       ARG  84  -7.360  -1.886   6.306
  598   2HB   ARG  84          1HB       ARG  84  -8.954  -2.026   7.035
  599   1HG   ARG  84          2HG       ARG  84  -9.210  -0.027   5.102
  600   2HG   ARG  84          1HG       ARG  84  -8.222  -1.288   4.352
  601   1HD   ARG  84          2HD       ARG  84 -11.000  -1.481   5.470
  602   2HD   ARG  84          1HD       ARG  84 -10.427  -1.895   3.856
  603    HE   ARG  84           HE       ARG  84  -9.081  -3.622   5.436
  604   1HH1  ARG  84          1HH1      ARG  84 -12.462  -2.802   5.152
  605   2HH1  ARG  84          2HH1      ARG  84 -13.011  -4.375   5.625
  606   1HH2  ARG  84          1HH2      ARG  84  -9.802  -5.691   6.058
  607   2HH2  ARG  84          2HH2      ARG  84 -11.502  -6.014   6.139
  608    H    GLN  85           H        GLN  85  -5.539   0.281   7.709
  609    HA   GLN  85           HA       GLN  85  -5.512  -1.127  10.291
  610   1HB   GLN  85          2HB       GLN  85  -3.062  -0.443   8.681
  611   2HB   GLN  85          1HB       GLN  85  -3.249  -1.673   9.931
  612   1HG   GLN  85          2HG       GLN  85  -4.334  -1.723   7.125
  613   2HG   GLN  85          1HG       GLN  85  -3.100  -2.775   7.830
  614   1HE2  GLN  85          1HE2      GLN  85  -3.999  -3.791   9.996
  615   2HE2  GLN  85          2HE2      GLN  85  -5.527  -4.578   9.816
  616    H    MET  86           H        MET  86  -5.282   1.941   8.857
  617    HA   MET  86           HA       MET  86  -3.593   3.122  10.874
  618   1HB   MET  86          2HB       MET  86  -4.976   4.032   8.414
  619   2HB   MET  86          1HB       MET  86  -4.703   5.255   9.658
  620   1HG   MET  86          2HG       MET  86  -2.279   4.485   9.653
  621   2HG   MET  86          1HG       MET  86  -2.678   3.622   8.163
  622   1HE   MET  86          1HE       MET  86  -3.038   5.241   5.613
  623   2HE   MET  86          2HE       MET  86  -1.759   4.327   6.409
  624   3HE   MET  86          3HE       MET  86  -1.436   5.953   5.811
  625    H    LYS  87           H        LYS  87  -7.010   3.538   9.930
  626    HA   LYS  87           HA       LYS  87  -7.623   4.945  12.358
  627   1HB   LYS  87          2HB       LYS  87  -9.922   4.969  11.535
  628   2HB   LYS  87          1HB       LYS  87  -8.799   5.454  10.265
  629   1HG   LYS  87          2HG       LYS  87  -8.993   2.762   9.849
  630   2HG   LYS  87          1HG       LYS  87 -10.621   3.173  10.402
  631   1HD   LYS  87          2HD       LYS  87  -9.269   4.831   8.306
  632   2HD   LYS  87          1HD       LYS  87 -10.054   3.311   7.870
  633   1HE   LYS  87          2HE       LYS  87 -12.159   4.091   8.745
  634   2HE   LYS  87          1HE       LYS  87 -11.401   5.560   9.360
  635   1HZ   LYS  87          1HZ       LYS  87 -11.355   4.888   6.483
  636   2HZ   LYS  87          2HZ       LYS  87 -11.107   6.390   7.217
  637   3HZ   LYS  87          3HZ       LYS  87 -12.658   5.715   7.175
  638    H    GLU  88           H        GLU  88  -6.811   3.235  13.796
  639    HA   GLU  88           HA       GLU  88  -8.588   0.925  14.064
  640   1HB   GLU  88          2HB       GLU  88  -5.835   1.222  14.343
  641   2HB   GLU  88          1HB       GLU  88  -6.417   1.084  15.996
  642   1HG   GLU  88          2HG       GLU  88  -7.785  -0.914  14.727
  643   2HG   GLU  88          1HG       GLU  88  -6.233  -0.925  13.893
  644    H    ASP  89           H        ASP  89  -9.502   3.588  14.756
  645    HA   ASP  89           HA       ASP  89 -10.773   3.037  17.191
  646   1HB   ASP  89          2HB       ASP  89  -8.220   3.764  17.722
  647   2HB   ASP  89          1HB       ASP  89  -8.997   5.350  17.704
  648    H    ALA  90           H        ALA  90  -9.495   5.685  15.202
  649    HA   ALA  90           HA       ALA  90 -10.474   7.535  14.308
  650   1HB   ALA  90          1HB       ALA  90 -12.033   5.619  13.527
  651   2HB   ALA  90          2HB       ALA  90 -12.576   7.289  13.366
  652   3HB   ALA  90          3HB       ALA  90 -13.169   6.294  14.695
  653   2H    ARG 115          HN2       ARG 115   1.857  -3.080   9.955
  654    H    ARG 115           H        ARG 115   2.499  -1.702   9.160
  655   3H    ARG 115          HN3       ARG 115   1.645  -1.519  10.635
  656    HA   ARG 115           HA       ARG 115   0.633  -2.213   7.976
  657   1HB   ARG 115          2HB       ARG 115  -1.570  -2.548   9.234
  658   2HB   ARG 115          1HB       ARG 115  -0.388  -3.847   9.333
  659   1HG   ARG 115          2HG       ARG 115   0.352  -2.736  11.524
  660   2HG   ARG 115          1HG       ARG 115  -1.176  -1.859  11.428
  661   1HD   ARG 115          2HD       ARG 115  -2.125  -3.610  12.421
  662   2HD   ARG 115          1HD       ARG 115  -1.863  -4.501  10.923
  663    HE   ARG 115           HE       ARG 115  -0.306  -5.744  12.020
  664   1HH1  ARG 115          1HH1      ARG 115  -0.655  -2.709  13.709
  665   2HH1  ARG 115          2HH1      ARG 115   0.422  -3.155  14.990
  666   1HH2  ARG 115          1HH2      ARG 115   1.109  -6.332  13.705
  667   2HH2  ARG 115          2HH2      ARG 115   1.425  -5.211  14.987
  668    H    MET 116           H        MET 116   0.098  -0.399  11.007
  669    HA   MET 116           HA       MET 116  -1.470   1.616   9.750
  670   1HB   MET 116          2HB       MET 116  -1.753   1.182  12.107
  671   2HB   MET 116          1HB       MET 116  -0.061   1.543  12.422
  672   1HG   MET 116          2HG       MET 116  -1.128   3.815  11.158
  673   2HG   MET 116          1HG       MET 116  -2.315   3.305  12.357
  674   1HE   MET 116          1HE       MET 116  -0.749   2.164  14.816
  675   2HE   MET 116          2HE       MET 116  -2.053   3.351  14.820
  676   3HE   MET 116          3HE       MET 116  -0.566   3.672  15.713
  677    H    SER 117           H        SER 117   1.717   1.930  11.327
  678    HA   SER 117           HA       SER 117   2.269   4.300   9.759
  679   1HB   SER 117          2HB       SER 117   4.088   4.680  11.201
  680   2HB   SER 117          1HB       SER 117   2.858   3.961  12.239
  681    HG   SER 117           HG       SER 117   4.587   2.770  12.707
  682    H    ALA 118           H        ALA 118   2.033   2.421   7.939
  683    HA   ALA 118           HA       ALA 118   4.495   1.055   7.365
  684   1HB   ALA 118          1HB       ALA 118   3.152   0.954   5.027
  685   2HB   ALA 118          2HB       ALA 118   1.821   1.258   6.144
  686   3HB   ALA 118          3HB       ALA 118   2.863  -0.146   6.375
  687    H    ASP 119           H        ASP 119   3.579   4.239   7.146
  688    HA   ASP 119           HA       ASP 119   4.298   5.274   4.757
  689   1HB   ASP 119          2HB       ASP 119   3.573   6.559   6.778
  690   2HB   ASP 119          1HB       ASP 119   5.217   6.424   7.395
  691    H    ALA 120           H        ALA 120   6.453   3.778   7.057
  692    HA   ALA 120           HA       ALA 120   8.912   4.776   6.404
  693   1HB   ALA 120          1HB       ALA 120   8.036   2.002   7.116
  694   2HB   ALA 120          2HB       ALA 120   8.907   3.181   8.096
  695   3HB   ALA 120          3HB       ALA 120   9.729   2.355   6.772
  696    H    MET 121           H        MET 121   7.617   1.825   4.851
  697    HA   MET 121           HA       MET 121   9.480   1.735   2.782
  698   1HB   MET 121          2HB       MET 121   8.156  -0.194   3.119
  699   2HB   MET 121          1HB       MET 121   6.656   0.713   3.012
  700   1HG   MET 121          2HG       MET 121   8.030   1.034   0.551
  701   2HG   MET 121          1HG       MET 121   8.055  -0.678   0.968
  702   1HE   MET 121          1HE       MET 121   5.223  -0.715   2.727
  703   2HE   MET 121          2HE       MET 121   5.893  -1.990   1.709
  704   3HE   MET 121          3HE       MET 121   4.241  -1.430   1.448
  705    H    LEU 122           H        LEU 122   6.397   3.410   3.031
  706    HA   LEU 122           HA       LEU 122   6.203   4.320   0.387
  707   1HB   LEU 122          2HB       LEU 122   5.166   5.401   3.000
  708   2HB   LEU 122          1HB       LEU 122   4.837   6.200   1.477
  709    HG   LEU 122           HG       LEU 122   3.653   4.225   0.664
  710   1HD1  LEU 122          1HD1      LEU 122   3.175   2.347   2.176
  711   2HD1  LEU 122          2HD1      LEU 122   4.270   3.045   3.368
  712   3HD1  LEU 122          3HD1      LEU 122   4.898   2.488   1.818
  713   1HD2  LEU 122          1HD2      LEU 122   2.468   4.635   3.355
  714   2HD2  LEU 122          2HD2      LEU 122   1.711   4.686   1.764
  715   3HD2  LEU 122          3HD2      LEU 122   2.681   6.049   2.323
  716    H    ARG 123           H        ARG 123   8.017   5.474   3.149
  717    HA   ARG 123           HA       ARG 123   8.858   7.884   1.747
  718   1HB   ARG 123          2HB       ARG 123   8.338   7.680   4.279
  719   2HB   ARG 123          1HB       ARG 123   9.936   6.959   4.393
  720   1HG   ARG 123          2HG       ARG 123  10.783   9.051   3.211
  721   2HG   ARG 123          1HG       ARG 123   9.200   9.746   3.571
  722   1HD   ARG 123          2HD       ARG 123   9.702   8.950   5.996
  723   2HD   ARG 123          1HD       ARG 123  11.377   8.912   5.445
  724    HE   ARG 123           HE       ARG 123  11.401  11.201   5.464
  725   1HH1  ARG 123          1HH1      ARG 123   8.093  10.105   5.641
  726   2HH1  ARG 123          2HH1      ARG 123   7.454  11.684   5.948
  727   1HH2  ARG 123          1HH2      ARG 123  10.563  13.280   5.868
  728   2HH2  ARG 123          2HH2      ARG 123   8.856  13.487   6.077
  729    H    ALA 124           H        ALA 124   9.917   4.666   2.259
  730    HA   ALA 124           HA       ALA 124  12.683   4.895   2.175
  731   1HB   ALA 124          1HB       ALA 124  12.740   2.625   1.776
  732   2HB   ALA 124          2HB       ALA 124  11.304   2.660   0.750
  733   3HB   ALA 124          3HB       ALA 124  11.144   2.827   2.500
  734    H    LEU 125           H        LEU 125  10.719   3.891  -0.627
  735    HA   LEU 125           HA       LEU 125  12.811   4.727  -2.425
  736   1HB   LEU 125          2HB       LEU 125  10.069   3.690  -3.113
  737   2HB   LEU 125          1HB       LEU 125  11.474   3.748  -4.161
  738    HG   LEU 125           HG       LEU 125  11.570   2.152  -1.631
  739   1HD1  LEU 125          1HD1      LEU 125  10.138   1.470  -4.156
  740   2HD1  LEU 125          2HD1      LEU 125   9.670   1.176  -2.481
  741   3HD1  LEU 125          3HD1      LEU 125  10.940   0.206  -3.224
  742   1HD2  LEU 125          1HD2      LEU 125  13.462   1.295  -2.479
  743   2HD2  LEU 125          2HD2      LEU 125  13.444   2.727  -3.508
  744   3HD2  LEU 125          3HD2      LEU 125  12.805   1.199  -4.114
  745    H    LEU 126           H        LEU 126  10.579   6.489  -0.854
  746    HA   LEU 126           HA       LEU 126   9.076   7.990  -2.519
  747   1HB   LEU 126          2HB       LEU 126   9.657   8.245   0.024
  748   2HB   LEU 126          1HB       LEU 126  10.808   9.434  -0.554
  749    HG   LEU 126           HG       LEU 126   7.807   9.509  -0.793
  750   1HD1  LEU 126          1HD1      LEU 126   9.750  11.483   0.390
  751   2HD1  LEU 126          2HD1      LEU 126   8.882  10.262   1.321
  752   3HD1  LEU 126          3HD1      LEU 126   7.989  11.529   0.479
  753   1HD2  LEU 126          1HD2      LEU 126   8.094  11.605  -2.044
  754   2HD2  LEU 126          2HD2      LEU 126   8.723  10.215  -2.928
  755   3HD2  LEU 126          3HD2      LEU 126   9.832  11.315  -2.111
  756    H    GLY 127           H        GLY 127  12.401   9.011  -1.691
  757   1HA   GLY 127          2HA       GLY 127  12.474  10.581  -4.161
  758   2HA   GLY 127          1HA       GLY 127  13.603  10.706  -2.821
  759    H    SER 128           H        SER 128  13.905  10.275  -5.805
  760    HA   SER 128           HA       SER 128  16.006   8.295  -5.582
  761   1HB   SER 128          2HB       SER 128  14.010   6.939  -6.155
  762   2HB   SER 128          1HB       SER 128  13.781   7.920  -7.602
  763    HG   SER 128           HG       SER 128  16.187   6.533  -7.074
  764    H    LYS 129           H        LYS 129  14.128  10.236  -7.907
  765    HA   LYS 129           HA       LYS 129  16.633  11.407  -8.861
  766   1HB   LYS 129          2HB       LYS 129  15.719   9.401 -10.298
  767   2HB   LYS 129          1HB       LYS 129  14.591  10.610 -10.896
  768   1HG   LYS 129          2HG       LYS 129  16.216  10.892 -12.436
  769   2HG   LYS 129          1HG       LYS 129  16.854  11.981 -11.201
  770   1HD   LYS 129          2HD       LYS 129  18.738  10.772 -11.473
  771   2HD   LYS 129          1HD       LYS 129  17.927   9.635 -10.394
  772   1HE   LYS 129          2HE       LYS 129  16.916   8.714 -12.630
  773   2HE   LYS 129          1HE       LYS 129  18.317   9.506 -13.350
  774   1HZ   LYS 129          1HZ       LYS 129  18.843   7.835 -11.031
  775   2HZ   LYS 129          2HZ       LYS 129  19.730   8.015 -12.460
  776   3HZ   LYS 129          3HZ       LYS 129  18.362   7.020 -12.433
  777    H    HIS 130           H        HIS 130  13.179  11.461  -9.759
  778    HA   HIS 130           HA       HIS 130  13.281  14.377  -9.823
  779   1HB   HIS 130          2HB       HIS 130  12.082  12.586 -11.494
  780   2HB   HIS 130          1HB       HIS 130  10.733  13.035 -10.455
  781    HD1  HIS 130           1HD      HIS 130   9.705  15.320 -10.800
  782    HD2  HIS 130           2HD      HIS 130  13.180  14.752 -13.007
  783    HE1  HIS 130           1HE      HIS 130   9.833  17.281 -12.369
  784    HE2  HIS 130           2HE      HIS 130  11.895  16.868 -13.757
  785    H    LYS 131           H        LYS 131  12.280  15.677  -8.393
  786    HA   LYS 131           HA       LYS 131  10.928  14.379  -6.134
  787   1HB   LYS 131          2HB       LYS 131  12.050  17.180  -6.315
  788   2HB   LYS 131          1HB       LYS 131  11.426  16.397  -4.870
  789   1HG   LYS 131          2HG       LYS 131  13.326  15.263  -4.506
  790   2HG   LYS 131          1HG       LYS 131  13.583  14.940  -6.222
  791   1HD   LYS 131          2HD       LYS 131  15.281  16.403  -5.984
  792   2HD   LYS 131          1HD       LYS 131  14.004  17.611  -6.148
  793   1HE   LYS 131          2HE       LYS 131  13.854  17.136  -3.507
  794   2HE   LYS 131          1HE       LYS 131  15.564  16.799  -3.774
  795   1HZ   LYS 131          1HZ       LYS 131  14.098  19.323  -4.092
  796   2HZ   LYS 131          2HZ       LYS 131  15.467  19.049  -5.046
  797   3HZ   LYS 131          3HZ       LYS 131  15.596  19.035  -3.360
  Start of MODEL    6
    1   2H    ALA   1          HN2       ALA   1 -19.996   1.190 -13.056
    2    H    ALA   1           H        ALA   1 -21.424   1.187 -14.006
    3   3H    ALA   1          HN3       ALA   1 -20.970   2.600 -13.149
    4    HA   ALA   1           HA       ALA   1 -22.655   1.677 -11.925
    5   1HB   ALA   1          1HB       ALA   1 -22.238  -0.819 -11.166
    6   2HB   ALA   1          2HB       ALA   1 -21.352  -0.880 -12.689
    7   3HB   ALA   1          3HB       ALA   1 -23.058  -0.437 -12.680
    8    H    SER   2           H        SER   2 -22.640   1.169  -9.609
    9    HA   SER   2           HA       SER   2 -20.095   1.979  -8.415
   10   1HB   SER   2          2HB       SER   2 -21.405   2.539  -6.430
   11   2HB   SER   2          1HB       SER   2 -22.124   3.285  -7.856
   12    HG   SER   2           HG       SER   2 -23.339   1.774  -6.137
   13    H    MET   3           H        MET   3 -19.275   0.921  -6.529
   14    HA   MET   3           HA       MET   3 -20.342  -1.673  -5.815
   15   1HB   MET   3          2HB       MET   3 -17.931  -1.327  -7.505
   16   2HB   MET   3          1HB       MET   3 -17.795  -2.485  -6.189
   17   1HG   MET   3          2HG       MET   3 -19.147  -3.971  -7.179
   18   2HG   MET   3          1HG       MET   3 -20.238  -2.728  -7.791
   19   1HE   MET   3          1HE       MET   3 -20.043  -1.627 -10.203
   20   2HE   MET   3          2HE       MET   3 -18.496  -1.552 -11.048
   21   3HE   MET   3          3HE       MET   3 -18.662  -0.828  -9.449
   22    H    THR   4           H        THR   4 -17.223   0.045  -5.581
   23    HA   THR   4           HA       THR   4 -17.607   0.396  -2.724
   24    HB   THR   4           HB       THR   4 -16.590  -1.843  -2.905
   25    HG1  THR   4           1HG      THR   4 -16.009  -0.653  -1.111
   26   1HG2  THR   4          1HG2      THR   4 -14.181  -0.491  -4.084
   27   2HG2  THR   4          2HG2      THR   4 -15.334  -1.443  -5.018
   28   3HG2  THR   4          3HG2      THR   4 -14.396  -2.206  -3.734
   29    H    ASP   5           H        ASP   5 -17.055   2.418  -2.303
   30    HA   ASP   5           HA       ASP   5 -15.201   3.804  -4.084
   31   1HB   ASP   5          2HB       ASP   5 -17.143   4.781  -1.989
   32   2HB   ASP   5          1HB       ASP   5 -15.996   5.847  -2.807
   33    H    GLN   6           H        GLN   6 -14.850   2.008  -1.391
   34    HA   GLN   6           HA       GLN   6 -13.473   3.472   0.482
   35   1HB   GLN   6          2HB       GLN   6 -12.371   1.410   1.130
   36   2HB   GLN   6          1HB       GLN   6 -14.051   1.088   0.724
   37   1HG   GLN   6          2HG       GLN   6 -13.345   0.280  -1.483
   38   2HG   GLN   6          1HG       GLN   6 -11.664   0.563  -1.033
   39   1HE2  GLN   6          1HE2      GLN   6 -14.451  -0.889   0.619
   40   2HE2  GLN   6          2HE2      GLN   6 -13.664  -2.376   1.008
   41    H    GLN   7           H        GLN   7 -12.284   2.207  -2.589
   42    HA   GLN   7           HA       GLN   7  -9.551   2.799  -2.185
   43   1HB   GLN   7          2HB       GLN   7 -10.827   2.899  -4.896
   44   2HB   GLN   7          1HB       GLN   7  -9.231   2.316  -4.447
   45   1HG   GLN   7          2HG       GLN   7 -10.029   0.258  -4.460
   46   2HG   GLN   7          1HG       GLN   7 -11.047   0.678  -3.084
   47   1HE2  GLN   7          1HE2      GLN   7 -11.623  -1.199  -5.172
   48   2HE2  GLN   7          2HE2      GLN   7 -13.048  -0.645  -5.975
   49    H    ALA   8           H        ALA   8 -12.241   4.803  -2.753
   50    HA   ALA   8           HA       ALA   8 -10.678   6.966  -3.891
   51   1HB   ALA   8          1HB       ALA   8 -13.294   6.215  -4.186
   52   2HB   ALA   8          2HB       ALA   8 -12.619   7.779  -4.649
   53   3HB   ALA   8          3HB       ALA   8 -13.415   7.589  -3.087
   54    H    GLU   9           H        GLU   9 -12.644   6.384  -0.975
   55    HA   GLU   9           HA       GLU   9 -12.120   8.809   0.308
   56   1HB   GLU   9          2HB       GLU   9 -12.596   6.117   1.601
   57   2HB   GLU   9          1HB       GLU   9 -12.799   7.685   2.369
   58   1HG   GLU   9          2HG       GLU   9 -14.696   8.194   1.108
   59   2HG   GLU   9          1HG       GLU   9 -14.346   6.936  -0.084
   60    H    ALA  10           H        ALA  10 -10.393   5.734   0.394
   61    HA   ALA  10           HA       ALA  10  -8.542   6.052   2.338
   62   1HB   ALA  10          1HB       ALA  10  -6.994   4.986   0.384
   63   2HB   ALA  10          2HB       ALA  10  -8.613   4.691  -0.258
   64   3HB   ALA  10          3HB       ALA  10  -8.169   4.079   1.336
   65    H    ARG  11           H        ARG  11  -8.033   7.150  -1.023
   66    HA   ARG  11           HA       ARG  11  -5.613   8.440  -0.661
   67   1HB   ARG  11          2HB       ARG  11  -7.591   8.270  -2.697
   68   2HB   ARG  11          1HB       ARG  11  -7.185   9.970  -2.498
   69   1HG   ARG  11          2HG       ARG  11  -4.760   9.276  -2.686
   70   2HG   ARG  11          1HG       ARG  11  -5.354   7.697  -3.203
   71   1HD   ARG  11          2HD       ARG  11  -6.622   8.832  -5.015
   72   2HD   ARG  11          1HD       ARG  11  -5.870  10.353  -4.536
   73    HE   ARG  11           HE       ARG  11  -3.895   8.391  -5.037
   74   1HH1  ARG  11          1HH1      ARG  11  -6.158  10.477  -6.683
   75   2HH1  ARG  11          2HH1      ARG  11  -5.212  10.567  -8.131
   76   1HH2  ARG  11          1HH2      ARG  11  -2.650   8.508  -6.941
   77   2HH2  ARG  11          2HH2      ARG  11  -3.222   9.450  -8.278
   78    H    ALA  12           H        ALA  12  -8.824   9.460   0.201
   79    HA   ALA  12           HA       ALA  12  -7.966  12.174   0.807
   80   1HB   ALA  12          1HB       ALA  12 -10.655  10.841   1.106
   81   2HB   ALA  12          2HB       ALA  12 -10.142  11.880  -0.224
   82   3HB   ALA  12          3HB       ALA  12 -10.323  12.548   1.398
   83    H    PHE  13           H        PHE  13  -8.415   9.143   2.401
   84    HA   PHE  13           HA       PHE  13  -8.846  10.140   5.030
   85   1HB   PHE  13          2HB       PHE  13  -8.183   7.508   3.815
   86   2HB   PHE  13          1HB       PHE  13  -7.806   7.722   5.527
   87    HD1  PHE  13           1HD      PHE  13 -10.171   6.464   3.407
   88    HD2  PHE  13           2HD      PHE  13  -9.861   9.037   6.784
   89    HE1  PHE  13           1HE      PHE  13 -12.518   5.997   3.975
   90    HE2  PHE  13           2HE      PHE  13 -12.208   8.573   7.357
   91    HZ   PHE  13           HZ       PHE  13 -13.541   7.051   5.952
   92    H    LEU  14           H        LEU  14  -6.065   9.893   3.037
   93    HA   LEU  14           HA       LEU  14  -4.330  10.397   5.365
   94   1HB   LEU  14          2HB       LEU  14  -3.375   9.399   2.693
   95   2HB   LEU  14          1HB       LEU  14  -2.523   9.380   4.233
   96    HG   LEU  14           HG       LEU  14  -5.016   7.757   3.771
   97   1HD1  LEU  14          1HD1      LEU  14  -2.297   6.551   3.595
   98   2HD1  LEU  14          2HD1      LEU  14  -2.987   7.334   2.171
   99   3HD1  LEU  14          3HD1      LEU  14  -3.830   5.984   2.931
  100   1HD2  LEU  14          1HD2      LEU  14  -2.734   7.502   5.729
  101   2HD2  LEU  14          2HD2      LEU  14  -4.150   6.453   5.637
  102   3HD2  LEU  14          3HD2      LEU  14  -4.337   8.147   6.089
  103    H    SER  15           H        SER  15  -2.431  11.781   4.898
  104    HA   SER  15           HA       SER  15  -3.285  14.177   3.537
  105   1HB   SER  15          2HB       SER  15  -1.790  13.804   5.747
  106   2HB   SER  15          1HB       SER  15  -0.495  13.946   4.549
  107    HG   SER  15           HG       SER  15  -1.484  15.940   3.900
  108    H    GLU  16           H        GLU  16  -1.786  15.321   2.024
  109    HA   GLU  16           HA       GLU  16  -1.299  13.882  -0.280
  110   1HB   GLU  16          2HB       GLU  16  -0.377  16.502   0.776
  111   2HB   GLU  16          1HB       GLU  16   0.526  15.836  -0.578
  112   1HG   GLU  16          2HG       GLU  16  -1.058  17.132  -1.628
  113   2HG   GLU  16          1HG       GLU  16  -1.797  15.532  -1.669
  114    H    GLU  17           H        GLU  17   0.634  14.210   2.571
  115    HA   GLU  17           HA       GLU  17   3.137  13.409   1.592
  116   1HB   GLU  17          2HB       GLU  17   1.800  13.571   4.233
  117   2HB   GLU  17          1HB       GLU  17   3.177  12.477   4.130
  118   1HG   GLU  17          2HG       GLU  17   4.520  14.205   4.417
  119   2HG   GLU  17          1HG       GLU  17   3.980  14.845   2.866
  120    H    MET  18           H        MET  18   0.689  11.475   3.326
  121    HA   MET  18           HA       MET  18   1.917   8.994   2.972
  122   1HB   MET  18          2HB       MET  18  -0.299   9.879   4.289
  123   2HB   MET  18          1HB       MET  18  -1.032   8.976   2.964
  124   1HG   MET  18          2HG       MET  18  -0.846   7.408   4.656
  125   2HG   MET  18          1HG       MET  18   0.557   7.080   3.641
  126   1HE   MET  18          1HE       MET  18  -0.274   6.797   7.190
  127   2HE   MET  18          2HE       MET  18   1.420   6.460   7.548
  128   3HE   MET  18          3HE       MET  18   0.649   5.716   6.146
  129    H    ILE  19           H        ILE  19   0.172  10.951   0.732
  130    HA   ILE  19           HA       ILE  19  -0.477   8.783  -1.065
  131    HB   ILE  19           HB       ILE  19  -0.710  11.779  -1.289
  132   1HG1  ILE  19          2HG1      ILE  19  -2.775   9.566  -1.316
  133   2HG1  ILE  19          1HG1      ILE  19  -2.374  10.567   0.082
  134   1HG2  ILE  19          1HG2      ILE  19  -0.307  11.382  -3.503
  135   2HG2  ILE  19          2HG2      ILE  19  -2.040  11.052  -3.453
  136   3HG2  ILE  19          3HG2      ILE  19  -0.887   9.716  -3.426
  137   1HD1  ILE  19          1HD1      ILE  19  -2.968  12.360  -1.972
  138   2HD1  ILE  19          2HD1      ILE  19  -3.959  11.964  -0.568
  139   3HD1  ILE  19          3HD1      ILE  19  -4.184  11.087  -2.081
  140    H    ALA  20           H        ALA  20   1.517  11.720  -1.455
  141    HA   ALA  20           HA       ALA  20   2.855  11.024  -3.750
  142   1HB   ALA  20          1HB       ALA  20   4.673  12.524  -2.947
  143   2HB   ALA  20          2HB       ALA  20   3.858  12.596  -1.384
  144   3HB   ALA  20          3HB       ALA  20   3.058  13.222  -2.826
  145    H    GLU  21           H        GLU  21   3.286   9.783  -0.546
  146    HA   GLU  21           HA       GLU  21   5.812   8.501  -1.163
  147   1HB   GLU  21          2HB       GLU  21   4.066   8.304   1.300
  148   2HB   GLU  21          1HB       GLU  21   5.698   7.673   1.143
  149   1HG   GLU  21          2HG       GLU  21   6.651   9.795   1.133
  150   2HG   GLU  21          1HG       GLU  21   5.123  10.580   0.744
  151    H    PHE  22           H        PHE  22   2.410   7.753  -0.948
  152    HA   PHE  22           HA       PHE  22   2.564   4.947  -0.859
  153   1HB   PHE  22          2HB       PHE  22   0.354   5.262  -0.659
  154   2HB   PHE  22          1HB       PHE  22   0.526   6.940  -1.155
  155    HD1  PHE  22           1HD      PHE  22  -0.912   3.823  -1.936
  156    HD2  PHE  22           2HD      PHE  22   0.661   7.343  -3.735
  157    HE1  PHE  22           1HE      PHE  22  -2.175   3.336  -3.991
  158    HE2  PHE  22           2HE      PHE  22  -0.598   6.862  -5.790
  159    HZ   PHE  22           HZ       PHE  22  -2.018   4.855  -5.920
  160    H    LYS  23           H        LYS  23   2.761   7.257  -3.476
  161    HA   LYS  23           HA       LYS  23   2.715   5.273  -5.554
  162   1HB   LYS  23          2HB       LYS  23   1.989   7.737  -5.721
  163   2HB   LYS  23          1HB       LYS  23   3.711   8.100  -5.841
  164   1HG   LYS  23          2HG       LYS  23   3.103   7.984  -8.051
  165   2HG   LYS  23          1HG       LYS  23   3.673   6.340  -7.757
  166   1HD   LYS  23          2HD       LYS  23   1.632   5.451  -8.067
  167   2HD   LYS  23          1HD       LYS  23   0.830   6.749  -7.172
  168   1HE   LYS  23          2HE       LYS  23   0.419   7.952  -9.036
  169   2HE   LYS  23          1HE       LYS  23   1.958   7.519  -9.779
  170   1HZ   LYS  23          1HZ       LYS  23   1.041   5.368 -10.360
  171   2HZ   LYS  23          2HZ       LYS  23   0.075   6.603 -10.994
  172   3HZ   LYS  23          3HZ       LYS  23  -0.429   5.759  -9.618
  173    H    ALA  24           H        ALA  24   5.019   6.263  -3.330
  174    HA   ALA  24           HA       ALA  24   7.405   6.432  -4.693
  175   1HB   ALA  24          1HB       ALA  24   7.076   4.993  -2.068
  176   2HB   ALA  24          2HB       ALA  24   7.036   6.749  -2.234
  177   3HB   ALA  24          3HB       ALA  24   8.495   5.856  -2.662
  178    H    ALA  25           H        ALA  25   6.472   3.433  -3.013
  179    HA   ALA  25           HA       ALA  25   8.196   1.882  -4.708
  180   1HB   ALA  25          1HB       ALA  25   7.681   0.044  -3.294
  181   2HB   ALA  25          2HB       ALA  25   6.243   0.850  -2.667
  182   3HB   ALA  25          3HB       ALA  25   7.844   1.466  -2.263
  183    H    PHE  26           H        PHE  26   5.179   3.074  -5.259
  184    HA   PHE  26           HA       PHE  26   3.625   0.975  -6.156
  185   1HB   PHE  26          2HB       PHE  26   3.012   3.436  -6.013
  186   2HB   PHE  26          1HB       PHE  26   3.796   3.629  -7.578
  187    HD1  PHE  26           1HD      PHE  26   2.947   2.125  -9.489
  188    HD2  PHE  26           2HD      PHE  26   0.785   2.830  -5.893
  189    HE1  PHE  26           1HE      PHE  26   0.866   1.448 -10.613
  190    HE2  PHE  26           2HE      PHE  26  -1.301   2.154  -7.010
  191    HZ   PHE  26           HZ       PHE  26  -1.262   1.461  -9.373
  192    H    ASP  27           H        ASP  27   6.498   2.298  -7.574
  193    HA   ASP  27           HA       ASP  27   6.034   1.130 -10.175
  194   1HB   ASP  27          2HB       ASP  27   8.110   2.830  -8.925
  195   2HB   ASP  27          1HB       ASP  27   8.669   1.759 -10.207
  196    H    MET  28           H        MET  28   8.678   0.669  -7.816
  197    HA   MET  28           HA       MET  28   9.671  -1.691  -8.869
  198   1HB   MET  28          2HB       MET  28   9.974  -0.181  -6.419
  199   2HB   MET  28          1HB       MET  28  10.029  -1.909  -6.096
  200   1HG   MET  28          2HG       MET  28  12.002  -2.181  -7.134
  201   2HG   MET  28          1HG       MET  28  11.627  -0.998  -8.392
  202   1HE   MET  28          1HE       MET  28  12.012   2.314  -6.577
  203   2HE   MET  28          2HE       MET  28  11.178   1.362  -7.806
  204   3HE   MET  28          3HE       MET  28  12.867   1.817  -8.038
  205    H    PHE  29           H        PHE  29   6.843  -1.162  -6.936
  206    HA   PHE  29           HA       PHE  29   6.424  -3.678  -5.828
  207   1HB   PHE  29          2HB       PHE  29   4.740  -1.357  -6.546
  208   2HB   PHE  29          1HB       PHE  29   3.883  -2.895  -6.421
  209    HD1  PHE  29           1HD      PHE  29   5.135  -4.262  -4.240
  210    HD2  PHE  29           2HD      PHE  29   4.307  -0.111  -4.675
  211    HE1  PHE  29           1HE      PHE  29   5.060  -4.019  -1.794
  212    HE2  PHE  29           2HE      PHE  29   4.233   0.136  -2.230
  213    HZ   PHE  29           HZ       PHE  29   4.609  -1.822  -0.785
  214    H    ASP  30           H        ASP  30   4.694  -2.494  -8.705
  215    HA   ASP  30           HA       ASP  30   3.825  -4.986  -9.581
  216   1HB   ASP  30          2HB       ASP  30   4.253  -2.367 -11.003
  217   2HB   ASP  30          1HB       ASP  30   3.660  -3.794 -11.860
  218    H    ALA  31           H        ALA  31   4.904  -6.657 -10.326
  219    HA   ALA  31           HA       ALA  31   7.642  -6.352 -11.251
  220   1HB   ALA  31          1HB       ALA  31   7.810  -8.727 -11.080
  221   2HB   ALA  31          2HB       ALA  31   6.058  -8.899 -10.969
  222   3HB   ALA  31          3HB       ALA  31   6.955  -8.149  -9.649
  223    H    ASP  32           H        ASP  32   4.616  -7.785 -12.464
  224    HA   ASP  32           HA       ASP  32   5.706  -8.112 -15.113
  225   1HB   ASP  32          2HB       ASP  32   3.421  -8.911 -15.683
  226   2HB   ASP  32          1HB       ASP  32   4.122  -9.760 -14.302
  227    H    GLY  33           H        GLY  33   3.854  -5.739 -13.391
  228   1HA   GLY  33          2HA       GLY  33   3.495  -3.531 -14.048
  229   2HA   GLY  33          1HA       GLY  33   4.022  -3.953 -15.670
  230    H    GLY  34           H        GLY  34   1.489  -5.534 -13.777
  231   1HA   GLY  34          2HA       GLY  34  -0.759  -4.247 -14.693
  232   2HA   GLY  34          1HA       GLY  34  -0.341  -5.383 -15.974
  233    H    GLY  35           H        GLY  35   0.003  -5.801 -12.470
  234   1HA   GLY  35          2HA       GLY  35  -2.235  -7.681 -12.457
  235   2HA   GLY  35          1HA       GLY  35  -0.640  -8.338 -12.093
  236    H    ASP  36           H        ASP  36  -1.274  -5.099 -11.100
  237    HA   ASP  36           HA       ASP  36  -1.396  -4.129  -9.046
  238   1HB   ASP  36          2HB       ASP  36  -3.178  -6.530  -8.664
  239   2HB   ASP  36          1HB       ASP  36  -2.952  -5.320  -7.395
  240    H    ILE  37           H        ILE  37  -1.326  -4.884  -6.502
  241    HA   ILE  37           HA       ILE  37   1.224  -6.315  -6.302
  242    HB   ILE  37           HB       ILE  37  -0.140  -4.467  -4.342
  243   1HG1  ILE  37          2HG1      ILE  37   2.350  -4.077  -6.012
  244   2HG1  ILE  37          1HG1      ILE  37   0.771  -3.371  -6.365
  245   1HG2  ILE  37          1HG2      ILE  37   1.302  -5.047  -2.757
  246   2HG2  ILE  37          2HG2      ILE  37   2.669  -5.008  -3.872
  247   3HG2  ILE  37          3HG2      ILE  37   1.676  -6.458  -3.745
  248   1HD1  ILE  37          1HD1      ILE  37   2.355  -2.849  -3.861
  249   2HD1  ILE  37          2HD1      ILE  37   0.861  -2.055  -4.362
  250   3HD1  ILE  37          3HD1      ILE  37   2.344  -1.807  -5.284
  251    H    SER  38           H        SER  38   1.376  -8.227  -5.329
  252    HA   SER  38           HA       SER  38  -0.982  -9.250  -3.894
  253   1HB   SER  38          2HB       SER  38  -0.076 -10.359  -6.095
  254   2HB   SER  38          1HB       SER  38   1.140 -11.051  -5.014
  255    HG   SER  38           HG       SER  38  -1.636 -11.226  -4.491
  256    H    THR  39           H        THR  39   0.235 -11.488  -2.740
  257    HA   THR  39           HA       THR  39   1.389 -10.320  -0.421
  258    HB   THR  39           HB       THR  39   1.670 -12.676   0.330
  259    HG1  THR  39           1HG      THR  39   2.015 -13.439  -1.907
  260   1HG2  THR  39          1HG2      THR  39  -0.856 -13.323  -0.237
  261   2HG2  THR  39          2HG2      THR  39  -0.904 -11.602  -0.618
  262   3HG2  THR  39          3HG2      THR  39  -0.413 -12.135   0.989
  263    H    LYS  40           H        LYS  40   2.703 -11.627  -3.340
  264    HA   LYS  40           HA       LYS  40   5.347 -12.016  -2.219
  265   1HB   LYS  40          2HB       LYS  40   4.134 -13.312  -4.184
  266   2HB   LYS  40          1HB       LYS  40   4.845 -12.027  -5.161
  267   1HG   LYS  40          2HG       LYS  40   6.715 -13.272  -3.285
  268   2HG   LYS  40          1HG       LYS  40   6.065 -14.374  -4.506
  269   1HD   LYS  40          2HD       LYS  40   6.649 -12.157  -5.994
  270   2HD   LYS  40          1HD       LYS  40   7.936 -12.133  -4.787
  271   1HE   LYS  40          2HE       LYS  40   8.746 -13.399  -6.621
  272   2HE   LYS  40          1HE       LYS  40   8.354 -14.550  -5.344
  273   1HZ   LYS  40          1HZ       LYS  40   6.493 -15.292  -6.471
  274   2HZ   LYS  40          2HZ       LYS  40   7.597 -15.048  -7.728
  275   3HZ   LYS  40          3HZ       LYS  40   6.381 -13.909  -7.438
  276    H    GLU  41           H        GLU  41   3.673  -9.708  -4.291
  277    HA   GLU  41           HA       GLU  41   5.935  -8.227  -5.085
  278   1HB   GLU  41          2HB       GLU  41   3.049  -7.387  -4.809
  279   2HB   GLU  41          1HB       GLU  41   4.292  -6.418  -5.586
  280   1HG   GLU  41          2HG       GLU  41   4.559  -8.777  -6.901
  281   2HG   GLU  41          1HG       GLU  41   2.828  -8.755  -6.569
  282    H    LEU  42           H        LEU  42   4.316  -8.411  -2.073
  283    HA   LEU  42           HA       LEU  42   5.085  -5.784  -1.177
  284   1HB   LEU  42          2HB       LEU  42   3.295  -7.786  -0.310
  285   2HB   LEU  42          1HB       LEU  42   4.454  -7.548   0.993
  286    HG   LEU  42           HG       LEU  42   2.468  -6.135   1.267
  287   1HD1  LEU  42          1HD1      LEU  42   4.996  -4.618   0.632
  288   2HD1  LEU  42          2HD1      LEU  42   4.564  -5.347   2.180
  289   3HD1  LEU  42          3HD1      LEU  42   3.633  -3.985   1.557
  290   1HD2  LEU  42          1HD2      LEU  42   2.463  -5.882  -1.416
  291   2HD2  LEU  42          2HD2      LEU  42   3.203  -4.349  -0.955
  292   3HD2  LEU  42          3HD2      LEU  42   1.615  -4.787  -0.324
  293    H    GLY  43           H        GLY  43   6.001  -9.089  -0.177
  294   1HA   GLY  43          2HA       GLY  43   8.020  -8.486   1.585
  295   2HA   GLY  43          1HA       GLY  43   8.021  -9.916   0.554
  296    H    THR  44           H        THR  44   8.082  -8.182  -1.879
  297    HA   THR  44           HA       THR  44  10.835  -8.199  -2.338
  298    HB   THR  44           HB       THR  44   8.476  -6.994  -3.730
  299    HG1  THR  44           1HG      THR  44   9.162  -9.225  -3.954
  300   1HG2  THR  44          1HG2      THR  44  10.171  -6.494  -5.631
  301   2HG2  THR  44          2HG2      THR  44  11.317  -6.303  -4.303
  302   3HG2  THR  44          3HG2      THR  44   9.873  -5.292  -4.374
  303    H    VAL  45           H        VAL  45   8.990  -5.197  -2.577
  304    HA   VAL  45           HA       VAL  45  11.154  -3.517  -2.055
  305    HB   VAL  45           HB       VAL  45   9.196  -2.708  -3.203
  306   1HG1  VAL  45          1HG1      VAL  45   7.121  -2.226  -1.775
  307   2HG1  VAL  45          2HG1      VAL  45   7.793  -3.404  -0.646
  308   3HG1  VAL  45          3HG1      VAL  45   7.403  -3.887  -2.298
  309   1HG2  VAL  45          1HG2      VAL  45  10.586  -1.284  -1.364
  310   2HG2  VAL  45          2HG2      VAL  45   8.935  -1.048  -0.789
  311   3HG2  VAL  45          3HG2      VAL  45   9.368  -0.597  -2.438
  312    H    MET  46           H        MET  46   8.840  -4.998   0.134
  313    HA   MET  46           HA       MET  46   9.421  -3.363   2.372
  314   1HB   MET  46          2HB       MET  46   8.022  -5.960   1.942
  315   2HB   MET  46          1HB       MET  46   8.503  -5.540   3.586
  316   1HG   MET  46          2HG       MET  46   6.732  -3.923   1.764
  317   2HG   MET  46          1HG       MET  46   6.223  -4.866   3.170
  318   1HE   MET  46          1HE       MET  46   4.931  -3.113   3.877
  319   2HE   MET  46          2HE       MET  46   5.423  -1.551   4.531
  320   3HE   MET  46          3HE       MET  46   5.626  -3.017   5.495
  321    H    ARG  47           H        ARG  47  10.904  -6.269   1.090
  322    HA   ARG  47           HA       ARG  47  12.508  -6.694   3.458
  323   1HB   ARG  47          2HB       ARG  47  12.391  -8.018   0.759
  324   2HB   ARG  47          1HB       ARG  47  13.646  -8.409   1.925
  325   1HG   ARG  47          2HG       ARG  47  12.026  -9.185   3.508
  326   2HG   ARG  47          1HG       ARG  47  10.698  -8.630   2.486
  327   1HD   ARG  47          2HD       ARG  47  10.842 -10.952   2.128
  328   2HD   ARG  47          1HD       ARG  47  11.593 -10.209   0.713
  329    HE   ARG  47           HE       ARG  47  12.908 -11.763   2.785
  330   1HH1  ARG  47          1HH1      ARG  47  13.271  -9.655   0.022
  331   2HH1  ARG  47          2HH1      ARG  47  14.900 -10.146  -0.291
  332   1HH2  ARG  47          1HH2      ARG  47  15.051 -12.404   2.371
  333   2HH2  ARG  47          2HH2      ARG  47  15.910 -11.705   1.039
  334    H    MET  48           H        MET  48  12.853  -5.090   0.383
  335    HA   MET  48           HA       MET  48  15.728  -4.764   0.771
  336   1HB   MET  48          2HB       MET  48  15.715  -3.737  -1.457
  337   2HB   MET  48          1HB       MET  48  14.958  -5.330  -1.472
  338   1HG   MET  48          2HG       MET  48  13.026  -4.513  -2.194
  339   2HG   MET  48          1HG       MET  48  13.035  -3.217  -0.999
  340   1HE   MET  48          1HE       MET  48  12.482  -1.067  -1.942
  341   2HE   MET  48          2HE       MET  48  11.683  -1.981  -3.220
  342   3HE   MET  48          3HE       MET  48  12.705  -0.603  -3.628
  343    H    LEU  49           H        LEU  49  13.276  -3.331   2.183
  344    HA   LEU  49           HA       LEU  49  14.417  -0.626   1.930
  345   1HB   LEU  49          2HB       LEU  49  11.593  -1.547   2.330
  346   2HB   LEU  49          1HB       LEU  49  12.091   0.049   2.857
  347    HG   LEU  49           HG       LEU  49  12.188  -1.005   0.031
  348   1HD1  LEU  49          1HD1      LEU  49  10.490   0.685  -0.404
  349   2HD1  LEU  49          2HD1      LEU  49  10.494   1.141   1.300
  350   3HD1  LEU  49          3HD1      LEU  49   9.942  -0.462   0.818
  351   1HD2  LEU  49          1HD2      LEU  49  12.680   1.532  -0.346
  352   2HD2  LEU  49          2HD2      LEU  49  13.989   0.424   0.060
  353   3HD2  LEU  49          3HD2      LEU  49  13.290   1.457   1.306
  354    H    GLY  50           H        GLY  50  13.005  -2.999   4.145
  355   1HA   GLY  50          2HA       GLY  50  14.728  -2.742   6.223
  356   2HA   GLY  50          1HA       GLY  50  13.614  -1.400   6.474
  357    H    GLN  51           H        GLN  51  11.282  -2.756   5.479
  358    HA   GLN  51           HA       GLN  51  10.460  -4.045   7.867
  359   1HB   GLN  51          2HB       GLN  51   9.169  -2.863   5.757
  360   2HB   GLN  51          1HB       GLN  51   8.835  -4.571   5.470
  361   1HG   GLN  51          2HG       GLN  51   7.044  -3.832   6.759
  362   2HG   GLN  51          1HG       GLN  51   8.096  -4.656   7.909
  363   1HE2  GLN  51          1HE2      GLN  51   8.537  -3.617   9.714
  364   2HE2  GLN  51          2HE2      GLN  51   8.398  -1.915   9.969
  365    H    ASN  52           H        ASN  52   9.492  -6.256   7.923
  366    HA   ASN  52           HA       ASN  52  10.714  -8.145   6.064
  367   1HB   ASN  52          2HB       ASN  52  12.007  -7.640   8.388
  368   2HB   ASN  52          1HB       ASN  52  10.930  -8.943   8.901
  369   1HD2  ASN  52          1HD2      ASN  52  12.516 -10.455   9.165
  370   2HD2  ASN  52          2HD2      ASN  52  13.414 -11.129   7.852
  371    HA   PRO  53           HA       PRO  53   6.453  -9.319   7.770
  372   1HB   PRO  53          2HB       PRO  53   4.826  -8.478   5.813
  373   2HB   PRO  53          1HB       PRO  53   5.346  -7.392   7.107
  374   1HG   PRO  53          2HG       PRO  53   6.395  -7.645   4.312
  375   2HG   PRO  53          1HG       PRO  53   6.033  -6.178   5.241
  376   1HD   PRO  53          2HD       PRO  53   8.552  -7.204   4.958
  377   2HD   PRO  53          1HD       PRO  53   8.032  -6.246   6.363
  378    H    THR  54           H        THR  54   6.742 -11.476   7.455
  379    HA   THR  54           HA       THR  54   7.456 -12.710   5.042
  380    HB   THR  54           HB       THR  54   7.721 -13.817   7.203
  381    HG1  THR  54           1HG      THR  54   7.484 -15.131   5.346
  382   1HG2  THR  54          1HG2      THR  54   4.934 -14.675   7.431
  383   2HG2  THR  54          2HG2      THR  54   5.230 -12.988   7.845
  384   3HG2  THR  54          3HG2      THR  54   6.110 -14.266   8.680
  385    H    LYS  55           H        LYS  55   5.904 -14.593   4.207
  386    HA   LYS  55           HA       LYS  55   3.928 -13.375   2.673
  387   1HB   LYS  55          2HB       LYS  55   4.807 -16.127   3.215
  388   2HB   LYS  55          1HB       LYS  55   3.116 -15.992   2.733
  389   1HG   LYS  55          2HG       LYS  55   4.295 -14.398   0.892
  390   2HG   LYS  55          1HG       LYS  55   5.570 -15.587   1.172
  391   1HD   LYS  55          2HD       LYS  55   4.417 -17.233   0.164
  392   2HD   LYS  55          1HD       LYS  55   2.888 -16.737   0.891
  393   1HE   LYS  55          2HE       LYS  55   2.776 -14.876  -0.748
  394   2HE   LYS  55          1HE       LYS  55   4.230 -15.512  -1.515
  395   1HZ   LYS  55          1HZ       LYS  55   1.507 -16.603  -1.501
  396   2HZ   LYS  55          2HZ       LYS  55   2.806 -17.683  -1.602
  397   3HZ   LYS  55          3HZ       LYS  55   2.612 -16.481  -2.777
  398    H    CYS  56           H        CYS  56   3.749 -14.862   5.835
  399    HA   CYS  56           HA       CYS  56   0.894 -14.953   5.950
  400   1HB   CYS  56          2HB       CYS  56   2.729 -16.235   7.358
  401   2HB   CYS  56          1HB       CYS  56   2.567 -14.840   8.426
  402    HG   CYS  56           HG       CYS  56   0.210 -16.772   7.787
  403    H    GLU  57           H        GLU  57   3.368 -12.736   7.191
  404    HA   GLU  57           HA       GLU  57   1.721 -11.022   8.641
  405   1HB   GLU  57          2HB       GLU  57   4.242 -10.404   7.088
  406   2HB   GLU  57          1HB       GLU  57   3.490  -9.307   8.246
  407   1HG   GLU  57          2HG       GLU  57   4.114 -12.038   9.196
  408   2HG   GLU  57          1HG       GLU  57   5.474 -10.959   8.891
  409    H    LEU  58           H        LEU  58   2.656 -10.910   5.227
  410    HA   LEU  58           HA       LEU  58   1.068  -8.573   4.701
  411   1HB   LEU  58          2HB       LEU  58   2.173 -10.440   2.619
  412   2HB   LEU  58          1HB       LEU  58   1.848  -8.716   2.482
  413    HG   LEU  58           HG       LEU  58   3.894  -9.566   4.472
  414   1HD1  LEU  58          1HD1      LEU  58   4.761 -10.904   2.811
  415   2HD1  LEU  58          2HD1      LEU  58   5.553  -9.364   2.475
  416   3HD1  LEU  58          3HD1      LEU  58   4.162  -9.869   1.514
  417   1HD2  LEU  58          1HD2      LEU  58   3.889  -7.317   4.497
  418   2HD2  LEU  58          2HD2      LEU  58   3.159  -7.196   2.897
  419   3HD2  LEU  58          3HD2      LEU  58   4.893  -7.480   3.055
  420    H    ASP  59           H        ASP  59   0.546 -11.983   4.714
  421    HA   ASP  59           HA       ASP  59  -1.664 -12.035   2.912
  422   1HB   ASP  59          2HB       ASP  59  -0.334 -13.932   4.741
  423   2HB   ASP  59          1HB       ASP  59  -2.055 -14.227   4.474
  424    H    ALA  60           H        ALA  60  -1.283 -11.331   6.291
  425    HA   ALA  60           HA       ALA  60  -4.059 -11.646   6.927
  426   1HB   ALA  60          1HB       ALA  60  -3.149 -10.138   8.956
  427   2HB   ALA  60          2HB       ALA  60  -1.623 -10.794   8.363
  428   3HB   ALA  60          3HB       ALA  60  -2.916 -11.884   8.865
  429    H    ILE  61           H        ILE  61  -1.994  -9.043   5.848
  430    HA   ILE  61           HA       ILE  61  -3.944  -6.990   6.367
  431    HB   ILE  61           HB       ILE  61  -1.260  -7.036   5.016
  432   1HG1  ILE  61          2HG1      ILE  61  -1.232  -5.013   6.824
  433   2HG1  ILE  61          1HG1      ILE  61  -2.426  -6.085   7.562
  434   1HG2  ILE  61          1HG2      ILE  61  -2.503  -5.583   3.599
  435   2HG2  ILE  61          2HG2      ILE  61  -1.525  -4.573   4.664
  436   3HG2  ILE  61          3HG2      ILE  61  -3.248  -4.776   4.979
  437   1HD1  ILE  61          1HD1      ILE  61  -0.893  -7.771   7.899
  438   2HD1  ILE  61          2HD1      ILE  61   0.072  -6.321   8.183
  439   3HD1  ILE  61          3HD1      ILE  61   0.196  -7.176   6.645
  440    H    ILE  62           H        ILE  62  -2.467  -8.276   3.371
  441    HA   ILE  62           HA       ILE  62  -4.009  -7.064   1.480
  442    HB   ILE  62           HB       ILE  62  -3.017  -9.913   1.483
  443   1HG1  ILE  62          2HG1      ILE  62  -1.946  -7.353   0.274
  444   2HG1  ILE  62          1HG1      ILE  62  -1.259  -8.236   1.641
  445   1HG2  ILE  62          1HG2      ILE  62  -3.240  -9.088  -1.155
  446   2HG2  ILE  62          2HG2      ILE  62  -4.739  -8.543  -0.404
  447   3HG2  ILE  62          3HG2      ILE  62  -4.281 -10.243  -0.324
  448   1HD1  ILE  62          1HD1      ILE  62  -1.570  -9.597  -0.991
  449   2HD1  ILE  62          2HD1      ILE  62  -0.412  -9.898   0.305
  450   3HD1  ILE  62          3HD1      ILE  62  -0.231  -8.480  -0.727
  451    H    CYS  63           H        CYS  63  -4.829 -10.067   3.209
  452    HA   CYS  63           HA       CYS  63  -7.230 -10.661   1.969
  453   1HB   CYS  63          2HB       CYS  63  -5.902 -11.905   3.856
  454   2HB   CYS  63          1HB       CYS  63  -6.950 -10.988   4.941
  455    HG   CYS  63           HG       CYS  63  -8.740 -12.588   4.498
  456    H    GLU  64           H        GLU  64  -6.504  -8.272   4.418
  457    HA   GLU  64           HA       GLU  64  -9.285  -7.573   4.820
  458   1HB   GLU  64          2HB       GLU  64  -6.822  -6.093   5.761
  459   2HB   GLU  64          1HB       GLU  64  -8.461  -5.916   6.371
  460   1HG   GLU  64          2HG       GLU  64  -7.283  -8.619   6.511
  461   2HG   GLU  64          1HG       GLU  64  -6.598  -7.394   7.578
  462    H    VAL  65           H        VAL  65  -6.508  -6.460   3.017
  463    HA   VAL  65           HA       VAL  65  -7.478  -3.923   2.251
  464    HB   VAL  65           HB       VAL  65  -5.629  -5.709   0.664
  465   1HG1  VAL  65          1HG1      VAL  65  -6.462  -3.819  -0.603
  466   2HG1  VAL  65          2HG1      VAL  65  -4.756  -3.589  -0.219
  467   3HG1  VAL  65          3HG1      VAL  65  -5.991  -2.717   0.689
  468   1HG2  VAL  65          1HG2      VAL  65  -5.116  -3.944   3.029
  469   2HG2  VAL  65          2HG2      VAL  65  -3.852  -4.251   1.838
  470   3HG2  VAL  65          3HG2      VAL  65  -4.569  -5.590   2.728
  471    H    ASP  66           H        ASP  66  -7.522  -7.062   0.593
  472    HA   ASP  66           HA       ASP  66  -9.039  -6.143  -1.625
  473   1HB   ASP  66          2HB       ASP  66  -8.228  -8.837  -0.583
  474   2HB   ASP  66          1HB       ASP  66  -9.399  -8.715  -1.894
  475    H    GLU  67           H        GLU  67 -11.000  -5.298  -1.231
  476    HA   GLU  67           HA       GLU  67 -12.771  -6.273   0.777
  477   1HB   GLU  67          2HB       GLU  67 -14.399  -4.708  -0.204
  478   2HB   GLU  67          1HB       GLU  67 -12.835  -3.940   0.068
  479   1HG   GLU  67          2HG       GLU  67 -13.260  -5.120  -2.602
  480   2HG   GLU  67          1HG       GLU  67 -14.241  -3.704  -2.202
  481    H    ASP  68           H        ASP  68 -12.222  -7.021  -2.563
  482    HA   ASP  68           HA       ASP  68 -14.726  -8.494  -2.791
  483   1HB   ASP  68          2HB       ASP  68 -14.086  -8.829  -5.130
  484   2HB   ASP  68          1HB       ASP  68 -13.992  -7.126  -4.697
  485    H    GLY  69           H        GLY  69 -11.337  -9.038  -2.258
  486   1HA   GLY  69          2HA       GLY  69 -10.455 -11.011  -1.320
  487   2HA   GLY  69          1HA       GLY  69 -11.891 -11.877  -1.848
  488    H    SER  70           H        SER  70  -9.341  -9.959  -3.436
  489    HA   SER  70           HA       SER  70  -9.075 -12.131  -5.410
  490   1HB   SER  70          2HB       SER  70  -7.882  -9.972  -6.592
  491   2HB   SER  70          1HB       SER  70  -9.569 -10.444  -6.839
  492    HG   SER  70           HG       SER  70  -9.660  -8.347  -6.237
  493    H    GLY  71           H        GLY  71  -7.476 -10.428  -2.927
  494   1HA   GLY  71          2HA       GLY  71  -5.372 -10.764  -2.032
  495   2HA   GLY  71          1HA       GLY  71  -5.091 -11.982  -3.274
  496    H    THR  72           H        THR  72  -6.120  -9.201  -4.779
  497    HA   THR  72           HA       THR  72  -3.346  -8.348  -5.273
  498    HB   THR  72           HB       THR  72  -4.296  -7.511  -7.481
  499    HG1  THR  72           1HG      THR  72  -6.356  -7.698  -7.707
  500   1HG2  THR  72          1HG2      THR  72  -3.755 -10.275  -6.730
  501   2HG2  THR  72          2HG2      THR  72  -3.157  -9.324  -8.091
  502   3HG2  THR  72          3HG2      THR  72  -4.738 -10.101  -8.184
  503    H    ILE  73           H        ILE  73  -2.837  -6.211  -5.135
  504    HA   ILE  73           HA       ILE  73  -4.900  -4.466  -4.002
  505    HB   ILE  73           HB       ILE  73  -1.932  -3.965  -4.149
  506   1HG1  ILE  73          2HG1      ILE  73  -3.479  -4.994  -1.763
  507   2HG1  ILE  73          1HG1      ILE  73  -2.595  -6.052  -2.866
  508   1HG2  ILE  73          1HG2      ILE  73  -3.155  -1.941  -3.814
  509   2HG2  ILE  73          2HG2      ILE  73  -2.455  -2.404  -2.263
  510   3HG2  ILE  73          3HG2      ILE  73  -4.167  -2.690  -2.579
  511   1HD1  ILE  73          1HD1      ILE  73  -0.578  -5.421  -2.064
  512   2HD1  ILE  73          2HD1      ILE  73  -1.543  -5.107  -0.621
  513   3HD1  ILE  73          3HD1      ILE  73  -1.108  -3.779  -1.699
  514    H    ASP  74           H        ASP  74  -5.961  -3.275  -5.448
  515    HA   ASP  74           HA       ASP  74  -5.050  -2.648  -8.032
  516   1HB   ASP  74          2HB       ASP  74  -7.389  -2.091  -6.398
  517   2HB   ASP  74          1HB       ASP  74  -6.945  -0.698  -7.388
  518    H    PHE  75           H        PHE  75  -5.453  -0.005  -8.500
  519    HA   PHE  75           HA       PHE  75  -2.986   1.146  -7.849
  520   1HB   PHE  75          2HB       PHE  75  -5.531   2.184  -9.036
  521   2HB   PHE  75          1HB       PHE  75  -4.263   3.326  -8.581
  522    HD1  PHE  75           1HD      PHE  75  -4.175  -0.059 -10.152
  523    HD2  PHE  75           2HD      PHE  75  -3.201   4.072 -10.473
  524    HE1  PHE  75           1HE      PHE  75  -3.022  -0.499 -12.281
  525    HE2  PHE  75           2HE      PHE  75  -2.047   3.639 -12.602
  526    HZ   PHE  75           HZ       PHE  75  -1.957   1.351 -13.509
  527    H    GLU  76           H        GLU  76  -6.047   2.710  -6.966
  528    HA   GLU  76           HA       GLU  76  -4.914   4.064  -4.762
  529   1HB   GLU  76          2HB       GLU  76  -7.846   3.513  -5.220
  530   2HB   GLU  76          1HB       GLU  76  -7.146   4.820  -4.274
  531   1HG   GLU  76          2HG       GLU  76  -6.129   4.900  -6.952
  532   2HG   GLU  76          1HG       GLU  76  -7.891   4.850  -6.974
  533    H    GLU  77           H        GLU  77  -6.178   0.889  -5.108
  534    HA   GLU  77           HA       GLU  77  -7.158   0.353  -2.570
  535   1HB   GLU  77          2HB       GLU  77  -6.246  -1.190  -4.853
  536   2HB   GLU  77          1HB       GLU  77  -5.860  -1.991  -3.336
  537   1HG   GLU  77          2HG       GLU  77  -8.231  -1.741  -2.659
  538   2HG   GLU  77          1HG       GLU  77  -8.576  -1.088  -4.266
  539    H    PHE  78           H        PHE  78  -3.900   0.906  -3.578
  540    HA   PHE  78           HA       PHE  78  -2.621  -0.441  -1.414
  541   1HB   PHE  78          2HB       PHE  78  -1.570   0.300  -3.640
  542   2HB   PHE  78          1HB       PHE  78  -1.446   1.901  -2.905
  543    HD1  PHE  78           1HD      PHE  78  -0.258  -1.564  -2.786
  544    HD2  PHE  78           2HD      PHE  78   0.131   2.347  -1.156
  545    HE1  PHE  78           1HE      PHE  78   1.845  -2.231  -1.696
  546    HE2  PHE  78           2HE      PHE  78   2.235   1.689  -0.066
  547    HZ   PHE  78           HZ       PHE  78   3.095  -0.604  -0.334
  548    H    LEU  79           H        LEU  79  -4.511   2.332  -1.511
  549    HA   LEU  79           HA       LEU  79  -3.146   3.606   0.739
  550   1HB   LEU  79          2HB       LEU  79  -5.473   4.447  -0.986
  551   2HB   LEU  79          1HB       LEU  79  -4.984   5.331   0.446
  552    HG   LEU  79           HG       LEU  79  -2.678   4.962  -1.190
  553   1HD1  LEU  79          1HD1      LEU  79  -5.156   5.800  -2.641
  554   2HD1  LEU  79          2HD1      LEU  79  -3.872   4.707  -3.159
  555   3HD1  LEU  79          3HD1      LEU  79  -3.579   6.446  -3.099
  556   1HD2  LEU  79          1HD2      LEU  79  -4.249   7.156   0.002
  557   2HD2  LEU  79          2HD2      LEU  79  -3.216   7.585  -1.362
  558   3HD2  LEU  79          3HD2      LEU  79  -2.518   6.829   0.069
  559    H    VAL  80           H        VAL  80  -6.170   2.019  -0.129
  560    HA   VAL  80           HA       VAL  80  -7.482   2.372   2.352
  561    HB   VAL  80           HB       VAL  80  -7.885   0.126   0.371
  562   1HG1  VAL  80          1HG1      VAL  80  -9.500   1.180   2.668
  563   2HG1  VAL  80          2HG1      VAL  80  -9.026  -0.481   2.315
  564   3HG1  VAL  80          3HG1      VAL  80 -10.260   0.311   1.334
  565   1HG2  VAL  80          1HG2      VAL  80  -9.520   1.476  -0.713
  566   2HG2  VAL  80          2HG2      VAL  80  -8.038   2.426  -0.608
  567   3HG2  VAL  80          3HG2      VAL  80  -9.368   2.741   0.505
  568    H    MET  81           H        MET  81  -5.199   0.014   1.144
  569    HA   MET  81           HA       MET  81  -5.496  -2.043   2.966
  570   1HB   MET  81          2HB       MET  81  -2.915  -2.241   2.638
  571   2HB   MET  81          1HB       MET  81  -3.983  -2.506   1.273
  572   1HG   MET  81          2HG       MET  81  -3.383  -0.588   0.231
  573   2HG   MET  81          1HG       MET  81  -2.934   0.225   1.731
  574   1HE   MET  81          1HE       MET  81   0.318  -1.087   2.750
  575   2HE   MET  81          2HE       MET  81  -0.595  -2.596   2.659
  576   3HE   MET  81          3HE       MET  81  -1.375  -1.129   3.250
  577    H    MET  82           H        MET  82  -3.725   0.976   3.250
  578    HA   MET  82           HA       MET  82  -2.833   0.380   5.936
  579   1HB   MET  82          2HB       MET  82  -1.937   2.045   3.879
  580   2HB   MET  82          1HB       MET  82  -2.539   3.151   5.113
  581   1HG   MET  82          2HG       MET  82  -1.087   2.150   6.767
  582   2HG   MET  82          1HG       MET  82  -0.537   0.955   5.595
  583   1HE   MET  82          1HE       MET  82   1.594   2.513   3.203
  584   2HE   MET  82          2HE       MET  82   0.157   3.474   2.859
  585   3HE   MET  82          3HE       MET  82  -0.001   1.765   3.266
  586    H    VAL  83           H        VAL  83  -5.366   2.181   4.341
  587    HA   VAL  83           HA       VAL  83  -6.172   3.812   6.490
  588    HB   VAL  83           HB       VAL  83  -7.852   2.686   4.241
  589   1HG1  VAL  83          1HG1      VAL  83  -8.380   4.933   6.174
  590   2HG1  VAL  83          2HG1      VAL  83  -9.313   3.451   5.965
  591   3HG1  VAL  83          3HG1      VAL  83  -9.298   4.673   4.691
  592   1HG2  VAL  83          1HG2      VAL  83  -5.713   4.425   4.075
  593   2HG2  VAL  83          2HG2      VAL  83  -7.117   5.492   4.092
  594   3HG2  VAL  83          3HG2      VAL  83  -6.989   4.224   2.875
  595    H    ARG  84           H        ARG  84  -6.995   0.510   5.575
  596    HA   ARG  84           HA       ARG  84  -9.076   0.168   7.474
  597   1HB   ARG  84          2HB       ARG  84  -7.349  -1.946   6.178
  598   2HB   ARG  84          1HB       ARG  84  -8.902  -2.206   6.960
  599   1HG   ARG  84          2HG       ARG  84  -9.430  -0.263   5.060
  600   2HG   ARG  84          1HG       ARG  84  -8.302  -1.365   4.257
  601   1HD   ARG  84          2HD       ARG  84  -9.798  -3.048   4.195
  602   2HD   ARG  84          1HD       ARG  84 -10.443  -2.671   5.793
  603    HE   ARG  84           HE       ARG  84 -11.180  -0.771   3.763
  604   1HH1  ARG  84          1HH1      ARG  84 -12.011  -3.798   5.289
  605   2HH1  ARG  84          2HH1      ARG  84 -13.685  -3.700   4.857
  606   1HH2  ARG  84          1HH2      ARG  84 -13.381  -0.641   3.194
  607   2HH2  ARG  84          2HH2      ARG  84 -14.464  -1.907   3.667
  608    H    GLN  85           H        GLN  85  -5.684   0.284   7.795
  609    HA   GLN  85           HA       GLN  85  -5.814  -1.113  10.383
  610   1HB   GLN  85          2HB       GLN  85  -3.263  -0.369   8.971
  611   2HB   GLN  85          1HB       GLN  85  -3.517  -1.596  10.211
  612   1HG   GLN  85          2HG       GLN  85  -4.356  -1.692   7.325
  613   2HG   GLN  85          1HG       GLN  85  -3.163  -2.709   8.142
  614   1HE2  GLN  85          1HE2      GLN  85  -4.135  -3.866  10.124
  615   2HE2  GLN  85          2HE2      GLN  85  -5.656  -4.641   9.857
  616    H    MET  86           H        MET  86  -5.233   1.916   8.826
  617    HA   MET  86           HA       MET  86  -3.879   3.174  11.001
  618   1HB   MET  86          2HB       MET  86  -5.085   4.050   8.420
  619   2HB   MET  86          1HB       MET  86  -4.787   5.277   9.654
  620   1HG   MET  86          2HG       MET  86  -2.412   4.331   9.750
  621   2HG   MET  86          1HG       MET  86  -2.816   3.520   8.233
  622   1HE   MET  86          1HE       MET  86  -1.492   5.950   5.871
  623   2HE   MET  86          2HE       MET  86  -2.909   4.903   5.805
  624   3HE   MET  86          3HE       MET  86  -1.436   4.343   6.596
  625    H    LYS  87           H        LYS  87  -7.233   3.148   9.843
  626    HA   LYS  87           HA       LYS  87  -8.203   4.917  11.847
  627   1HB   LYS  87          2HB       LYS  87  -9.471   3.050   9.875
  628   2HB   LYS  87          1HB       LYS  87 -10.452   3.760  11.156
  629   1HG   LYS  87          2HG       LYS  87 -10.596   5.692  10.077
  630   2HG   LYS  87          1HG       LYS  87  -8.844   5.770   9.852
  631   1HD   LYS  87          2HD       LYS  87  -9.940   5.766   7.698
  632   2HD   LYS  87          1HD       LYS  87  -9.062   4.252   7.916
  633   1HE   LYS  87          2HE       LYS  87 -11.042   3.042   8.323
  634   2HE   LYS  87          1HE       LYS  87 -11.983   4.513   8.568
  635   1HZ   LYS  87          1HZ       LYS  87 -11.288   3.158   6.117
  636   2HZ   LYS  87          2HZ       LYS  87 -11.074   4.835   6.059
  637   3HZ   LYS  87          3HZ       LYS  87 -12.587   4.189   6.454
  638    H    GLU  88           H        GLU  88  -7.789   1.446  11.634
  639    HA   GLU  88           HA       GLU  88  -7.983   1.150  14.464
  640   1HB   GLU  88          2HB       GLU  88  -9.915  -0.345  14.529
  641   2HB   GLU  88          1HB       GLU  88 -10.377   1.244  13.939
  642   1HG   GLU  88          2HG       GLU  88  -9.635  -0.593  11.807
  643   2HG   GLU  88          1HG       GLU  88 -10.998  -1.156  12.771
  644    H    ASP  89           H        ASP  89  -7.033  -0.729  15.159
  645    HA   ASP  89           HA       ASP  89  -5.859  -2.400  13.055
  646   1HB   ASP  89          2HB       ASP  89  -4.858  -1.291  15.499
  647   2HB   ASP  89          1HB       ASP  89  -4.762  -3.051  15.594
  648    H    ALA  90           H        ALA  90  -8.614  -2.712  13.943
  649    HA   ALA  90           HA       ALA  90  -8.459  -5.533  14.709
  650   1HB   ALA  90          1HB       ALA  90 -10.366  -5.235  16.275
  651   2HB   ALA  90          2HB       ALA  90 -10.194  -3.489  16.088
  652   3HB   ALA  90          3HB       ALA  90  -8.885  -4.432  16.799
  653   2H    ARG 115          HN2       ARG 115   1.587  -2.875  10.975
  654    H    ARG 115           H        ARG 115   1.393  -4.535  10.586
  655   3H    ARG 115          HN3       ARG 115   2.480  -3.565   9.684
  656    HA   ARG 115           HA       ARG 115   0.736  -3.640   8.298
  657   1HB   ARG 115          2HB       ARG 115  -1.637  -3.440   9.206
  658   2HB   ARG 115          1HB       ARG 115  -0.776  -4.928   9.577
  659   1HG   ARG 115          2HG       ARG 115  -0.153  -3.396  11.736
  660   2HG   ARG 115          1HG       ARG 115  -1.781  -2.833  11.358
  661   1HD   ARG 115          2HD       ARG 115  -2.114  -4.614  12.834
  662   2HD   ARG 115          1HD       ARG 115  -2.414  -5.307  11.241
  663    HE   ARG 115           HE       ARG 115   0.283  -5.692  11.891
  664   1HH1  ARG 115          1HH1      ARG 115  -2.876  -6.774  12.903
  665   2HH1  ARG 115          2HH1      ARG 115  -2.310  -8.315  13.455
  666   1HH2  ARG 115          1HH2      ARG 115   1.030  -7.718  12.616
  667   2HH2  ARG 115          2HH2      ARG 115  -0.092  -8.850  13.292
  668    H    MET 116           H        MET 116   0.180  -1.526  11.127
  669    HA   MET 116           HA       MET 116  -0.542   0.681   9.403
  670   1HB   MET 116          2HB       MET 116  -1.321   0.022  11.899
  671   2HB   MET 116          1HB       MET 116  -0.035   1.159  12.282
  672   1HG   MET 116          2HG       MET 116  -1.362   2.548  10.390
  673   2HG   MET 116          1HG       MET 116  -2.683   1.620  11.096
  674   1HE   MET 116          1HE       MET 116  -4.000   2.575  13.212
  675   2HE   MET 116          2HE       MET 116  -3.016   2.851  14.650
  676   3HE   MET 116          3HE       MET 116  -2.845   1.351  13.738
  677    H    SER 117           H        SER 117   0.493   2.880  10.004
  678    HA   SER 117           HA       SER 117   2.310   4.222   9.750
  679   1HB   SER 117          2HB       SER 117   3.956   4.062  11.412
  680   2HB   SER 117          1HB       SER 117   2.556   3.282  12.148
  681    HG   SER 117           HG       SER 117   3.456   1.277  11.614
  682    H    ALA 118           H        ALA 118   1.951   1.982   7.886
  683    HA   ALA 118           HA       ALA 118   4.464   0.856   7.219
  684   1HB   ALA 118          1HB       ALA 118   1.775   0.951   6.044
  685   2HB   ALA 118          2HB       ALA 118   2.907  -0.395   6.189
  686   3HB   ALA 118          3HB       ALA 118   3.090   0.774   4.881
  687    H    ASP 119           H        ASP 119   3.299   4.000   6.924
  688    HA   ASP 119           HA       ASP 119   4.052   5.046   4.562
  689   1HB   ASP 119          2HB       ASP 119   3.149   6.341   6.464
  690   2HB   ASP 119          1HB       ASP 119   4.728   6.267   7.243
  691    H    ALA 120           H        ALA 120   6.235   3.753   6.966
  692    HA   ALA 120           HA       ALA 120   8.628   4.934   6.338
  693   1HB   ALA 120          1HB       ALA 120   9.605   3.266   7.517
  694   2HB   ALA 120          2HB       ALA 120   8.737   1.998   6.652
  695   3HB   ALA 120          3HB       ALA 120   7.933   2.896   7.939
  696    H    MET 121           H        MET 121   7.462   1.901   4.837
  697    HA   MET 121           HA       MET 121   9.420   1.802   2.837
  698   1HB   MET 121          2HB       MET 121   8.187  -0.178   3.187
  699   2HB   MET 121          1HB       MET 121   6.645   0.654   3.047
  700   1HG   MET 121          2HG       MET 121   8.095   0.952   0.599
  701   2HG   MET 121          1HG       MET 121   8.064  -0.750   1.060
  702   1HE   MET 121          1HE       MET 121   5.256  -0.972   2.629
  703   2HE   MET 121          2HE       MET 121   5.964  -2.121   1.494
  704   3HE   MET 121          3HE       MET 121   4.303  -1.567   1.269
  705    H    LEU 122           H        LEU 122   6.305   3.404   2.997
  706    HA   LEU 122           HA       LEU 122   6.113   4.186   0.302
  707   1HB   LEU 122          2HB       LEU 122   4.986   5.354   2.843
  708   2HB   LEU 122          1HB       LEU 122   4.635   6.032   1.266
  709    HG   LEU 122           HG       LEU 122   3.497   4.030   0.576
  710   1HD1  LEU 122          1HD1      LEU 122   4.890   2.349   1.596
  711   2HD1  LEU 122          2HD1      LEU 122   3.220   2.116   2.114
  712   3HD1  LEU 122          3HD1      LEU 122   4.386   2.861   3.206
  713   1HD2  LEU 122          1HD2      LEU 122   2.495   5.756   2.321
  714   2HD2  LEU 122          2HD2      LEU 122   2.434   4.314   3.334
  715   3HD2  LEU 122          3HD2      LEU 122   1.591   4.340   1.786
  716    H    ARG 123           H        ARG 123   7.638   5.674   3.119
  717    HA   ARG 123           HA       ARG 123   8.541   7.946   1.533
  718   1HB   ARG 123          2HB       ARG 123   7.707   8.097   3.945
  719   2HB   ARG 123          1HB       ARG 123   9.237   7.364   4.406
  720   1HG   ARG 123          2HG       ARG 123  10.204   9.339   2.930
  721   2HG   ARG 123          1HG       ARG 123   8.667  10.082   3.374
  722   1HD   ARG 123          2HD       ARG 123   9.740   8.904   5.711
  723   2HD   ARG 123          1HD       ARG 123  11.043   9.801   4.930
  724    HE   ARG 123           HE       ARG 123   9.965  11.757   5.444
  725   1HH1  ARG 123          1HH1      ARG 123   7.763   9.089   5.909
  726   2HH1  ARG 123          2HH1      ARG 123   6.550  10.060   6.672
  727   1HH2  ARG 123          1HH2      ARG 123   8.371  13.036   6.448
  728   2HH2  ARG 123          2HH2      ARG 123   6.894  12.301   6.978
  729    H    ALA 124           H        ALA 124   9.521   4.976   1.419
  730    HA   ALA 124           HA       ALA 124  12.333   5.280   2.043
  731   1HB   ALA 124          1HB       ALA 124  11.574   2.913   0.514
  732   2HB   ALA 124          2HB       ALA 124  10.633   3.129   1.990
  733   3HB   ALA 124          3HB       ALA 124  12.392   3.046   2.071
  734    H    LEU 125           H        LEU 125  10.769   4.025  -0.890
  735    HA   LEU 125           HA       LEU 125  12.955   4.860  -2.529
  736   1HB   LEU 125          2HB       LEU 125  10.250   3.881  -3.423
  737   2HB   LEU 125          1HB       LEU 125  11.742   3.867  -4.346
  738    HG   LEU 125           HG       LEU 125  11.609   2.348  -1.779
  739   1HD1  LEU 125          1HD1      LEU 125  10.988   0.406  -3.487
  740   2HD1  LEU 125          2HD1      LEU 125  10.132   1.737  -4.266
  741   3HD1  LEU 125          3HD1      LEU 125   9.771   1.315  -2.592
  742   1HD2  LEU 125          1HD2      LEU 125  13.695   2.715  -3.212
  743   2HD2  LEU 125          2HD2      LEU 125  12.949   1.596  -4.354
  744   3HD2  LEU 125          3HD2      LEU 125  13.323   1.065  -2.714
  745    H    LEU 126           H        LEU 126  10.253   6.490  -1.340
  746    HA   LEU 126           HA       LEU 126  10.842   8.827  -2.816
  747   1HB   LEU 126          2HB       LEU 126   9.204   7.077  -4.187
  748   2HB   LEU 126          1HB       LEU 126   8.067   8.192  -3.454
  749    HG   LEU 126           HG       LEU 126  10.336   8.896  -5.315
  750   1HD1  LEU 126          1HD1      LEU 126   7.903   7.936  -5.971
  751   2HD1  LEU 126          2HD1      LEU 126   8.821   9.064  -6.969
  752   3HD1  LEU 126          3HD1      LEU 126   7.556   9.664  -5.895
  753   1HD2  LEU 126          1HD2      LEU 126   9.905  10.540  -3.433
  754   2HD2  LEU 126          2HD2      LEU 126   8.316  10.797  -4.155
  755   3HD2  LEU 126          3HD2      LEU 126   9.775  11.172  -5.075
  756    H    GLY 127           H        GLY 127  10.748  10.123  -1.088
  757   1HA   GLY 127          2HA       GLY 127   8.173  10.607   0.137
  758   2HA   GLY 127          1HA       GLY 127   9.372   9.928   1.227
  759    H    SER 128           H        SER 128  10.212  11.450   2.474
  760    HA   SER 128           HA       SER 128  10.608  14.137   1.343
  761   1HB   SER 128          2HB       SER 128   9.377  13.335   3.716
  762   2HB   SER 128          1HB       SER 128  10.944  13.962   4.226
  763    HG   SER 128           HG       SER 128   9.265  15.568   4.072
  764    H    LYS 129           H        LYS 129  12.141  12.387   4.038
  765    HA   LYS 129           HA       LYS 129  14.726  13.434   3.231
  766   1HB   LYS 129          2HB       LYS 129  15.535  12.449   5.335
  767   2HB   LYS 129          1HB       LYS 129  14.141  13.487   5.595
  768   1HG   LYS 129          2HG       LYS 129  12.714  11.661   5.970
  769   2HG   LYS 129          1HG       LYS 129  13.879  10.513   5.306
  770   1HD   LYS 129          2HD       LYS 129  14.664  12.142   7.674
  771   2HD   LYS 129          1HD       LYS 129  13.561  10.786   7.908
  772   1HE   LYS 129          2HE       LYS 129  15.229   9.357   6.684
  773   2HE   LYS 129          1HE       LYS 129  16.344  10.721   6.761
  774   1HZ   LYS 129          1HZ       LYS 129  15.665  10.556   9.305
  775   2HZ   LYS 129          2HZ       LYS 129  16.950   9.673   8.651
  776   3HZ   LYS 129          3HZ       LYS 129  15.447   8.933   8.879
  777    H    HIS 130           H        HIS 130  16.518  12.191   2.680
  778    HA   HIS 130           HA       HIS 130  16.132   9.323   2.277
  779   1HB   HIS 130          2HB       HIS 130  17.177   9.598  -0.044
  780   2HB   HIS 130          1HB       HIS 130  15.490  10.068   0.134
  781    HD1  HIS 130           1HD      HIS 130  18.043  12.437   1.408
  782    HD2  HIS 130           2HD      HIS 130  15.832  11.839  -2.059
  783    HE1  HIS 130           1HE      HIS 130  18.285  14.560   0.083
  784    HE2  HIS 130           2HE      HIS 130  17.009  14.143  -2.050
  785    H    LYS 131           H        LYS 131  17.725  10.924   4.111
  786    HA   LYS 131           HA       LYS 131  20.296   9.683   3.570
  787   1HB   LYS 131          2HB       LYS 131  19.830  12.620   3.578
  788   2HB   LYS 131          1HB       LYS 131  21.280  12.034   4.382
  789   1HG   LYS 131          2HG       LYS 131  22.283  11.455   2.451
  790   2HG   LYS 131          1HG       LYS 131  20.773  10.939   1.695
  791   1HD   LYS 131          2HD       LYS 131  20.165  13.192   1.201
  792   2HD   LYS 131          1HD       LYS 131  21.490  13.825   2.179
  793   1HE   LYS 131          2HE       LYS 131  23.078  12.708   0.609
  794   2HE   LYS 131          1HE       LYS 131  21.699  12.290  -0.407
  795   1HZ   LYS 131          1HZ       LYS 131  21.938  15.090   0.335
  796   2HZ   LYS 131          2HZ       LYS 131  21.489  14.395  -1.140
  797   3HZ   LYS 131          3HZ       LYS 131  23.125  14.504  -0.720
  Start of MODEL    7
    1   2H    ALA   1          HN2       ALA   1 -20.818  -2.194 -11.112
    2    H    ALA   1           H        ALA   1 -21.153  -2.166 -12.796
    3   3H    ALA   1          HN3       ALA   1 -19.566  -2.506 -12.245
    4    HA   ALA   1           HA       ALA   1 -19.437  -0.357 -12.918
    5   1HB   ALA   1          1HB       ALA   1 -21.964   0.333 -11.446
    6   2HB   ALA   1          2HB       ALA   1 -21.958  -0.183 -13.133
    7   3HB   ALA   1          3HB       ALA   1 -21.104   1.284 -12.656
    8    H    SER   2           H        SER   2 -21.006  -0.756  -9.737
    9    HA   SER   2           HA       SER   2 -18.612   0.463  -8.522
   10   1HB   SER   2          2HB       SER   2 -20.976   1.704  -8.517
   11   2HB   SER   2          1HB       SER   2 -21.232   0.663  -7.116
   12    HG   SER   2           HG       SER   2 -19.221   1.519  -6.295
   13    H    MET   3           H        MET   3 -17.801  -0.469  -6.679
   14    HA   MET   3           HA       MET   3 -19.187  -2.833  -5.626
   15   1HB   MET   3          2HB       MET   3 -16.269  -2.699  -6.407
   16   2HB   MET   3          1HB       MET   3 -17.006  -4.024  -5.518
   17   1HG   MET   3          2HG       MET   3 -17.952  -4.905  -7.349
   18   2HG   MET   3          1HG       MET   3 -18.333  -3.330  -8.041
   19   1HE   MET   3          1HE       MET   3 -16.473  -3.953 -11.051
   20   2HE   MET   3          2HE       MET   3 -16.641  -2.374 -10.283
   21   3HE   MET   3          3HE       MET   3 -17.952  -3.550 -10.179
   22    H    THR   4           H        THR   4 -16.300  -0.793  -5.137
   23    HA   THR   4           HA       THR   4 -17.136  -0.213  -2.431
   24    HB   THR   4           HB       THR   4 -15.955  -2.361  -2.176
   25    HG1  THR   4           1HG      THR   4 -14.895  -1.690  -0.449
   26   1HG2  THR   4          1HG2      THR   4 -13.438  -0.983  -3.040
   27   2HG2  THR   4          2HG2      THR   4 -14.389  -1.993  -4.129
   28   3HG2  THR   4          3HG2      THR   4 -13.690  -2.687  -2.665
   29    H    ASP   5           H        ASP   5 -16.921   1.918  -2.375
   30    HA   ASP   5           HA       ASP   5 -14.930   3.268  -3.977
   31   1HB   ASP   5          2HB       ASP   5 -17.192   4.179  -2.219
   32   2HB   ASP   5          1HB       ASP   5 -15.987   5.328  -2.808
   33    H    GLN   6           H        GLN   6 -14.692   1.727  -1.119
   34    HA   GLN   6           HA       GLN   6 -13.556   3.470   0.697
   35   1HB   GLN   6          2HB       GLN   6 -12.504   1.552   1.705
   36   2HB   GLN   6          1HB       GLN   6 -14.095   1.081   1.125
   37   1HG   GLN   6          2HG       GLN   6 -13.035   0.107  -0.882
   38   2HG   GLN   6          1HG       GLN   6 -11.457   0.502  -0.203
   39   1HE2  GLN   6          1HE2      GLN   6 -10.747  -1.580  -0.024
   40   2HE2  GLN   6          2HE2      GLN   6 -11.422  -2.724   1.080
   41    H    GLN   7           H        GLN   7 -12.225   2.205  -2.254
   42    HA   GLN   7           HA       GLN   7  -9.494   2.805  -1.675
   43   1HB   GLN   7          2HB       GLN   7 -10.636   2.625  -4.447
   44   2HB   GLN   7          1HB       GLN   7  -9.026   2.189  -3.893
   45   1HG   GLN   7          2HG       GLN   7  -9.646   0.097  -3.542
   46   2HG   GLN   7          1HG       GLN   7 -10.982   0.614  -2.514
   47   1HE2  GLN   7          1HE2      GLN   7 -10.970  -1.595  -4.315
   48   2HE2  GLN   7          2HE2      GLN   7 -12.188  -1.299  -5.504
   49    H    ALA   8           H        ALA   8 -12.188   4.676  -2.631
   50    HA   ALA   8           HA       ALA   8 -10.610   6.778  -3.845
   51   1HB   ALA   8          1HB       ALA   8 -12.639   7.826  -4.386
   52   2HB   ALA   8          2HB       ALA   8 -13.521   6.964  -3.124
   53   3HB   ALA   8          3HB       ALA   8 -12.965   6.101  -4.559
   54    H    GLU   9           H        GLU   9 -12.630   6.377  -0.938
   55    HA   GLU   9           HA       GLU   9 -12.194   8.911   0.161
   56   1HB   GLU   9          2HB       GLU   9 -12.560   6.336   1.705
   57   2HB   GLU   9          1HB       GLU   9 -12.908   7.964   2.271
   58   1HG   GLU   9          2HG       GLU   9 -14.309   7.156  -0.183
   59   2HG   GLU   9          1HG       GLU   9 -14.755   6.273   1.282
   60    H    ALA  10           H        ALA  10 -10.332   5.951   0.291
   61    HA   ALA  10           HA       ALA  10  -8.495   6.401   2.254
   62   1HB   ALA  10          1HB       ALA  10  -8.321   4.358   1.199
   63   2HB   ALA  10          2HB       ALA  10  -6.895   5.200   0.593
   64   3HB   ALA  10          3HB       ALA  10  -8.340   5.070  -0.415
   65    H    ARG  11           H        ARG  11  -8.085   7.359  -1.159
   66    HA   ARG  11           HA       ARG  11  -5.707   8.750  -0.902
   67   1HB   ARG  11          2HB       ARG  11  -7.386   8.211  -2.964
   68   2HB   ARG  11          1HB       ARG  11  -7.682   9.932  -2.758
   69   1HG   ARG  11          2HG       ARG  11  -5.560  10.517  -3.383
   70   2HG   ARG  11          1HG       ARG  11  -4.868   8.976  -2.874
   71   1HD   ARG  11          2HD       ARG  11  -4.847   8.484  -5.059
   72   2HD   ARG  11          1HD       ARG  11  -6.576   8.201  -4.856
   73    HE   ARG  11           HE       ARG  11  -6.967  10.030  -6.154
   74   1HH1  ARG  11          1HH1      ARG  11  -3.727  10.269  -4.879
   75   2HH1  ARG  11          2HH1      ARG  11  -3.339  11.690  -5.789
   76   1HH2  ARG  11          1HH2      ARG  11  -6.458  11.900  -7.351
   77   2HH2  ARG  11          2HH2      ARG  11  -4.890  12.617  -7.192
   78    H    ALA  12           H        ALA  12  -8.906   9.659   0.062
   79    HA   ALA  12           HA       ALA  12  -8.127  12.442   0.487
   80   1HB   ALA  12          1HB       ALA  12 -10.307  12.003  -0.531
   81   2HB   ALA  12          2HB       ALA  12 -10.474  12.822   1.023
   82   3HB   ALA  12          3HB       ALA  12 -10.792  11.091   0.900
   83    H    PHE  13           H        PHE  13  -8.437   9.480   2.213
   84    HA   PHE  13           HA       PHE  13  -8.844  10.659   4.800
   85   1HB   PHE  13          2HB       PHE  13  -9.017   8.084   3.725
   86   2HB   PHE  13          1HB       PHE  13  -7.674   8.002   4.869
   87    HD1  PHE  13           1HD      PHE  13  -8.040   8.384   7.241
   88    HD2  PHE  13           2HD      PHE  13 -11.269   8.460   4.470
   89    HE1  PHE  13           1HE      PHE  13  -9.636   8.200   9.104
   90    HE2  PHE  13           2HE      PHE  13 -12.872   8.277   6.328
   91    HZ   PHE  13           HZ       PHE  13 -12.056   8.146   8.648
   92    H    LEU  14           H        LEU  14  -6.112   9.860   2.812
   93    HA   LEU  14           HA       LEU  14  -4.283  10.399   5.047
   94   1HB   LEU  14          2HB       LEU  14  -3.502   9.353   2.337
   95   2HB   LEU  14          1HB       LEU  14  -2.584   9.283   3.837
   96    HG   LEU  14           HG       LEU  14  -5.169   7.787   3.411
   97   1HD1  LEU  14          1HD1      LEU  14  -3.388   7.103   1.804
   98   2HD1  LEU  14          2HD1      LEU  14  -3.893   5.833   2.918
   99   3HD1  LEU  14          3HD1      LEU  14  -2.374   6.690   3.187
  100   1HD2  LEU  14          1HD2      LEU  14  -2.977   7.584   5.472
  101   2HD2  LEU  14          2HD2      LEU  14  -4.331   6.463   5.323
  102   3HD2  LEU  14          3HD2      LEU  14  -4.626   8.153   5.732
  103    H    SER  15           H        SER  15  -2.488  11.817   4.722
  104    HA   SER  15           HA       SER  15  -3.198  14.193   3.286
  105   1HB   SER  15          2HB       SER  15  -1.714  13.745   5.513
  106   2HB   SER  15          1HB       SER  15  -0.426  13.920   4.311
  107    HG   SER  15           HG       SER  15  -2.000  15.814   5.426
  108    H    GLU  16           H        GLU  16  -1.717  15.275   1.752
  109    HA   GLU  16           HA       GLU  16  -1.208  13.789  -0.516
  110   1HB   GLU  16          2HB       GLU  16  -0.123  16.398   0.490
  111   2HB   GLU  16          1HB       GLU  16   0.515  15.703  -0.994
  112   1HG   GLU  16          2HG       GLU  16  -2.286  15.585  -1.197
  113   2HG   GLU  16          1HG       GLU  16  -1.890  17.187  -0.574
  114    H    GLU  17           H        GLU  17   0.712  14.185   2.336
  115    HA   GLU  17           HA       GLU  17   3.223  13.375   1.384
  116   1HB   GLU  17          2HB       GLU  17   1.873  13.575   4.016
  117   2HB   GLU  17          1HB       GLU  17   3.258  12.490   3.937
  118   1HG   GLU  17          2HG       GLU  17   4.571  14.391   2.964
  119   2HG   GLU  17          1HG       GLU  17   3.198  15.434   3.335
  120    H    MET  18           H        MET  18   0.674  11.487   3.008
  121    HA   MET  18           HA       MET  18   1.927   8.991   2.790
  122   1HB   MET  18          2HB       MET  18  -0.345   9.912   3.980
  123   2HB   MET  18          1HB       MET  18  -1.018   8.978   2.644
  124   1HG   MET  18          2HG       MET  18  -0.915   7.458   4.388
  125   2HG   MET  18          1HG       MET  18   0.523   7.095   3.435
  126   1HE   MET  18          1HE       MET  18   1.127   6.618   7.429
  127   2HE   MET  18          2HE       MET  18   0.273   5.889   6.070
  128   3HE   MET  18          3HE       MET  18  -0.514   7.132   7.041
  129    H    ILE  19           H        ILE  19   0.291  10.904   0.431
  130    HA   ILE  19           HA       ILE  19  -0.297   8.705  -1.344
  131    HB   ILE  19           HB       ILE  19  -0.466  11.697  -1.650
  132   1HG1  ILE  19          2HG1      ILE  19  -2.606   9.570  -1.837
  133   2HG1  ILE  19          1HG1      ILE  19  -2.202  10.421  -0.344
  134   1HG2  ILE  19          1HG2      ILE  19  -1.718  10.865  -3.860
  135   2HG2  ILE  19          2HG2      ILE  19  -0.484   9.608  -3.746
  136   3HG2  ILE  19          3HG2      ILE  19  -0.009  11.304  -3.835
  137   1HD1  ILE  19          1HD1      ILE  19  -4.062  11.183  -2.244
  138   2HD1  ILE  19          2HD1      ILE  19  -2.691  12.261  -2.514
  139   3HD1  ILE  19          3HD1      ILE  19  -3.439  12.165  -0.919
  140    H    ALA  20           H        ALA  20   1.760  11.597  -1.730
  141    HA   ALA  20           HA       ALA  20   3.191  10.818  -3.936
  142   1HB   ALA  20          1HB       ALA  20   4.036  12.465  -1.565
  143   2HB   ALA  20          2HB       ALA  20   3.439  13.025  -3.129
  144   3HB   ALA  20          3HB       ALA  20   5.033  12.275  -3.009
  145    H    GLU  21           H        GLU  21   3.449   9.632  -0.695
  146    HA   GLU  21           HA       GLU  21   5.982   8.300  -1.164
  147   1HB   GLU  21          2HB       GLU  21   4.109   8.209   1.210
  148   2HB   GLU  21          1HB       GLU  21   5.716   7.504   1.152
  149   1HG   GLU  21          2HG       GLU  21   6.762   9.594   1.114
  150   2HG   GLU  21          1HG       GLU  21   5.270  10.426   0.681
  151    H    PHE  22           H        PHE  22   2.558   7.594  -1.041
  152    HA   PHE  22           HA       PHE  22   2.671   4.792  -0.918
  153   1HB   PHE  22          2HB       PHE  22   0.456   5.123  -0.819
  154   2HB   PHE  22          1HB       PHE  22   0.674   6.801  -1.291
  155    HD1  PHE  22           1HD      PHE  22   0.997   7.161  -3.901
  156    HD2  PHE  22           2HD      PHE  22  -0.873   3.780  -2.118
  157    HE1  PHE  22           1HE      PHE  22  -0.194   6.719  -6.005
  158    HE2  PHE  22           2HE      PHE  22  -2.066   3.330  -4.223
  159    HZ   PHE  22           HZ       PHE  22  -1.727   4.799  -6.168
  160    H    LYS  23           H        LYS  23   3.051   7.057  -3.541
  161    HA   LYS  23           HA       LYS  23   2.961   5.113  -5.634
  162   1HB   LYS  23          2HB       LYS  23   2.459   7.579  -5.874
  163   2HB   LYS  23          1HB       LYS  23   4.196   7.865  -5.743
  164   1HG   LYS  23          2HG       LYS  23   3.479   5.856  -7.737
  165   2HG   LYS  23          1HG       LYS  23   2.824   7.461  -8.067
  166   1HD   LYS  23          2HD       LYS  23   5.335   8.128  -7.386
  167   2HD   LYS  23          1HD       LYS  23   5.624   6.511  -8.044
  168   1HE   LYS  23          2HE       LYS  23   5.870   8.067  -9.833
  169   2HE   LYS  23          1HE       LYS  23   4.349   7.211 -10.082
  170   1HZ   LYS  23          1HZ       LYS  23   3.691   9.352 -10.421
  171   2HZ   LYS  23          2HZ       LYS  23   4.807  10.006  -9.331
  172   3HZ   LYS  23          3HZ       LYS  23   3.411   9.244  -8.756
  173    H    ALA  24           H        ALA  24   5.312   6.087  -3.369
  174    HA   ALA  24           HA       ALA  24   7.738   5.938  -4.579
  175   1HB   ALA  24          1HB       ALA  24   8.643   5.077  -2.483
  176   2HB   ALA  24          2HB       ALA  24   7.020   4.635  -1.956
  177   3HB   ALA  24          3HB       ALA  24   7.439   6.331  -2.189
  178    H    ALA  25           H        ALA  25   6.517   3.026  -2.940
  179    HA   ALA  25           HA       ALA  25   8.168   1.335  -4.547
  180   1HB   ALA  25          1HB       ALA  25   6.069   0.727  -2.480
  181   2HB   ALA  25          2HB       ALA  25   7.822   0.721  -2.273
  182   3HB   ALA  25          3HB       ALA  25   7.046  -0.504  -3.281
  183    H    PHE  26           H        PHE  26   5.274   2.787  -5.257
  184    HA   PHE  26           HA       PHE  26   3.660   0.832  -6.355
  185   1HB   PHE  26          2HB       PHE  26   3.144   3.288  -6.155
  186   2HB   PHE  26          1HB       PHE  26   4.123   3.546  -7.596
  187    HD1  PHE  26           1HD      PHE  26   1.237   1.523  -6.392
  188    HD2  PHE  26           2HD      PHE  26   3.104   3.507  -9.661
  189    HE1  PHE  26           1HE      PHE  26  -0.723   1.039  -7.799
  190    HE2  PHE  26           2HE      PHE  26   1.146   3.029 -11.074
  191    HZ   PHE  26           HZ       PHE  26  -0.771   1.793 -10.142
  192    H    ASP  27           H        ASP  27   6.686   2.072  -7.524
  193    HA   ASP  27           HA       ASP  27   6.368   0.994 -10.182
  194   1HB   ASP  27          2HB       ASP  27   7.885   3.005  -9.231
  195   2HB   ASP  27          1HB       ASP  27   9.070   1.704  -9.182
  196    H    MET  28           H        MET  28   8.683   0.328  -7.543
  197    HA   MET  28           HA       MET  28   9.710  -2.035  -8.611
  198   1HB   MET  28          2HB       MET  28   9.426  -1.329  -5.685
  199   2HB   MET  28          1HB       MET  28  10.534  -2.512  -6.364
  200   1HG   MET  28          2HG       MET  28  10.699   0.265  -7.384
  201   2HG   MET  28          1HG       MET  28  11.285  -0.051  -5.746
  202   1HE   MET  28          1HE       MET  28  14.756  -0.138  -6.995
  203   2HE   MET  28          2HE       MET  28  13.995  -0.672  -5.496
  204   3HE   MET  28          3HE       MET  28  13.450   0.810  -6.284
  205    H    PHE  29           H        PHE  29   6.767  -1.422  -6.865
  206    HA   PHE  29           HA       PHE  29   6.144  -3.971  -5.930
  207   1HB   PHE  29          2HB       PHE  29   4.586  -1.547  -6.673
  208   2HB   PHE  29          1HB       PHE  29   3.691  -3.059  -6.518
  209    HD1  PHE  29           1HD      PHE  29   4.112  -0.260  -4.834
  210    HD2  PHE  29           2HD      PHE  29   4.962  -4.394  -4.298
  211    HE1  PHE  29           1HE      PHE  29   4.040   0.047  -2.397
  212    HE2  PHE  29           2HE      PHE  29   4.890  -4.092  -1.858
  213    HZ   PHE  29           HZ       PHE  29   4.428  -1.871  -0.904
  214    H    ASP  30           H        ASP  30   4.533  -2.543  -8.757
  215    HA   ASP  30           HA       ASP  30   3.637  -4.930  -9.844
  216   1HB   ASP  30          2HB       ASP  30   4.236  -2.266 -11.128
  217   2HB   ASP  30          1HB       ASP  30   3.511  -3.609 -12.016
  218    H    ALA  31           H        ALA  31   4.693  -6.587 -10.656
  219    HA   ALA  31           HA       ALA  31   7.440  -6.249 -11.592
  220   1HB   ALA  31          1HB       ALA  31   5.945  -8.836 -11.249
  221   2HB   ALA  31          2HB       ALA  31   6.799  -8.033  -9.932
  222   3HB   ALA  31          3HB       ALA  31   7.688  -8.593 -11.347
  223    H    ASP  32           H        ASP  32   4.352  -7.623 -12.682
  224    HA   ASP  32           HA       ASP  32   5.244  -8.331 -15.269
  225   1HB   ASP  32          2HB       ASP  32   2.762  -8.354 -15.803
  226   2HB   ASP  32          1HB       ASP  32   3.269  -9.385 -14.462
  227    H    GLY  33           H        GLY  33   4.395  -5.319 -13.862
  228   1HA   GLY  33          2HA       GLY  33   5.326  -3.554 -15.564
  229   2HA   GLY  33          1HA       GLY  33   3.916  -4.077 -16.472
  230    H    GLY  34           H        GLY  34   1.804  -3.717 -15.542
  231   1HA   GLY  34          2HA       GLY  34   1.737  -1.765 -13.346
  232   2HA   GLY  34          1HA       GLY  34   1.000  -1.330 -14.886
  233    H    GLY  35           H        GLY  35   0.981  -4.137 -12.674
  234   1HA   GLY  35          2HA       GLY  35  -1.916  -4.361 -13.155
  235   2HA   GLY  35          1HA       GLY  35  -0.876  -5.659 -12.574
  236    H    ASP  36           H        ASP  36  -0.944  -6.088 -10.471
  237    HA   ASP  36           HA       ASP  36  -1.694  -3.945  -8.608
  238   1HB   ASP  36          2HB       ASP  36  -2.826  -6.750  -8.544
  239   2HB   ASP  36          1HB       ASP  36  -3.182  -5.458  -7.395
  240    H    ILE  37           H        ILE  37  -1.627  -5.278  -6.256
  241    HA   ILE  37           HA       ILE  37   1.077  -6.442  -6.164
  242    HB   ILE  37           HB       ILE  37  -0.194  -4.463  -4.279
  243   1HG1  ILE  37          2HG1      ILE  37   2.531  -4.298  -5.532
  244   2HG1  ILE  37          1HG1      ILE  37   1.095  -3.814  -6.438
  245   1HG2  ILE  37          1HG2      ILE  37   1.722  -6.544  -3.680
  246   2HG2  ILE  37          2HG2      ILE  37   0.883  -5.436  -2.597
  247   3HG2  ILE  37          3HG2      ILE  37   2.388  -4.941  -3.373
  248   1HD1  ILE  37          1HD1      ILE  37   2.031  -1.866  -5.463
  249   2HD1  ILE  37          2HD1      ILE  37   2.133  -2.633  -3.878
  250   3HD1  ILE  37          3HD1      ILE  37   0.557  -2.245  -4.571
  251    H    SER  38           H        SER  38   1.256  -8.350  -5.192
  252    HA   SER  38           HA       SER  38  -1.029  -9.333  -3.615
  253   1HB   SER  38          2HB       SER  38   0.918 -11.286  -4.708
  254   2HB   SER  38          1HB       SER  38  -0.845 -11.382  -4.602
  255    HG   SER  38           HG       SER  38  -1.035 -10.313  -6.471
  256    H    THR  39           H        THR  39   0.237 -11.594  -2.541
  257    HA   THR  39           HA       THR  39   1.485 -10.480  -0.267
  258    HB   THR  39           HB       THR  39   2.097 -12.980   0.137
  259    HG1  THR  39           1HG      THR  39   0.780 -14.371  -1.130
  260   1HG2  THR  39          1HG2      THR  39  -0.813 -12.290  -0.167
  261   2HG2  THR  39          2HG2      THR  39   0.190 -11.826   1.208
  262   3HG2  THR  39          3HG2      THR  39  -0.110 -13.531   0.871
  263    H    LYS  40           H        LYS  40   2.731 -11.685  -3.280
  264    HA   LYS  40           HA       LYS  40   5.437 -11.966  -2.330
  265   1HB   LYS  40          2HB       LYS  40   4.450 -11.873  -5.185
  266   2HB   LYS  40          1HB       LYS  40   6.000 -12.494  -4.619
  267   1HG   LYS  40          2HG       LYS  40   4.881 -14.305  -3.458
  268   2HG   LYS  40          1HG       LYS  40   3.305 -13.663  -3.943
  269   1HD   LYS  40          2HD       LYS  40   3.571 -14.304  -6.138
  270   2HD   LYS  40          1HD       LYS  40   5.333 -14.269  -6.045
  271   1HE   LYS  40          2HE       LYS  40   5.467 -16.375  -5.194
  272   2HE   LYS  40          1HE       LYS  40   3.925 -16.249  -4.349
  273   1HZ   LYS  40          1HZ       LYS  40   2.914 -16.309  -6.675
  274   2HZ   LYS  40          2HZ       LYS  40   3.526 -17.757  -6.052
  275   3HZ   LYS  40          3HZ       LYS  40   4.421 -16.882  -7.191
  276    H    GLU  41           H        GLU  41   3.734  -9.702  -4.488
  277    HA   GLU  41           HA       GLU  41   5.871  -8.030  -5.079
  278   1HB   GLU  41          2HB       GLU  41   2.927  -7.436  -4.834
  279   2HB   GLU  41          1HB       GLU  41   4.094  -6.264  -5.431
  280   1HG   GLU  41          2HG       GLU  41   4.660  -8.424  -6.977
  281   2HG   GLU  41          1HG       GLU  41   2.922  -8.602  -6.743
  282    H    LEU  42           H        LEU  42   4.108  -8.359  -2.126
  283    HA   LEU  42           HA       LEU  42   4.891  -5.780  -1.098
  284   1HB   LEU  42          2HB       LEU  42   2.947  -7.681  -0.438
  285   2HB   LEU  42          1HB       LEU  42   4.050  -7.658   0.931
  286    HG   LEU  42           HG       LEU  42   2.348  -6.101   1.439
  287   1HD1  LEU  42          1HD1      LEU  42   3.518  -4.015   1.631
  288   2HD1  LEU  42          2HD1      LEU  42   4.623  -4.461   0.330
  289   3HD1  LEU  42          3HD1      LEU  42   4.669  -5.331   1.864
  290   1HD2  LEU  42          1HD2      LEU  42   1.323  -5.839  -0.708
  291   2HD2  LEU  42          2HD2      LEU  42   2.752  -5.024  -1.346
  292   3HD2  LEU  42          3HD2      LEU  42   1.767  -4.240  -0.110
  293    H    GLY  43           H        GLY  43   5.831  -9.159  -0.579
  294   1HA   GLY  43          2HA       GLY  43   7.738  -8.623   1.447
  295   2HA   GLY  43          1HA       GLY  43   7.661 -10.081   0.461
  296    H    THR  44           H        THR  44   7.828  -7.885  -1.847
  297    HA   THR  44           HA       THR  44  10.644  -8.267  -2.252
  298    HB   THR  44           HB       THR  44   8.360  -7.168  -3.817
  299    HG1  THR  44           1HG      THR  44  10.453  -9.014  -4.245
  300   1HG2  THR  44          1HG2      THR  44  10.127  -6.606  -5.634
  301   2HG2  THR  44          2HG2      THR  44  11.183  -6.313  -4.251
  302   3HG2  THR  44          3HG2      THR  44   9.685  -5.396  -4.427
  303    H    VAL  45           H        VAL  45   8.823  -5.259  -2.630
  304    HA   VAL  45           HA       VAL  45  10.975  -3.550  -2.218
  305    HB   VAL  45           HB       VAL  45   8.973  -2.796  -3.317
  306   1HG1  VAL  45          1HG1      VAL  45   6.926  -2.311  -1.895
  307   2HG1  VAL  45          2HG1      VAL  45   7.645  -3.369  -0.682
  308   3HG1  VAL  45          3HG1      VAL  45   7.247  -4.000  -2.281
  309   1HG2  VAL  45          1HG2      VAL  45   9.290  -0.685  -2.672
  310   2HG2  VAL  45          2HG2      VAL  45  10.365  -1.331  -1.432
  311   3HG2  VAL  45          3HG2      VAL  45   8.673  -1.006  -1.051
  312    H    MET  46           H        MET  46   8.657  -4.842   0.116
  313    HA   MET  46           HA       MET  46   9.427  -3.155   2.252
  314   1HB   MET  46          2HB       MET  46   7.954  -5.767   2.102
  315   2HB   MET  46          1HB       MET  46   8.335  -5.021   3.654
  316   1HG   MET  46          2HG       MET  46   7.238  -2.925   2.372
  317   2HG   MET  46          1HG       MET  46   6.367  -4.255   1.603
  318   1HE   MET  46          1HE       MET  46   7.134  -2.406   5.019
  319   2HE   MET  46          2HE       MET  46   5.444  -2.353   5.522
  320   3HE   MET  46          3HE       MET  46   5.921  -1.686   3.959
  321    H    ARG  47           H        ARG  47  10.702  -6.174   1.035
  322    HA   ARG  47           HA       ARG  47  12.314  -6.666   3.376
  323   1HB   ARG  47          2HB       ARG  47  12.048  -7.973   0.689
  324   2HB   ARG  47          1HB       ARG  47  13.389  -8.384   1.748
  325   1HG   ARG  47          2HG       ARG  47  11.815  -9.056   3.489
  326   2HG   ARG  47          1HG       ARG  47  10.467  -8.642   2.427
  327   1HD   ARG  47          2HD       ARG  47  10.694 -10.953   2.181
  328   2HD   ARG  47          1HD       ARG  47  11.516 -10.285   0.766
  329    HE   ARG  47           HE       ARG  47  13.257 -10.774   3.003
  330   1HH1  ARG  47          1HH1      ARG  47  11.771 -12.167   0.169
  331   2HH1  ARG  47          2HH1      ARG  47  12.979 -13.393  -0.015
  332   1HH2  ARG  47          1HH2      ARG  47  14.848 -12.388   2.762
  333   2HH2  ARG  47          2HH2      ARG  47  14.725 -13.520   1.456
  334    H    MET  48           H        MET  48  12.704  -5.101   0.283
  335    HA   MET  48           HA       MET  48  15.587  -4.851   0.664
  336   1HB   MET  48          2HB       MET  48  15.611  -3.877  -1.577
  337   2HB   MET  48          1HB       MET  48  14.770  -5.428  -1.570
  338   1HG   MET  48          2HG       MET  48  12.927  -4.508  -2.373
  339   2HG   MET  48          1HG       MET  48  12.917  -3.282  -1.107
  340   1HE   MET  48          1HE       MET  48  11.637  -2.053  -3.396
  341   2HE   MET  48          2HE       MET  48  12.621  -0.631  -3.748
  342   3HE   MET  48          3HE       MET  48  12.317  -1.100  -2.075
  343    H    LEU  49           H        LEU  49  13.175  -3.331   2.055
  344    HA   LEU  49           HA       LEU  49  14.383  -0.660   1.756
  345   1HB   LEU  49          2HB       LEU  49  11.542  -1.506   2.204
  346   2HB   LEU  49          1HB       LEU  49  12.085   0.084   2.704
  347    HG   LEU  49           HG       LEU  49  12.093  -1.016  -0.105
  348   1HD1  LEU  49          1HD1      LEU  49   9.907  -0.387   0.371
  349   2HD1  LEU  49          2HD1      LEU  49  10.588   1.050  -0.388
  350   3HD1  LEU  49          3HD1      LEU  49  10.410   0.977   1.365
  351   1HD2  LEU  49          1HD2      LEU  49  13.458   1.302   1.119
  352   2HD2  LEU  49          2HD2      LEU  49  12.656   1.575  -0.428
  353   3HD2  LEU  49          3HD2      LEU  49  13.900   0.333  -0.286
  354    H    GLY  50           H        GLY  50  12.956  -2.977   4.020
  355   1HA   GLY  50          2HA       GLY  50  14.724  -2.689   6.071
  356   2HA   GLY  50          1HA       GLY  50  13.586  -1.368   6.326
  357    H    GLN  51           H        GLN  51  11.242  -2.705   5.440
  358    HA   GLN  51           HA       GLN  51  10.528  -4.047   7.832
  359   1HB   GLN  51          2HB       GLN  51   9.151  -2.823   5.791
  360   2HB   GLN  51          1HB       GLN  51   8.777  -4.527   5.527
  361   1HG   GLN  51          2HG       GLN  51   7.124  -4.142   6.982
  362   2HG   GLN  51          1HG       GLN  51   8.389  -4.335   8.195
  363   1HE2  GLN  51          1HE2      GLN  51   6.164  -2.922   8.812
  364   2HE2  GLN  51          2HE2      GLN  51   6.536  -1.240   8.937
  365    H    ASN  52           H        ASN  52   9.632  -6.245   7.958
  366    HA   ASN  52           HA       ASN  52  10.665  -8.120   5.973
  367   1HB   ASN  52          2HB       ASN  52  12.390  -7.775   7.802
  368   2HB   ASN  52          1HB       ASN  52  11.236  -8.525   8.909
  369   1HD2  ASN  52          1HD2      ASN  52  11.156 -10.671   9.027
  370   2HD2  ASN  52          2HD2      ASN  52  12.008 -11.758   7.989
  371    HA   PRO  53           HA       PRO  53   6.533  -9.201   8.016
  372   1HB   PRO  53          2HB       PRO  53   4.870  -8.613   5.971
  373   2HB   PRO  53          1HB       PRO  53   5.346  -7.412   7.176
  374   1HG   PRO  53          2HG       PRO  53   6.398  -7.842   4.409
  375   2HG   PRO  53          1HG       PRO  53   6.018  -6.324   5.240
  376   1HD   PRO  53          2HD       PRO  53   8.551  -7.303   4.997
  377   2HD   PRO  53          1HD       PRO  53   8.025  -6.281   6.353
  378    H    THR  54           H        THR  54   6.797 -11.373   7.963
  379    HA   THR  54           HA       THR  54   7.527 -12.935   5.785
  380    HB   THR  54           HB       THR  54   6.110 -14.720   7.209
  381    HG1  THR  54           1HG      THR  54   5.228 -13.083   8.557
  382   1HG2  THR  54          1HG2      THR  54   8.503 -13.764   8.645
  383   2HG2  THR  54          2HG2      THR  54   8.716 -14.252   6.964
  384   3HG2  THR  54          3HG2      THR  54   8.053 -15.391   8.136
  385    H    LYS  55           H        LYS  55   5.884 -14.901   5.214
  386    HA   LYS  55           HA       LYS  55   4.103 -13.863   3.338
  387   1HB   LYS  55          2HB       LYS  55   5.131 -16.319   3.815
  388   2HB   LYS  55          1HB       LYS  55   3.485 -16.555   4.403
  389   1HG   LYS  55          2HG       LYS  55   3.148 -15.264   1.979
  390   2HG   LYS  55          1HG       LYS  55   4.485 -16.378   1.690
  391   1HD   LYS  55          2HD       LYS  55   2.657 -17.704   1.208
  392   2HD   LYS  55          1HD       LYS  55   2.947 -18.099   2.903
  393   1HE   LYS  55          2HE       LYS  55   1.044 -17.100   3.602
  394   2HE   LYS  55          1HE       LYS  55   1.155 -15.813   2.402
  395   1HZ   LYS  55          1HZ       LYS  55   0.393 -17.385   0.718
  396   2HZ   LYS  55          2HZ       LYS  55  -0.737 -17.230   1.966
  397   3HZ   LYS  55          3HZ       LYS  55   0.254 -18.596   1.891
  398    H    CYS  56           H        CYS  56   3.346 -15.445   6.445
  399    HA   CYS  56           HA       CYS  56   0.585 -15.019   6.371
  400   1HB   CYS  56          2HB       CYS  56   0.736 -15.255   8.891
  401   2HB   CYS  56          1HB       CYS  56   1.439 -16.577   7.954
  402    HG   CYS  56           HG       CYS  56   3.639 -16.105   8.936
  403    H    GLU  57           H        GLU  57   3.213 -12.922   7.321
  404    HA   GLU  57           HA       GLU  57   1.768 -10.988   8.743
  405   1HB   GLU  57          2HB       GLU  57   4.406 -11.345   7.958
  406   2HB   GLU  57          1HB       GLU  57   3.919  -9.869   7.125
  407   1HG   GLU  57          2HG       GLU  57   3.483 -10.290  10.066
  408   2HG   GLU  57          1HG       GLU  57   4.966  -9.600   9.408
  409    H    LEU  58           H        LEU  58   2.873 -10.804   5.352
  410    HA   LEU  58           HA       LEU  58   1.240  -8.571   4.731
  411   1HB   LEU  58          2HB       LEU  58   2.342 -10.574   2.764
  412   2HB   LEU  58          1HB       LEU  58   1.916  -8.895   2.458
  413    HG   LEU  58           HG       LEU  58   4.086  -9.559   4.418
  414   1HD1  LEU  58          1HD1      LEU  58   4.146  -9.915   1.496
  415   2HD1  LEU  58          2HD1      LEU  58   5.145 -10.644   2.753
  416   3HD1  LEU  58          3HD1      LEU  58   5.491  -9.010   2.189
  417   1HD2  LEU  58          1HD2      LEU  58   3.806  -7.317   4.551
  418   2HD2  LEU  58          2HD2      LEU  58   3.105  -7.198   2.938
  419   3HD2  LEU  58          3HD2      LEU  58   4.852  -7.337   3.130
  420    H    ASP  59           H        ASP  59   0.777 -12.035   4.554
  421    HA   ASP  59           HA       ASP  59  -1.523 -12.041   2.916
  422   1HB   ASP  59          2HB       ASP  59  -0.049 -14.029   3.555
  423   2HB   ASP  59          1HB       ASP  59  -0.945 -14.063   5.077
  424    H    ALA  60           H        ALA  60  -1.031 -11.373   6.284
  425    HA   ALA  60           HA       ALA  60  -3.761 -11.717   7.043
  426   1HB   ALA  60          1HB       ALA  60  -1.327 -11.261   8.377
  427   2HB   ALA  60          2HB       ALA  60  -2.910 -11.567   9.092
  428   3HB   ALA  60          3HB       ALA  60  -2.383  -9.910   8.790
  429    H    ILE  61           H        ILE  61  -1.828  -9.106   5.783
  430    HA   ILE  61           HA       ILE  61  -3.799  -7.075   6.315
  431    HB   ILE  61           HB       ILE  61  -1.184  -7.127   4.835
  432   1HG1  ILE  61          2HG1      ILE  61  -0.879  -5.151   6.528
  433   2HG1  ILE  61          1HG1      ILE  61  -2.264  -5.884   7.341
  434   1HG2  ILE  61          1HG2      ILE  61  -2.068  -5.616   3.420
  435   2HG2  ILE  61          2HG2      ILE  61  -1.776  -4.510   4.762
  436   3HG2  ILE  61          3HG2      ILE  61  -3.383  -5.193   4.515
  437   1HD1  ILE  61          1HD1      ILE  61  -1.089  -7.830   7.833
  438   2HD1  ILE  61          2HD1      ILE  61   0.083  -6.541   8.107
  439   3HD1  ILE  61          3HD1      ILE  61   0.155  -7.498   6.628
  440    H    ILE  62           H        ILE  62  -2.416  -8.436   3.313
  441    HA   ILE  62           HA       ILE  62  -4.086  -7.348   1.449
  442    HB   ILE  62           HB       ILE  62  -3.028 -10.175   1.477
  443   1HG1  ILE  62          2HG1      ILE  62  -1.949  -7.591   0.330
  444   2HG1  ILE  62          1HG1      ILE  62  -1.257  -8.531   1.655
  445   1HG2  ILE  62          1HG2      ILE  62  -4.092  -8.532  -0.819
  446   2HG2  ILE  62          2HG2      ILE  62  -4.851  -9.962  -0.118
  447   3HG2  ILE  62          3HG2      ILE  62  -3.309 -10.106  -0.961
  448   1HD1  ILE  62          1HD1      ILE  62  -0.267  -8.678  -0.750
  449   2HD1  ILE  62          2HD1      ILE  62  -1.593  -9.811  -1.009
  450   3HD1  ILE  62          3HD1      ILE  62  -0.402 -10.121   0.253
  451    H    CYS  63           H        CYS  63  -4.741 -10.139   3.517
  452    HA   CYS  63           HA       CYS  63  -7.167 -10.922   2.326
  453   1HB   CYS  63          2HB       CYS  63  -5.720 -12.172   4.060
  454   2HB   CYS  63          1HB       CYS  63  -6.587 -11.219   5.267
  455    HG   CYS  63           HG       CYS  63  -7.706 -13.596   3.718
  456    H    GLU  64           H        GLU  64  -6.423  -8.624   4.901
  457    HA   GLU  64           HA       GLU  64  -9.164  -8.036   5.482
  458   1HB   GLU  64          2HB       GLU  64  -6.817  -7.614   6.802
  459   2HB   GLU  64          1HB       GLU  64  -7.139  -6.005   6.169
  460   1HG   GLU  64          2HG       GLU  64  -9.394  -7.390   7.480
  461   2HG   GLU  64          1HG       GLU  64  -8.066  -6.870   8.515
  462    H    VAL  65           H        VAL  65  -6.647  -6.609   3.477
  463    HA   VAL  65           HA       VAL  65  -8.038  -4.244   2.792
  464    HB   VAL  65           HB       VAL  65  -5.930  -5.700   1.183
  465   1HG1  VAL  65          1HG1      VAL  65  -5.574  -3.684   0.005
  466   2HG1  VAL  65          2HG1      VAL  65  -6.591  -2.766   1.115
  467   3HG1  VAL  65          3HG1      VAL  65  -7.319  -3.934   0.012
  468   1HG2  VAL  65          1HG2      VAL  65  -5.049  -5.242   3.362
  469   2HG2  VAL  65          2HG2      VAL  65  -5.681  -3.598   3.331
  470   3HG2  VAL  65          3HG2      VAL  65  -4.371  -4.059   2.246
  471    H    ASP  66           H        ASP  66  -7.435  -7.149   0.809
  472    HA   ASP  66           HA       ASP  66  -9.188  -6.510  -1.256
  473   1HB   ASP  66          2HB       ASP  66  -8.169  -9.160  -0.239
  474   2HB   ASP  66          1HB       ASP  66  -9.195  -9.031  -1.665
  475    H    GLU  67           H        GLU  67 -11.154  -5.752  -0.506
  476    HA   GLU  67           HA       GLU  67 -12.767  -7.145   1.369
  477   1HB   GLU  67          2HB       GLU  67 -14.552  -5.596   0.660
  478   2HB   GLU  67          1HB       GLU  67 -13.043  -4.755   1.013
  479   1HG   GLU  67          2HG       GLU  67 -13.355  -3.735  -0.936
  480   2HG   GLU  67          1HG       GLU  67 -12.822  -5.254  -1.668
  481    H    ASP  68           H        ASP  68 -12.397  -7.292  -2.093
  482    HA   ASP  68           HA       ASP  68 -14.794  -8.851  -2.494
  483   1HB   ASP  68          2HB       ASP  68 -14.016  -9.006  -4.837
  484   2HB   ASP  68          1HB       ASP  68 -14.068  -7.344  -4.259
  485    H    GLY  69           H        GLY  69 -11.404  -9.428  -1.951
  486   1HA   GLY  69          2HA       GLY  69 -10.492 -11.452  -1.193
  487   2HA   GLY  69          1HA       GLY  69 -11.952 -12.280  -1.716
  488    H    SER  70           H        SER  70  -9.400 -10.327  -3.266
  489    HA   SER  70           HA       SER  70  -9.218 -12.414  -5.339
  490   1HB   SER  70          2HB       SER  70  -8.159 -10.383  -6.654
  491   2HB   SER  70          1HB       SER  70  -9.915 -10.571  -6.551
  492    HG   SER  70           HG       SER  70  -9.856  -9.102  -4.771
  493    H    GLY  71           H        GLY  71  -7.462 -10.359  -3.126
  494   1HA   GLY  71          2HA       GLY  71  -5.365 -10.871  -2.197
  495   2HA   GLY  71          1HA       GLY  71  -5.102 -12.034  -3.496
  496    H    THR  72           H        THR  72  -6.160  -9.508  -5.163
  497    HA   THR  72           HA       THR  72  -3.445  -8.461  -5.572
  498    HB   THR  72           HB       THR  72  -4.323  -7.715  -7.788
  499    HG1  THR  72           1HG      THR  72  -6.596  -9.259  -7.104
  500   1HG2  THR  72          1HG2      THR  72  -3.743 -10.365  -7.004
  501   2HG2  THR  72          2HG2      THR  72  -3.561  -9.620  -8.592
  502   3HG2  THR  72          3HG2      THR  72  -5.073 -10.421  -8.162
  503    H    ILE  73           H        ILE  73  -2.985  -6.412  -5.094
  504    HA   ILE  73           HA       ILE  73  -5.116  -4.698  -4.096
  505    HB   ILE  73           HB       ILE  73  -2.148  -4.160  -4.138
  506   1HG1  ILE  73          2HG1      ILE  73  -3.706  -5.099  -1.739
  507   2HG1  ILE  73          1HG1      ILE  73  -2.998  -6.257  -2.868
  508   1HG2  ILE  73          1HG2      ILE  73  -4.367  -2.933  -2.504
  509   2HG2  ILE  73          2HG2      ILE  73  -3.552  -2.174  -3.872
  510   3HG2  ILE  73          3HG2      ILE  73  -2.653  -2.530  -2.398
  511   1HD1  ILE  73          1HD1      ILE  73  -1.762  -5.185  -0.678
  512   2HD1  ILE  73          2HD1      ILE  73  -1.124  -4.207  -2.000
  513   3HD1  ILE  73          3HD1      ILE  73  -0.955  -5.961  -2.040
  514    H    ASP  74           H        ASP  74  -6.177  -3.572  -5.600
  515    HA   ASP  74           HA       ASP  74  -5.250  -2.882  -8.137
  516   1HB   ASP  74          2HB       ASP  74  -7.655  -2.748  -6.879
  517   2HB   ASP  74          1HB       ASP  74  -7.221  -1.037  -6.937
  518    H    PHE  75           H        PHE  75  -5.748  -0.190  -8.510
  519    HA   PHE  75           HA       PHE  75  -3.246   0.950  -7.873
  520   1HB   PHE  75          2HB       PHE  75  -5.766   1.939  -9.141
  521   2HB   PHE  75          1HB       PHE  75  -4.553   3.118  -8.637
  522    HD1  PHE  75           1HD      PHE  75  -4.769  -0.101 -10.514
  523    HD2  PHE  75           2HD      PHE  75  -2.969   3.739 -10.172
  524    HE1  PHE  75           1HE      PHE  75  -3.521  -0.504 -12.597
  525    HE2  PHE  75           2HE      PHE  75  -1.718   3.345 -12.253
  526    HZ   PHE  75           HZ       PHE  75  -1.994   1.220 -13.469
  527    H    GLU  76           H        GLU  76  -6.306   2.557  -7.077
  528    HA   GLU  76           HA       GLU  76  -5.243   3.959  -4.894
  529   1HB   GLU  76          2HB       GLU  76  -8.157   3.273  -5.264
  530   2HB   GLU  76          1HB       GLU  76  -7.481   4.658  -4.418
  531   1HG   GLU  76          2HG       GLU  76  -6.625   4.521  -7.188
  532   2HG   GLU  76          1HG       GLU  76  -8.378   4.600  -7.019
  533    H    GLU  77           H        GLU  77  -6.455   0.739  -5.146
  534    HA   GLU  77           HA       GLU  77  -7.360   0.216  -2.590
  535   1HB   GLU  77          2HB       GLU  77  -6.297  -1.360  -4.815
  536   2HB   GLU  77          1HB       GLU  77  -6.007  -2.097  -3.245
  537   1HG   GLU  77          2HG       GLU  77  -8.460  -1.774  -2.772
  538   2HG   GLU  77          1HG       GLU  77  -8.642  -1.347  -4.478
  539    H    PHE  78           H        PHE  78  -4.083   0.678  -3.710
  540    HA   PHE  78           HA       PHE  78  -2.766  -0.441  -1.457
  541   1HB   PHE  78          2HB       PHE  78  -1.775   0.192  -3.761
  542   2HB   PHE  78          1HB       PHE  78  -1.629   1.818  -3.087
  543    HD1  PHE  78           1HD      PHE  78   0.453   2.338  -2.297
  544    HD2  PHE  78           2HD      PHE  78  -0.931  -1.670  -1.944
  545    HE1  PHE  78           1HE      PHE  78   2.568   1.708  -1.212
  546    HE2  PHE  78           2HE      PHE  78   1.182  -2.309  -0.859
  547    HZ   PHE  78           HZ       PHE  78   2.934  -0.619  -0.490
  548    H    LEU  79           H        LEU  79  -4.611   2.384  -1.835
  549    HA   LEU  79           HA       LEU  79  -3.287   3.792   0.348
  550   1HB   LEU  79          2HB       LEU  79  -5.586   4.523  -1.460
  551   2HB   LEU  79          1HB       LEU  79  -5.076   5.519  -0.110
  552    HG   LEU  79           HG       LEU  79  -2.776   4.960  -1.691
  553   1HD1  LEU  79          1HD1      LEU  79  -3.776   6.369  -3.701
  554   2HD1  LEU  79          2HD1      LEU  79  -5.246   5.513  -3.234
  555   3HD1  LEU  79          3HD1      LEU  79  -3.803   4.606  -3.687
  556   1HD2  LEU  79          1HD2      LEU  79  -2.628   6.931  -0.577
  557   2HD2  LEU  79          2HD2      LEU  79  -4.339   7.305  -0.782
  558   3HD2  LEU  79          3HD2      LEU  79  -3.217   7.551  -2.120
  559    H    VAL  80           H        VAL  80  -6.364   2.215  -0.408
  560    HA   VAL  80           HA       VAL  80  -7.599   2.812   2.080
  561    HB   VAL  80           HB       VAL  80  -8.781   2.117  -0.056
  562   1HG1  VAL  80          1HG1      VAL  80  -7.977  -0.629   0.891
  563   2HG1  VAL  80          2HG1      VAL  80  -7.478   0.154  -0.607
  564   3HG1  VAL  80          3HG1      VAL  80  -9.167  -0.290  -0.366
  565   1HG2  VAL  80          1HG2      VAL  80 -10.621   1.684   1.165
  566   2HG2  VAL  80          2HG2      VAL  80  -9.555   2.027   2.528
  567   3HG2  VAL  80          3HG2      VAL  80  -9.857   0.358   2.041
  568    H    MET  81           H        MET  81  -5.661   0.134   0.895
  569    HA   MET  81           HA       MET  81  -6.011  -1.781   2.836
  570   1HB   MET  81          2HB       MET  81  -3.520  -2.256   2.447
  571   2HB   MET  81          1HB       MET  81  -4.574  -2.318   1.043
  572   1HG   MET  81          2HG       MET  81  -3.603  -0.557   0.067
  573   2HG   MET  81          1HG       MET  81  -3.354   0.304   1.588
  574   1HE   MET  81          1HE       MET  81  -2.159  -1.109   3.353
  575   2HE   MET  81          2HE       MET  81  -0.528  -0.470   3.122
  576   3HE   MET  81          3HE       MET  81  -0.813  -2.211   3.057
  577    H    MET  82           H        MET  82  -4.031   1.082   2.874
  578    HA   MET  82           HA       MET  82  -2.867   0.629   5.436
  579   1HB   MET  82          2HB       MET  82  -2.941   2.858   3.438
  580   2HB   MET  82          1HB       MET  82  -2.290   3.152   5.053
  581   1HG   MET  82          2HG       MET  82  -0.802   1.116   4.593
  582   2HG   MET  82          1HG       MET  82  -1.277   1.327   2.909
  583   1HE   MET  82          1HE       MET  82   0.605   2.173   5.790
  584   2HE   MET  82          2HE       MET  82   0.381   3.920   5.873
  585   3HE   MET  82          3HE       MET  82   1.888   3.253   5.243
  586    H    VAL  83           H        VAL  83  -5.690   2.274   4.206
  587    HA   VAL  83           HA       VAL  83  -6.244   3.830   6.518
  588    HB   VAL  83           HB       VAL  83  -8.176   2.854   4.404
  589   1HG1  VAL  83          1HG1      VAL  83  -9.375   5.002   5.097
  590   2HG1  VAL  83          2HG1      VAL  83  -8.365   4.952   6.543
  591   3HG1  VAL  83          3HG1      VAL  83  -9.472   3.624   6.195
  592   1HG2  VAL  83          1HG2      VAL  83  -7.541   4.532   3.024
  593   2HG2  VAL  83          2HG2      VAL  83  -6.012   4.368   3.895
  594   3HG2  VAL  83          3HG2      VAL  83  -7.160   5.625   4.355
  595    H    ARG  84           H        ARG  84  -6.965   0.554   5.539
  596    HA   ARG  84           HA       ARG  84  -8.972   0.042   7.488
  597   1HB   ARG  84          2HB       ARG  84  -7.169  -1.872   5.996
  598   2HB   ARG  84          1HB       ARG  84  -8.582  -2.336   6.934
  599   1HG   ARG  84          2HG       ARG  84  -9.428  -0.351   5.121
  600   2HG   ARG  84          1HG       ARG  84  -8.421  -1.489   4.215
  601   1HD   ARG  84          2HD       ARG  84 -10.383  -2.607   4.044
  602   2HD   ARG  84          1HD       ARG  84  -9.886  -3.234   5.615
  603    HE   ARG  84           HE       ARG  84 -11.711  -2.213   6.501
  604   1HH1  ARG  84          1HH1      ARG  84 -10.840  -0.512   3.580
  605   2HH1  ARG  84          2HH1      ARG  84 -12.179   0.583   3.671
  606   1HH2  ARG  84          1HH2      ARG  84 -13.472  -0.772   6.621
  607   2HH2  ARG  84          2HH2      ARG  84 -13.672   0.435   5.396
  608    H    GLN  85           H        GLN  85  -5.524   0.160   7.600
  609    HA   GLN  85           HA       GLN  85  -5.514  -1.198  10.209
  610   1HB   GLN  85          2HB       GLN  85  -2.996  -0.412   8.798
  611   2HB   GLN  85          1HB       GLN  85  -3.292  -1.765   9.888
  612   1HG   GLN  85          2HG       GLN  85  -4.042  -1.511   6.990
  613   2HG   GLN  85          1HG       GLN  85  -2.956  -2.683   7.745
  614   1HE2  GLN  85          1HE2      GLN  85  -4.859  -3.638   6.135
  615   2HE2  GLN  85          2HE2      GLN  85  -6.111  -4.413   7.038
  616    H    MET  86           H        MET  86  -5.191   1.853   8.675
  617    HA   MET  86           HA       MET  86  -3.669   3.127  10.736
  618   1HB   MET  86          2HB       MET  86  -5.024   3.936   8.234
  619   2HB   MET  86          1HB       MET  86  -4.860   5.191   9.463
  620   1HG   MET  86          2HG       MET  86  -2.402   4.577   9.552
  621   2HG   MET  86          1HG       MET  86  -2.691   3.638   8.083
  622   1HE   MET  86          1HE       MET  86  -1.545   4.476   6.346
  623   2HE   MET  86          2HE       MET  86  -1.704   6.056   5.578
  624   3HE   MET  86          3HE       MET  86  -3.059   4.925   5.557
  625    H    LYS  87           H        LYS  87  -7.100   2.867   9.928
  626    HA   LYS  87           HA       LYS  87  -7.990   4.652  11.959
  627   1HB   LYS  87          2HB       LYS  87  -9.269   2.700  10.108
  628   2HB   LYS  87          1HB       LYS  87 -10.188   3.206  11.526
  629   1HG   LYS  87          2HG       LYS  87 -10.732   5.119  10.557
  630   2HG   LYS  87          1HG       LYS  87  -9.032   5.499  10.247
  631   1HD   LYS  87          2HD       LYS  87 -10.310   5.442   8.169
  632   2HD   LYS  87          1HD       LYS  87  -9.107   4.152   8.206
  633   1HE   LYS  87          2HE       LYS  87 -11.056   3.139   7.378
  634   2HE   LYS  87          1HE       LYS  87 -10.973   2.654   9.070
  635   1HZ   LYS  87          1HZ       LYS  87 -12.897   4.360   7.723
  636   2HZ   LYS  87          2HZ       LYS  87 -12.420   4.878   9.261
  637   3HZ   LYS  87          3HZ       LYS  87 -13.099   3.342   9.060
  638    H    GLU  88           H        GLU  88  -6.448   3.555  13.559
  639    HA   GLU  88           HA       GLU  88  -7.246   1.055  14.688
  640   1HB   GLU  88          2HB       GLU  88  -4.932   1.857  14.829
  641   2HB   GLU  88          1HB       GLU  88  -5.457   3.219  15.810
  642   1HG   GLU  88          2HG       GLU  88  -4.567   1.665  17.315
  643   2HG   GLU  88          1HG       GLU  88  -6.317   1.518  17.471
  644    H    ASP  89           H        ASP  89  -7.115   4.243  16.279
  645    HA   ASP  89           HA       ASP  89  -9.829   4.062  17.182
  646   1HB   ASP  89          2HB       ASP  89  -8.088   2.636  18.719
  647   2HB   ASP  89          1HB       ASP  89  -8.033   4.209  19.519
  648    H    ALA  90           H        ALA  90  -6.657   5.542  17.779
  649    HA   ALA  90           HA       ALA  90  -7.977   8.171  17.737
  650   1HB   ALA  90          1HB       ALA  90  -5.927   8.701  19.382
  651   2HB   ALA  90          2HB       ALA  90  -6.227   7.019  19.819
  652   3HB   ALA  90          3HB       ALA  90  -7.522   8.210  19.952
  653   2H    ARG 115          HN2       ARG 115   2.532  -1.515  10.029
  654    H    ARG 115           H        ARG 115   1.702  -2.301  11.308
  655   3H    ARG 115          HN3       ARG 115   2.551  -3.227  10.143
  656    HA   ARG 115           HA       ARG 115   1.059  -2.755   8.482
  657   1HB   ARG 115          2HB       ARG 115  -1.083  -3.492   9.484
  658   2HB   ARG 115          1HB       ARG 115   0.288  -4.429  10.062
  659   1HG   ARG 115          2HG       ARG 115   0.120  -3.633  12.185
  660   2HG   ARG 115          1HG       ARG 115  -0.547  -2.082  11.669
  661   1HD   ARG 115          2HD       ARG 115  -2.669  -3.220  11.117
  662   2HD   ARG 115          1HD       ARG 115  -1.994  -4.726  11.735
  663    HE   ARG 115           HE       ARG 115  -1.706  -3.037  13.820
  664   1HH1  ARG 115          1HH1      ARG 115  -4.428  -3.868  11.799
  665   2HH1  ARG 115          2HH1      ARG 115  -5.597  -3.597  13.048
  666   1HH2  ARG 115          1HH2      ARG 115  -3.242  -2.679  15.462
  667   2HH2  ARG 115          2HH2      ARG 115  -4.924  -2.922  15.128
  668    H    MET 116           H        MET 116   0.745  -0.570  11.196
  669    HA   MET 116           HA       MET 116  -1.251   1.044   9.823
  670   1HB   MET 116          2HB       MET 116  -1.523   0.754  12.217
  671   2HB   MET 116          1HB       MET 116   0.096   1.371  12.510
  672   1HG   MET 116          2HG       MET 116  -1.182   3.374  11.054
  673   2HG   MET 116          1HG       MET 116  -2.389   2.793  12.200
  674   1HE   MET 116          1HE       MET 116  -1.718   5.152  14.882
  675   2HE   MET 116          2HE       MET 116  -2.817   4.188  13.896
  676   3HE   MET 116          3HE       MET 116  -2.069   5.638  13.224
  677    H    SER 117           H        SER 117   1.810   1.869  11.458
  678    HA   SER 117           HA       SER 117   2.165   4.178   9.790
  679   1HB   SER 117          2HB       SER 117   4.055   4.677  11.125
  680   2HB   SER 117          1HB       SER 117   2.892   3.943  12.229
  681    HG   SER 117           HG       SER 117   5.228   2.817  11.117
  682    H    ALA 118           H        ALA 118   1.992   2.491   7.901
  683    HA   ALA 118           HA       ALA 118   4.478   1.183   7.240
  684   1HB   ALA 118          1HB       ALA 118   2.630   1.447   5.031
  685   2HB   ALA 118          2HB       ALA 118   1.827   0.852   6.483
  686   3HB   ALA 118          3HB       ALA 118   3.226  -0.004   5.835
  687    H    ASP 119           H        ASP 119   3.582   4.335   7.225
  688    HA   ASP 119           HA       ASP 119   4.166   5.423   4.780
  689   1HB   ASP 119          2HB       ASP 119   3.463   6.595   6.946
  690   2HB   ASP 119          1HB       ASP 119   5.177   6.637   7.346
  691    H    ALA 120           H        ALA 120   6.348   3.919   7.028
  692    HA   ALA 120           HA       ALA 120   8.786   5.008   6.289
  693   1HB   ALA 120          1HB       ALA 120   8.037   3.054   7.991
  694   2HB   ALA 120          2HB       ALA 120   9.710   3.361   7.524
  695   3HB   ALA 120          3HB       ALA 120   8.788   2.093   6.717
  696    H    MET 121           H        MET 121   7.638   1.846   5.083
  697    HA   MET 121           HA       MET 121   9.422   1.657   2.963
  698   1HB   MET 121          2HB       MET 121   8.128  -0.260   3.668
  699   2HB   MET 121          1HB       MET 121   6.624   0.541   3.232
  700   1HG   MET 121          2HG       MET 121   8.040   0.585   0.878
  701   2HG   MET 121          1HG       MET 121   8.495  -0.964   1.587
  702   1HE   MET 121          1HE       MET 121   4.717   0.510   2.283
  703   2HE   MET 121          2HE       MET 121   4.255   0.429   0.583
  704   3HE   MET 121          3HE       MET 121   5.627   1.422   1.077
  705    H    LEU 122           H        LEU 122   6.388   3.359   3.232
  706    HA   LEU 122           HA       LEU 122   6.018   3.889   0.474
  707   1HB   LEU 122          2HB       LEU 122   4.947   5.067   3.012
  708   2HB   LEU 122          1HB       LEU 122   4.633   5.865   1.484
  709    HG   LEU 122           HG       LEU 122   3.682   3.628   0.688
  710   1HD1  LEU 122          1HD1      LEU 122   3.312   3.051   3.600
  711   2HD1  LEU 122          2HD1      LEU 122   4.728   2.453   2.737
  712   3HD1  LEU 122          3HD1      LEU 122   3.113   1.979   2.215
  713   1HD2  LEU 122          1HD2      LEU 122   2.371   5.661   1.329
  714   2HD2  LEU 122          2HD2      LEU 122   2.210   4.973   2.945
  715   3HD2  LEU 122          3HD2      LEU 122   1.520   4.133   1.556
  716    H    ARG 123           H        ARG 123   7.666   5.582   3.096
  717    HA   ARG 123           HA       ARG 123   8.430   7.760   1.320
  718   1HB   ARG 123          2HB       ARG 123   7.763   7.955   3.827
  719   2HB   ARG 123          1HB       ARG 123   9.414   7.432   4.137
  720   1HG   ARG 123          2HG       ARG 123  10.310   9.342   3.042
  721   2HG   ARG 123          1HG       ARG 123   8.724   9.806   2.424
  722   1HD   ARG 123          2HD       ARG 123   9.502  11.137   4.391
  723   2HD   ARG 123          1HD       ARG 123   7.944  10.341   4.613
  724    HE   ARG 123           HE       ARG 123   8.868   9.061   6.276
  725   1HH1  ARG 123          1HH1      ARG 123  11.427  10.612   4.478
  726   2HH1  ARG 123          2HH1      ARG 123  12.667  10.133   5.587
  727   1HH2  ARG 123          1HH2      ARG 123  10.497   8.432   7.737
  728   2HH2  ARG 123          2HH2      ARG 123  12.139   8.895   7.438
  729    H    ALA 124           H        ALA 124   9.461   4.775   1.436
  730    HA   ALA 124           HA       ALA 124  12.277   5.076   1.880
  731   1HB   ALA 124          1HB       ALA 124  10.638   2.951   1.933
  732   2HB   ALA 124          2HB       ALA 124  12.381   2.826   1.698
  733   3HB   ALA 124          3HB       ALA 124  11.298   2.778   0.306
  734    H    LEU 125           H        LEU 125  10.587   3.970  -1.046
  735    HA   LEU 125           HA       LEU 125  12.752   4.846  -2.715
  736   1HB   LEU 125          2HB       LEU 125  10.039   3.828  -3.550
  737   2HB   LEU 125          1HB       LEU 125  11.493   3.890  -4.531
  738    HG   LEU 125           HG       LEU 125  11.485   2.278  -2.012
  739   1HD1  LEU 125          1HD1      LEU 125   9.585   1.342  -2.929
  740   2HD1  LEU 125          2HD1      LEU 125  10.868   0.337  -3.602
  741   3HD1  LEU 125          3HD1      LEU 125  10.131   1.600  -4.587
  742   1HD2  LEU 125          1HD2      LEU 125  12.775   1.332  -4.474
  743   2HD2  LEU 125          2HD2      LEU 125  13.382   1.390  -2.819
  744   3HD2  LEU 125          3HD2      LEU 125  13.419   2.840  -3.822
  745    H    LEU 126           H        LEU 126   9.952   6.314  -1.469
  746    HA   LEU 126           HA       LEU 126   9.001   8.352  -1.776
  747   1HB   LEU 126          2HB       LEU 126  11.641   8.677  -3.113
  748   2HB   LEU 126          1HB       LEU 126  10.424   9.907  -3.392
  749    HG   LEU 126           HG       LEU 126  11.225   9.075  -0.615
  750   1HD1  LEU 126          1HD1      LEU 126  13.048  10.071  -2.327
  751   2HD1  LEU 126          2HD1      LEU 126  13.039  10.411  -0.596
  752   3HD1  LEU 126          3HD1      LEU 126  12.334  11.568  -1.725
  753   1HD2  LEU 126          1HD2      LEU 126   9.098  10.445  -1.268
  754   2HD2  LEU 126          2HD2      LEU 126  10.250  11.768  -1.448
  755   3HD2  LEU 126          3HD2      LEU 126  10.090  10.942   0.102
  756    H    GLY 127           H        GLY 127  10.516   8.014  -4.978
  757   1HA   GLY 127          2HA       GLY 127   9.323   7.201  -6.907
  758   2HA   GLY 127          1HA       GLY 127   7.825   7.692  -6.133
  759    H    SER 128           H        SER 128  10.695   8.820  -7.808
  760    HA   SER 128           HA       SER 128   9.197  11.040  -8.892
  761   1HB   SER 128          2HB       SER 128  10.749  12.774  -8.164
  762   2HB   SER 128          1HB       SER 128  10.070  11.957  -6.758
  763    HG   SER 128           HG       SER 128  12.522  12.343  -7.046
  764    H    LYS 129           H        LYS 129   9.540  10.213 -10.919
  765    HA   LYS 129           HA       LYS 129  12.303   9.776 -11.788
  766   1HB   LYS 129          2HB       LYS 129  10.313   8.145 -12.213
  767   2HB   LYS 129          1HB       LYS 129   9.891   9.267 -13.500
  768   1HG   LYS 129          2HG       LYS 129  11.709   8.720 -14.767
  769   2HG   LYS 129          1HG       LYS 129  12.685   8.267 -13.368
  770   1HD   LYS 129          2HD       LYS 129  12.252   6.201 -14.279
  771   2HD   LYS 129          1HD       LYS 129  10.909   6.348 -13.143
  772   1HE   LYS 129          2HE       LYS 129   9.362   6.609 -14.792
  773   2HE   LYS 129          1HE       LYS 129  10.497   7.407 -15.880
  774   1HZ   LYS 129          1HZ       LYS 129   9.765   5.126 -16.558
  775   2HZ   LYS 129          2HZ       LYS 129  10.639   4.516 -15.245
  776   3HZ   LYS 129          3HZ       LYS 129  11.441   5.346 -16.482
  777    H    HIS 130           H        HIS 130  11.258  12.448 -11.302
  778    HA   HIS 130           HA       HIS 130  11.305  14.519 -12.238
  779   1HB   HIS 130          2HB       HIS 130  13.277  12.994 -13.580
  780   2HB   HIS 130          1HB       HIS 130  12.457  13.953 -14.808
  781    HD1  HIS 130           1HD      HIS 130  14.085  15.790 -15.240
  782    HD2  HIS 130           2HD      HIS 130  13.436  15.185 -11.181
  783    HE1  HIS 130           1HE      HIS 130  15.309  17.654 -14.079
  784    HE2  HIS 130           2HE      HIS 130  14.830  17.317 -11.628
  785    H    LYS 131           H        LYS 131   9.017  12.812 -12.695
  786    HA   LYS 131           HA       LYS 131   8.110  13.096 -15.378
  787   1HB   LYS 131          2HB       LYS 131   6.923  12.233 -12.791
  788   2HB   LYS 131          1HB       LYS 131   5.812  12.742 -14.054
  789   1HG   LYS 131          2HG       LYS 131   7.400  11.085 -15.463
  790   2HG   LYS 131          1HG       LYS 131   7.495  10.338 -13.867
  791   1HD   LYS 131          2HD       LYS 131   4.831  11.134 -14.952
  792   2HD   LYS 131          1HD       LYS 131   5.599   9.661 -15.545
  793   1HE   LYS 131          2HE       LYS 131   5.247  10.232 -12.614
  794   2HE   LYS 131          1HE       LYS 131   4.011   9.418 -13.572
  795   1HZ   LYS 131          1HZ       LYS 131   5.341   7.764 -12.543
  796   2HZ   LYS 131          2HZ       LYS 131   6.780   8.490 -13.055
  797   3HZ   LYS 131          3HZ       LYS 131   5.750   7.766 -14.185
  Start of MODEL    8
    1   2H    ALA   1          HN2       ALA   1 -15.222  -0.841 -15.642
    2    H    ALA   1           H        ALA   1 -15.257   0.438 -14.497
    3   3H    ALA   1          HN3       ALA   1 -13.989  -0.715 -14.455
    4    HA   ALA   1           HA       ALA   1 -16.837  -1.149 -13.874
    5   1HB   ALA   1          1HB       ALA   1 -16.418  -3.445 -13.653
    6   2HB   ALA   1          2HB       ALA   1 -14.670  -3.220 -13.712
    7   3HB   ALA   1          3HB       ALA   1 -15.637  -2.991 -15.169
    8    H    SER   2           H        SER   2 -17.197  -0.355 -11.915
    9    HA   SER   2           HA       SER   2 -15.028  -0.064 -10.010
   10   1HB   SER   2          2HB       SER   2 -17.927   0.786  -9.977
   11   2HB   SER   2          1HB       SER   2 -16.849   1.010  -8.600
   12    HG   SER   2           HG       SER   2 -16.408   2.815  -9.602
   13    H    MET   3           H        MET   3 -15.960  -0.467  -7.594
   14    HA   MET   3           HA       MET   3 -17.509  -2.838  -7.262
   15   1HB   MET   3          2HB       MET   3 -14.622  -3.091  -7.607
   16   2HB   MET   3          1HB       MET   3 -15.176  -3.767  -6.082
   17   1HG   MET   3          2HG       MET   3 -16.178  -4.491  -8.825
   18   2HG   MET   3          1HG       MET   3 -15.125  -5.464  -7.799
   19   1HE   MET   3          1HE       MET   3 -18.989  -5.663  -8.785
   20   2HE   MET   3          2HE       MET   3 -18.326  -4.035  -8.654
   21   3HE   MET   3          3HE       MET   3 -19.531  -4.592  -7.494
   22    H    THR   4           H        THR   4 -15.006  -0.756  -5.869
   23    HA   THR   4           HA       THR   4 -16.684  -0.245  -3.574
   24    HB   THR   4           HB       THR   4 -15.448  -2.330  -2.974
   25    HG1  THR   4           1HG      THR   4 -14.750  -1.521  -0.961
   26   1HG2  THR   4          1HG2      THR   4 -12.991  -0.599  -2.946
   27   2HG2  THR   4          2HG2      THR   4 -13.341  -1.812  -4.178
   28   3HG2  THR   4          3HG2      THR   4 -13.115  -2.301  -2.498
   29    H    ASP   5           H        ASP   5 -16.559   1.853  -3.188
   30    HA   ASP   5           HA       ASP   5 -14.505   3.462  -4.380
   31   1HB   ASP   5          2HB       ASP   5 -16.715   4.276  -2.480
   32   2HB   ASP   5          1HB       ASP   5 -15.742   5.362  -3.476
   33    H    GLN   6           H        GLN   6 -14.447   1.656  -1.631
   34    HA   GLN   6           HA       GLN   6 -13.490   3.306   0.379
   35   1HB   GLN   6          2HB       GLN   6 -12.507   1.339   1.364
   36   2HB   GLN   6          1HB       GLN   6 -14.045   0.897   0.637
   37   1HG   GLN   6          2HG       GLN   6 -13.083  -0.413  -0.943
   38   2HG   GLN   6          1HG       GLN   6 -11.622   0.567  -1.029
   39   1HE2  GLN   6          1HE2      GLN   6 -10.587  -1.558  -1.028
   40   2HE2  GLN   6          2HE2      GLN   6 -10.251  -2.316   0.487
   41    H    GLN   7           H        GLN   7 -11.964   2.328  -2.558
   42    HA   GLN   7           HA       GLN   7  -9.279   2.898  -1.698
   43   1HB   GLN   7          2HB       GLN   7 -10.201   2.723  -4.557
   44   2HB   GLN   7          1HB       GLN   7  -8.607   2.378  -3.904
   45   1HG   GLN   7          2HG       GLN   7  -9.146   0.282  -3.318
   46   2HG   GLN   7          1HG       GLN   7 -10.787   0.712  -2.847
   47   1HE2  GLN   7          1HE2      GLN   7  -9.165   1.257  -5.930
   48   2HE2  GLN   7          2HE2      GLN   7 -10.239   0.286  -6.872
   49    H    ALA   8           H        ALA   8 -11.926   4.695  -2.949
   50    HA   ALA   8           HA       ALA   8 -10.346   6.875  -3.968
   51   1HB   ALA   8          1HB       ALA   8 -12.274   7.680  -4.824
   52   2HB   ALA   8          2HB       ALA   8 -13.192   7.343  -3.357
   53   3HB   ALA   8          3HB       ALA   8 -12.854   6.046  -4.503
   54    H    GLU   9           H        GLU   9 -12.482   6.370  -1.162
   55    HA   GLU   9           HA       GLU   9 -12.124   8.866   0.036
   56   1HB   GLU   9          2HB       GLU   9 -12.434   6.300   1.588
   57   2HB   GLU   9          1HB       GLU   9 -13.003   7.905   2.024
   58   1HG   GLU   9          2HG       GLU   9 -14.284   7.450  -0.354
   59   2HG   GLU   9          1HG       GLU   9 -14.258   5.846   0.390
   60    H    ALA  10           H        ALA  10 -10.211   5.935   0.143
   61    HA   ALA  10           HA       ALA  10  -8.461   6.331   2.188
   62   1HB   ALA  10          1HB       ALA  10  -6.765   5.325   0.409
   63   2HB   ALA  10          2HB       ALA  10  -8.266   5.073  -0.489
   64   3HB   ALA  10          3HB       ALA  10  -8.065   4.366   1.116
   65    H    ARG  11           H        ARG  11  -7.823   7.398  -1.159
   66    HA   ARG  11           HA       ARG  11  -5.535   8.864  -0.687
   67   1HB   ARG  11          2HB       ARG  11  -7.491   8.634  -2.809
   68   2HB   ARG  11          1HB       ARG  11  -6.924  10.293  -2.664
   69   1HG   ARG  11          2HG       ARG  11  -4.583   9.404  -2.756
   70   2HG   ARG  11          1HG       ARG  11  -5.273   7.827  -3.146
   71   1HD   ARG  11          2HD       ARG  11  -4.700   8.832  -5.209
   72   2HD   ARG  11          1HD       ARG  11  -6.454   8.951  -5.069
   73    HE   ARG  11           HE       ARG  11  -5.591  11.308  -4.061
   74   1HH1  ARG  11          1HH1      ARG  11  -4.951   9.610  -7.041
   75   2HH1  ARG  11          2HH1      ARG  11  -4.697  11.058  -7.958
   76   1HH2  ARG  11          1HH2      ARG  11  -5.256  13.213  -5.264
   77   2HH2  ARG  11          2HH2      ARG  11  -4.870  13.103  -6.948
   78    H    ALA  12           H        ALA  12  -8.830   9.665   0.035
   79    HA   ALA  12           HA       ALA  12  -8.192  12.456   0.576
   80   1HB   ALA  12          1HB       ALA  12 -10.638  12.571   1.183
   81   2HB   ALA  12          2HB       ALA  12 -10.763  10.894   0.649
   82   3HB   ALA  12          3HB       ALA  12 -10.283  12.151  -0.492
   83    H    PHE  13           H        PHE  13  -8.499   9.445   2.240
   84    HA   PHE  13           HA       PHE  13  -9.015  10.574   4.830
   85   1HB   PHE  13          2HB       PHE  13  -9.345   8.098   3.821
   86   2HB   PHE  13          1HB       PHE  13  -7.787   7.881   4.624
   87    HD1  PHE  13           1HD      PHE  13 -11.304   7.911   5.029
   88    HD2  PHE  13           2HD      PHE  13  -7.651   8.630   7.089
   89    HE1  PHE  13           1HE      PHE  13 -12.464   7.616   7.180
   90    HE2  PHE  13           2HE      PHE  13  -8.803   8.336   9.243
   91    HZ   PHE  13           HZ       PHE  13 -11.212   7.829   9.291
   92    H    LEU  14           H        LEU  14  -6.207   9.851   2.923
   93    HA   LEU  14           HA       LEU  14  -4.460  10.388   5.224
   94   1HB   LEU  14          2HB       LEU  14  -3.667   9.313   2.520
   95   2HB   LEU  14          1HB       LEU  14  -2.679   9.371   3.974
   96    HG   LEU  14           HG       LEU  14  -5.197   7.726   3.764
   97   1HD1  LEU  14          1HD1      LEU  14  -3.460   7.061   2.089
   98   2HD1  LEU  14          2HD1      LEU  14  -3.861   5.818   3.274
   99   3HD1  LEU  14          3HD1      LEU  14  -2.370   6.745   3.440
  100   1HD2  LEU  14          1HD2      LEU  14  -4.340   6.606   5.717
  101   2HD2  LEU  14          2HD2      LEU  14  -4.407   8.341   6.026
  102   3HD2  LEU  14          3HD2      LEU  14  -2.862   7.568   5.666
  103    H    SER  15           H        SER  15  -2.702  11.853   4.994
  104    HA   SER  15           HA       SER  15  -3.387  14.237   3.588
  105   1HB   SER  15          2HB       SER  15  -1.893  13.739   5.793
  106   2HB   SER  15          1HB       SER  15  -0.610  13.933   4.589
  107    HG   SER  15           HG       SER  15  -1.566  15.872   5.785
  108    H    GLU  16           H        GLU  16  -1.912  15.353   2.071
  109    HA   GLU  16           HA       GLU  16  -1.425  13.916  -0.235
  110   1HB   GLU  16          2HB       GLU  16  -0.504  16.538   0.820
  111   2HB   GLU  16          1HB       GLU  16   0.378  15.878  -0.550
  112   1HG   GLU  16          2HG       GLU  16  -2.527  15.777  -0.846
  113   2HG   GLU  16          1HG       GLU  16  -1.869  17.406  -0.705
  114    H    GLU  17           H        GLU  17   0.514  14.238   2.613
  115    HA   GLU  17           HA       GLU  17   3.024  13.481   1.629
  116   1HB   GLU  17          2HB       GLU  17   1.678  13.570   4.265
  117   2HB   GLU  17          1HB       GLU  17   3.058  12.482   4.145
  118   1HG   GLU  17          2HG       GLU  17   4.535  14.159   4.073
  119   2HG   GLU  17          1HG       GLU  17   3.522  15.140   3.015
  120    H    MET  18           H        MET  18   0.572  11.474   3.269
  121    HA   MET  18           HA       MET  18   1.815   9.015   2.953
  122   1HB   MET  18          2HB       MET  18  -0.539   9.891   4.050
  123   2HB   MET  18          1HB       MET  18  -1.109   8.929   2.686
  124   1HG   MET  18          2HG       MET  18  -1.004   7.561   4.654
  125   2HG   MET  18          1HG       MET  18   0.222   7.029   3.505
  126   1HE   MET  18          1HE       MET  18   0.609   5.818   6.180
  127   2HE   MET  18          2HE       MET  18  -0.327   7.059   7.012
  128   3HE   MET  18          3HE       MET  18   1.350   6.762   7.473
  129    H    ILE  19           H        ILE  19   0.224  10.971   0.596
  130    HA   ILE  19           HA       ILE  19  -0.272   8.829  -1.265
  131    HB   ILE  19           HB       ILE  19  -0.442  11.829  -1.481
  132   1HG1  ILE  19          2HG1      ILE  19  -2.501   9.613  -1.607
  133   2HG1  ILE  19          1HG1      ILE  19  -2.238  10.717  -0.255
  134   1HG2  ILE  19          1HG2      ILE  19  -1.493  11.366  -3.747
  135   2HG2  ILE  19          2HG2      ILE  19  -0.737   9.775  -3.655
  136   3HG2  ILE  19          3HG2      ILE  19   0.263  11.229  -3.644
  137   1HD1  ILE  19          1HD1      ILE  19  -4.191  11.169  -1.844
  138   2HD1  ILE  19          2HD1      ILE  19  -2.964  11.741  -2.972
  139   3HD1  ILE  19          3HD1      ILE  19  -3.149  12.521  -1.401
  140    H    ALA  20           H        ALA  20   1.793  11.732  -1.452
  141    HA   ALA  20           HA       ALA  20   3.286  11.078  -3.650
  142   1HB   ALA  20          1HB       ALA  20   4.109  12.560  -1.164
  143   2HB   ALA  20          2HB       ALA  20   3.481  13.232  -2.669
  144   3HB   ALA  20          3HB       ALA  20   5.083  12.495  -2.634
  145    H    GLU  21           H        GLU  21   3.463   9.680  -0.485
  146    HA   GLU  21           HA       GLU  21   6.000   8.369  -1.022
  147   1HB   GLU  21          2HB       GLU  21   4.177   8.098   1.376
  148   2HB   GLU  21          1HB       GLU  21   5.835   7.526   1.251
  149   1HG   GLU  21          2HG       GLU  21   5.003  10.413   1.114
  150   2HG   GLU  21          1HG       GLU  21   5.607   9.602   2.558
  151    H    PHE  22           H        PHE  22   2.575   7.713  -0.950
  152    HA   PHE  22           HA       PHE  22   2.644   4.906  -0.915
  153   1HB   PHE  22          2HB       PHE  22   0.435   5.284  -0.820
  154   2HB   PHE  22          1HB       PHE  22   0.680   6.962  -1.278
  155    HD1  PHE  22           1HD      PHE  22  -0.763   3.876  -2.202
  156    HD2  PHE  22           2HD      PHE  22   0.931   7.425  -3.824
  157    HE1  PHE  22           1HE      PHE  22  -1.920   3.453  -4.333
  158    HE2  PHE  22           2HE      PHE  22  -0.222   7.008  -5.955
  159    HZ   PHE  22           HZ       PHE  22  -1.650   5.019  -6.212
  160    H    LYS  23           H        LYS  23   3.062   7.258  -3.462
  161    HA   LYS  23           HA       LYS  23   2.992   5.376  -5.613
  162   1HB   LYS  23          2HB       LYS  23   2.529   7.893  -5.726
  163   2HB   LYS  23          1HB       LYS  23   4.281   8.097  -5.692
  164   1HG   LYS  23          2HG       LYS  23   3.640   8.176  -7.958
  165   2HG   LYS  23          1HG       LYS  23   4.378   6.593  -7.710
  166   1HD   LYS  23          2HD       LYS  23   2.340   5.483  -7.822
  167   2HD   LYS  23          1HD       LYS  23   1.415   6.943  -7.444
  168   1HE   LYS  23          2HE       LYS  23   1.321   7.579  -9.594
  169   2HE   LYS  23          1HE       LYS  23   3.000   7.133  -9.899
  170   1HZ   LYS  23          1HZ       LYS  23   0.793   5.160  -9.697
  171   2HZ   LYS  23          2HZ       LYS  23   2.376   4.880 -10.224
  172   3HZ   LYS  23          3HZ       LYS  23   1.327   5.820 -11.161
  173    H    ALA  24           H        ALA  24   5.275   6.162  -3.247
  174    HA   ALA  24           HA       ALA  24   7.738   6.125  -4.389
  175   1HB   ALA  24          1HB       ALA  24   8.546   4.995  -2.337
  176   2HB   ALA  24          2HB       ALA  24   6.868   4.680  -1.891
  177   3HB   ALA  24          3HB       ALA  24   7.449   6.339  -2.015
  178    H    ALA  25           H        ALA  25   6.669   3.070  -2.950
  179    HA   ALA  25           HA       ALA  25   8.295   1.563  -4.750
  180   1HB   ALA  25          1HB       ALA  25   7.831   0.991  -2.344
  181   2HB   ALA  25          2HB       ALA  25   7.667  -0.339  -3.491
  182   3HB   ALA  25          3HB       ALA  25   6.229   0.466  -2.862
  183    H    PHE  26           H        PHE  26   5.250   2.880  -5.140
  184    HA   PHE  26           HA       PHE  26   3.640   0.990  -6.267
  185   1HB   PHE  26          2HB       PHE  26   3.592   3.711  -6.115
  186   2HB   PHE  26          1HB       PHE  26   3.769   3.468  -7.849
  187    HD1  PHE  26           1HD      PHE  26   1.848   3.314  -9.083
  188    HD2  PHE  26           2HD      PHE  26   1.774   2.098  -5.005
  189    HE1  PHE  26           1HE      PHE  26  -0.564   2.863  -9.264
  190    HE2  PHE  26           2HE      PHE  26  -0.637   1.645  -5.179
  191    HZ   PHE  26           HZ       PHE  26  -1.810   2.027  -7.312
  192    H    ASP  27           H        ASP  27   6.563   2.332  -7.621
  193    HA   ASP  27           HA       ASP  27   6.091   1.242 -10.253
  194   1HB   ASP  27          2HB       ASP  27   8.406   2.667  -8.961
  195   2HB   ASP  27          1HB       ASP  27   8.554   1.938 -10.558
  196    H    MET  28           H        MET  28   8.588   0.665  -7.768
  197    HA   MET  28           HA       MET  28   9.647  -1.646  -8.929
  198   1HB   MET  28          2HB       MET  28   9.595  -0.700  -6.065
  199   2HB   MET  28          1HB       MET  28  10.476  -2.131  -6.581
  200   1HG   MET  28          2HG       MET  28  12.155  -0.625  -6.707
  201   2HG   MET  28          1HG       MET  28  11.487  -0.418  -8.331
  202   1HE   MET  28          1HE       MET  28  12.321   3.267  -7.731
  203   2HE   MET  28          2HE       MET  28  12.306   1.921  -8.870
  204   3HE   MET  28          3HE       MET  28  13.307   1.839  -7.420
  205    H    PHE  29           H        PHE  29   6.796  -1.165  -7.010
  206    HA   PHE  29           HA       PHE  29   6.389  -3.743  -6.020
  207   1HB   PHE  29          2HB       PHE  29   4.815  -1.324  -6.365
  208   2HB   PHE  29          1HB       PHE  29   3.842  -2.773  -6.631
  209    HD1  PHE  29           1HD      PHE  29   5.163  -0.567  -4.208
  210    HD2  PHE  29           2HD      PHE  29   4.034  -4.614  -4.835
  211    HE1  PHE  29           1HE      PHE  29   4.953  -0.878  -1.777
  212    HE2  PHE  29           2HE      PHE  29   3.815  -4.936  -2.411
  213    HZ   PHE  29           HZ       PHE  29   4.277  -3.067  -0.874
  214    H    ASP  30           H        ASP  30   4.570  -2.377  -8.763
  215    HA   ASP  30           HA       ASP  30   3.635  -4.780  -9.763
  216   1HB   ASP  30          2HB       ASP  30   4.227  -2.180 -11.181
  217   2HB   ASP  30          1HB       ASP  30   3.407  -3.541 -11.953
  218    H    ALA  31           H        ALA  31   4.659  -6.472 -10.538
  219    HA   ALA  31           HA       ALA  31   7.363  -6.174 -11.610
  220   1HB   ALA  31          1HB       ALA  31   6.491  -7.945  -9.844
  221   2HB   ALA  31          2HB       ALA  31   7.760  -8.336 -11.005
  222   3HB   ALA  31          3HB       ALA  31   6.098  -8.843 -11.310
  223    H    ASP  32           H        ASP  32   4.227  -7.587 -12.495
  224    HA   ASP  32           HA       ASP  32   4.994  -8.467 -15.062
  225   1HB   ASP  32          2HB       ASP  32   2.493  -8.431 -15.507
  226   2HB   ASP  32          1HB       ASP  32   3.018  -9.401 -14.128
  227    H    GLY  33           H        GLY  33   4.329  -5.340 -13.830
  228   1HA   GLY  33          2HA       GLY  33   5.244  -3.730 -15.680
  229   2HA   GLY  33          1HA       GLY  33   3.778  -4.256 -16.496
  230    H    GLY  34           H        GLY  34   1.757  -4.080 -14.999
  231   1HA   GLY  34          2HA       GLY  34   1.830  -1.923 -13.086
  232   2HA   GLY  34          1HA       GLY  34   1.088  -1.472 -14.619
  233    H    GLY  35           H        GLY  35   0.872  -4.665 -13.150
  234   1HA   GLY  35          2HA       GLY  35  -1.998  -4.590 -13.321
  235   2HA   GLY  35          1HA       GLY  35  -1.020  -5.918 -12.698
  236    H    ASP  36           H        ASP  36  -0.922  -6.225 -10.554
  237    HA   ASP  36           HA       ASP  36  -1.683  -4.037  -8.766
  238   1HB   ASP  36          2HB       ASP  36  -2.980  -6.764  -8.830
  239   2HB   ASP  36          1HB       ASP  36  -3.092  -5.671  -7.444
  240    H    ILE  37           H        ILE  37  -1.532  -5.034  -6.380
  241    HA   ILE  37           HA       ILE  37   1.126  -6.287  -6.236
  242    HB   ILE  37           HB       ILE  37  -0.249  -4.375  -4.354
  243   1HG1  ILE  37          2HG1      ILE  37   2.387  -4.126  -5.807
  244   2HG1  ILE  37          1HG1      ILE  37   0.862  -3.495  -6.435
  245   1HG2  ILE  37          1HG2      ILE  37   0.931  -6.083  -3.060
  246   2HG2  ILE  37          2HG2      ILE  37   1.710  -4.508  -2.926
  247   3HG2  ILE  37          3HG2      ILE  37   2.405  -5.749  -3.969
  248   1HD1  ILE  37          1HD1      ILE  37   2.031  -2.705  -3.784
  249   2HD1  ILE  37          2HD1      ILE  37   0.671  -1.965  -4.631
  250   3HD1  ILE  37          3HD1      ILE  37   2.303  -1.824  -5.287
  251    H    SER  38           H        SER  38   1.152  -8.313  -5.562
  252    HA   SER  38           HA       SER  38  -1.074  -9.319  -3.936
  253   1HB   SER  38          2HB       SER  38  -0.224 -10.380  -6.204
  254   2HB   SER  38          1HB       SER  38   0.983 -11.126  -5.149
  255    HG   SER  38           HG       SER  38  -1.430 -11.977  -5.569
  256    H    THR  39           H        THR  39   0.233 -11.596  -2.909
  257    HA   THR  39           HA       THR  39   1.443 -10.486  -0.592
  258    HB   THR  39           HB       THR  39   1.814 -12.852   0.063
  259    HG1  THR  39           1HG      THR  39   1.103 -14.469  -1.354
  260   1HG2  THR  39          1HG2      THR  39  -0.614 -13.632  -0.241
  261   2HG2  THR  39          2HG2      THR  39  -0.874 -12.040  -0.953
  262   3HG2  THR  39          3HG2      THR  39  -0.300 -12.180   0.708
  263    H    LYS  40           H        LYS  40   2.692 -11.768  -3.575
  264    HA   LYS  40           HA       LYS  40   5.387 -12.037  -2.558
  265   1HB   LYS  40          2HB       LYS  40   4.013 -13.204  -4.635
  266   2HB   LYS  40          1HB       LYS  40   5.053 -12.050  -5.469
  267   1HG   LYS  40          2HG       LYS  40   6.836 -13.153  -3.782
  268   2HG   LYS  40          1HG       LYS  40   5.734 -14.519  -4.016
  269   1HD   LYS  40          2HD       LYS  40   6.946 -14.922  -5.861
  270   2HD   LYS  40          1HD       LYS  40   6.036 -13.586  -6.567
  271   1HE   LYS  40          2HE       LYS  40   8.425 -13.304  -6.945
  272   2HE   LYS  40          1HE       LYS  40   7.800 -12.031  -5.898
  273   1HZ   LYS  40          1HZ       LYS  40   9.988 -13.425  -5.351
  274   2HZ   LYS  40          2HZ       LYS  40   8.846 -14.391  -4.562
  275   3HZ   LYS  40          3HZ       LYS  40   8.997 -12.758  -4.152
  276    H    GLU  41           H        GLU  41   3.485  -9.650  -4.214
  277    HA   GLU  41           HA       GLU  41   5.688  -8.134  -5.220
  278   1HB   GLU  41          2HB       GLU  41   2.764  -7.509  -4.844
  279   2HB   GLU  41          1HB       GLU  41   3.903  -6.337  -5.488
  280   1HG   GLU  41          2HG       GLU  41   4.403  -8.521  -7.042
  281   2HG   GLU  41          1HG       GLU  41   2.668  -8.653  -6.762
  282    H    LEU  42           H        LEU  42   4.127  -8.370  -2.157
  283    HA   LEU  42           HA       LEU  42   4.925  -5.766  -1.233
  284   1HB   LEU  42          2HB       LEU  42   3.234  -7.871  -0.312
  285   2HB   LEU  42          1HB       LEU  42   4.394  -7.497   0.957
  286    HG   LEU  42           HG       LEU  42   2.417  -6.192   1.319
  287   1HD1  LEU  42          1HD1      LEU  42   4.337  -4.991   1.943
  288   2HD1  LEU  42          2HD1      LEU  42   3.359  -3.852   1.019
  289   3HD1  LEU  42          3HD1      LEU  42   4.756  -4.624   0.270
  290   1HD2  LEU  42          1HD2      LEU  42   1.138  -5.380  -0.301
  291   2HD2  LEU  42          2HD2      LEU  42   2.209  -6.180  -1.449
  292   3HD2  LEU  42          3HD2      LEU  42   2.488  -4.495  -1.012
  293    H    GLY  43           H        GLY  43   5.847  -9.057  -0.190
  294   1HA   GLY  43          2HA       GLY  43   7.947  -8.453   1.457
  295   2HA   GLY  43          1HA       GLY  43   7.901  -9.895   0.444
  296    H    THR  44           H        THR  44   7.893  -8.247  -2.022
  297    HA   THR  44           HA       THR  44  10.625  -8.260  -2.572
  298    HB   THR  44           HB       THR  44   8.190  -7.176  -3.903
  299    HG1  THR  44           1HG      THR  44   8.588  -9.139  -4.597
  300   1HG2  THR  44          1HG2      THR  44   9.789  -6.536  -5.849
  301   2HG2  THR  44          2HG2      THR  44  10.945  -6.243  -4.549
  302   3HG2  THR  44          3HG2      THR  44   9.415  -5.363  -4.586
  303    H    VAL  45           H        VAL  45   8.717  -5.277  -2.722
  304    HA   VAL  45           HA       VAL  45  10.931  -3.592  -2.298
  305    HB   VAL  45           HB       VAL  45   8.923  -2.839  -3.457
  306   1HG1  VAL  45          1HG1      VAL  45   7.059  -2.120  -1.639
  307   2HG1  VAL  45          2HG1      VAL  45   7.647  -3.622  -0.923
  308   3HG1  VAL  45          3HG1      VAL  45   7.011  -3.618  -2.569
  309   1HG2  VAL  45          1HG2      VAL  45  10.353  -1.389  -1.501
  310   2HG2  VAL  45          2HG2      VAL  45   8.668  -0.884  -1.387
  311   3HG2  VAL  45          3HG2      VAL  45   9.521  -0.767  -2.926
  312    H    MET  46           H        MET  46   8.792  -5.191  -0.076
  313    HA   MET  46           HA       MET  46   9.336  -3.460   2.138
  314   1HB   MET  46          2HB       MET  46   7.893  -6.033   1.737
  315   2HB   MET  46          1HB       MET  46   8.416  -5.633   3.374
  316   1HG   MET  46          2HG       MET  46   6.657  -3.941   1.605
  317   2HG   MET  46          1HG       MET  46   6.127  -4.925   2.975
  318   1HE   MET  46          1HE       MET  46   5.626  -3.106   5.428
  319   2HE   MET  46          2HE       MET  46   4.889  -3.275   3.835
  320   3HE   MET  46          3HE       MET  46   5.361  -1.680   4.422
  321    H    ARG  47           H        ARG  47  10.770  -6.381   0.845
  322    HA   ARG  47           HA       ARG  47  12.411  -6.818   3.187
  323   1HB   ARG  47          2HB       ARG  47  12.254  -8.152   0.490
  324   2HB   ARG  47          1HB       ARG  47  13.498  -8.560   1.663
  325   1HG   ARG  47          2HG       ARG  47  11.877  -9.326   3.233
  326   2HG   ARG  47          1HG       ARG  47  10.551  -8.715   2.242
  327   1HD   ARG  47          2HD       ARG  47  10.519 -10.942   1.682
  328   2HD   ARG  47          1HD       ARG  47  11.584 -10.297   0.428
  329    HE   ARG  47           HE       ARG  47  12.967 -11.210   2.781
  330   1HH1  ARG  47          1HH1      ARG  47  11.649 -12.145  -0.313
  331   2HH1  ARG  47          2HH1      ARG  47  12.691 -13.517  -0.481
  332   1HH2  ARG  47          1HH2      ARG  47  14.339 -13.014   2.560
  333   2HH2  ARG  47          2HH2      ARG  47  14.218 -14.011   1.149
  334    H    MET  48           H        MET  48  12.735  -5.312   0.044
  335    HA   MET  48           HA       MET  48  15.608  -4.988   0.374
  336   1HB   MET  48          2HB       MET  48  15.539  -3.940  -1.845
  337   2HB   MET  48          1HB       MET  48  14.764  -5.524  -1.849
  338   1HG   MET  48          2HG       MET  48  12.819  -4.680  -2.501
  339   2HG   MET  48          1HG       MET  48  12.881  -3.392  -1.300
  340   1HE   MET  48          1HE       MET  48  12.540  -0.718  -3.841
  341   2HE   MET  48          2HE       MET  48  12.297  -1.281  -2.188
  342   3HE   MET  48          3HE       MET  48  11.485  -2.096  -3.525
  343    H    LEU  49           H        LEU  49  13.222  -3.537   1.871
  344    HA   LEU  49           HA       LEU  49  14.395  -0.847   1.619
  345   1HB   LEU  49          2HB       LEU  49  11.568  -1.735   2.045
  346   2HB   LEU  49          1HB       LEU  49  12.092  -0.168   2.635
  347    HG   LEU  49           HG       LEU  49  12.121  -1.105  -0.232
  348   1HD1  LEU  49          1HD1      LEU  49   9.922  -0.544   0.256
  349   2HD1  LEU  49          2HD1      LEU  49  10.584   0.953  -0.398
  350   3HD1  LEU  49          3HD1      LEU  49  10.392   0.760   1.344
  351   1HD2  LEU  49          1HD2      LEU  49  13.824   0.326  -0.462
  352   2HD2  LEU  49          2HD2      LEU  49  13.554   1.049   1.124
  353   3HD2  LEU  49          3HD2      LEU  49  12.605   1.584  -0.263
  354    H    GLY  50           H        GLY  50  13.098  -3.281   3.820
  355   1HA   GLY  50          2HA       GLY  50  14.835  -3.098   5.854
  356   2HA   GLY  50          1HA       GLY  50  13.805  -1.701   6.155
  357    H    GLN  51           H        GLN  51  11.382  -2.967   5.190
  358    HA   GLN  51           HA       GLN  51  10.548  -4.189   7.608
  359   1HB   GLN  51          2HB       GLN  51   9.269  -2.977   5.521
  360   2HB   GLN  51          1HB       GLN  51   8.873  -4.672   5.236
  361   1HG   GLN  51          2HG       GLN  51   7.162  -4.237   6.614
  362   2HG   GLN  51          1HG       GLN  51   8.366  -4.496   7.876
  363   1HE2  GLN  51          1HE2      GLN  51   7.998  -3.082   9.427
  364   2HE2  GLN  51          2HE2      GLN  51   7.715  -1.391   9.214
  365    H    ASN  52           H        ASN  52   9.655  -6.341   7.856
  366    HA   ASN  52           HA       ASN  52  10.590  -8.339   5.945
  367   1HB   ASN  52          2HB       ASN  52  12.242  -7.822   7.956
  368   2HB   ASN  52          1HB       ASN  52  11.143  -8.897   8.821
  369   1HD2  ASN  52          1HD2      ASN  52  13.343  -8.632   6.111
  370   2HD2  ASN  52          2HD2      ASN  52  13.636 -10.326   5.937
  371    HA   PRO  53           HA       PRO  53   6.441  -9.116   8.144
  372   1HB   PRO  53          2HB       PRO  53   4.823  -8.763   5.987
  373   2HB   PRO  53          1HB       PRO  53   5.246  -7.455   7.098
  374   1HG   PRO  53          2HG       PRO  53   6.418  -8.122   4.424
  375   2HG   PRO  53          1HG       PRO  53   5.976  -6.538   5.088
  376   1HD   PRO  53          2HD       PRO  53   8.529  -7.424   5.048
  377   2HD   PRO  53          1HD       PRO  53   7.903  -6.385   6.349
  378    H    THR  54           H        THR  54   6.693 -11.284   8.350
  379    HA   THR  54           HA       THR  54   7.425 -13.100   6.391
  380    HB   THR  54           HB       THR  54   7.522 -13.812   8.645
  381    HG1  THR  54           1HG      THR  54   6.526 -15.748   8.505
  382   1HG2  THR  54          1HG2      THR  54   4.621 -13.094   8.800
  383   2HG2  THR  54          2HG2      THR  54   5.954 -12.557   9.823
  384   3HG2  THR  54          3HG2      THR  54   5.367 -14.217   9.937
  385    H    LYS  55           H        LYS  55   5.935 -15.010   5.738
  386    HA   LYS  55           HA       LYS  55   4.121 -14.113   3.845
  387   1HB   LYS  55          2HB       LYS  55   5.225 -16.357   3.896
  388   2HB   LYS  55          1HB       LYS  55   4.092 -16.832   5.161
  389   1HG   LYS  55          2HG       LYS  55   2.763 -17.547   3.534
  390   2HG   LYS  55          1HG       LYS  55   2.465 -15.851   3.152
  391   1HD   LYS  55          2HD       LYS  55   4.891 -17.162   2.027
  392   2HD   LYS  55          1HD       LYS  55   3.320 -17.542   1.317
  393   1HE   LYS  55          2HE       LYS  55   3.794 -15.735   0.043
  394   2HE   LYS  55          1HE       LYS  55   3.117 -14.874   1.425
  395   1HZ   LYS  55          1HZ       LYS  55   5.123 -14.078   2.026
  396   2HZ   LYS  55          2HZ       LYS  55   5.489 -14.316   0.392
  397   3HZ   LYS  55          3HZ       LYS  55   5.963 -15.463   1.540
  398    H    CYS  56           H        CYS  56   3.653 -14.664   7.228
  399    HA   CYS  56           HA       CYS  56   0.773 -14.827   7.043
  400   1HB   CYS  56          2HB       CYS  56   2.724 -14.744   9.334
  401   2HB   CYS  56          1HB       CYS  56   0.985 -14.613   9.602
  402    HG   CYS  56           HG       CYS  56   0.699 -17.028   9.104
  403    H    GLU  57           H        GLU  57   3.192 -12.382   7.639
  404    HA   GLU  57           HA       GLU  57   1.503 -10.419   8.775
  405   1HB   GLU  57          2HB       GLU  57   4.091 -10.165   7.233
  406   2HB   GLU  57          1HB       GLU  57   3.295  -8.820   8.052
  407   1HG   GLU  57          2HG       GLU  57   3.441 -10.686  10.038
  408   2HG   GLU  57          1HG       GLU  57   4.927 -10.985   9.138
  409    H    LEU  58           H        LEU  58   2.731 -10.786   5.458
  410    HA   LEU  58           HA       LEU  58   1.119  -8.687   4.416
  411   1HB   LEU  58          2HB       LEU  58   2.343 -10.917   2.808
  412   2HB   LEU  58          1HB       LEU  58   1.990  -9.271   2.294
  413    HG   LEU  58           HG       LEU  58   3.987  -9.752   4.482
  414   1HD1  LEU  58          1HD1      LEU  58   4.955 -11.159   2.928
  415   2HD1  LEU  58          2HD1      LEU  58   5.681  -9.604   2.519
  416   3HD1  LEU  58          3HD1      LEU  58   4.347 -10.235   1.554
  417   1HD2  LEU  58          1HD2      LEU  58   3.675  -7.500   4.305
  418   2HD2  LEU  58          2HD2      LEU  58   3.257  -7.576   2.593
  419   3HD2  LEU  58          3HD2      LEU  58   4.943  -7.713   3.097
  420    H    ASP  59           H        ASP  59   0.438 -11.918   5.238
  421    HA   ASP  59           HA       ASP  59  -1.689 -12.268   3.308
  422   1HB   ASP  59          2HB       ASP  59  -0.364 -13.927   5.351
  423   2HB   ASP  59          1HB       ASP  59  -2.090 -14.238   5.154
  424    H    ALA  60           H        ALA  60  -1.312 -11.187   6.592
  425    HA   ALA  60           HA       ALA  60  -4.083 -11.386   7.259
  426   1HB   ALA  60          1HB       ALA  60  -3.159  -9.596   9.047
  427   2HB   ALA  60          2HB       ALA  60  -1.644 -10.353   8.556
  428   3HB   ALA  60          3HB       ALA  60  -2.949 -11.339   9.214
  429    H    ILE  61           H        ILE  61  -2.010  -8.954   5.851
  430    HA   ILE  61           HA       ILE  61  -3.943  -6.838   6.055
  431    HB   ILE  61           HB       ILE  61  -1.282  -7.117   4.680
  432   1HG1  ILE  61          2HG1      ILE  61  -1.134  -4.907   6.224
  433   2HG1  ILE  61          1HG1      ILE  61  -2.363  -5.811   7.111
  434   1HG2  ILE  61          1HG2      ILE  61  -3.258  -4.873   4.393
  435   2HG2  ILE  61          2HG2      ILE  61  -2.483  -5.815   3.121
  436   3HG2  ILE  61          3HG2      ILE  61  -1.532  -4.682   4.081
  437   1HD1  ILE  61          1HD1      ILE  61   0.134  -6.087   7.722
  438   2HD1  ILE  61          2HD1      ILE  61   0.184  -7.144   6.311
  439   3HD1  ILE  61          3HD1      ILE  61  -0.905  -7.509   7.650
  440    H    ILE  62           H        ILE  62  -2.436  -8.421   3.230
  441    HA   ILE  62           HA       ILE  62  -4.062  -7.531   1.235
  442    HB   ILE  62           HB       ILE  62  -2.861 -10.280   1.557
  443   1HG1  ILE  62          2HG1      ILE  62  -2.003  -7.806   0.039
  444   2HG1  ILE  62          1HG1      ILE  62  -1.240  -8.465   1.488
  445   1HG2  ILE  62          1HG2      ILE  62  -4.125  -9.034  -0.882
  446   2HG2  ILE  62          2HG2      ILE  62  -4.677 -10.468  -0.019
  447   3HG2  ILE  62          3HG2      ILE  62  -3.146 -10.501  -0.893
  448   1HD1  ILE  62          1HD1      ILE  62  -1.456 -10.132  -0.975
  449   2HD1  ILE  62          2HD1      ILE  62  -0.286 -10.214   0.342
  450   3HD1  ILE  62          3HD1      ILE  62  -0.198  -8.904  -0.835
  451    H    CYS  63           H        CYS  63  -4.813  -9.960   3.644
  452    HA   CYS  63           HA       CYS  63  -7.180 -10.925   2.369
  453   1HB   CYS  63          2HB       CYS  63  -5.932 -12.258   4.035
  454   2HB   CYS  63          1HB       CYS  63  -6.362 -11.083   5.281
  455    HG   CYS  63           HG       CYS  63  -7.951 -13.316   5.079
  456    H    GLU  64           H        GLU  64  -6.485  -8.521   4.864
  457    HA   GLU  64           HA       GLU  64  -9.241  -7.896   5.341
  458   1HB   GLU  64          2HB       GLU  64  -6.966  -7.470   6.749
  459   2HB   GLU  64          1HB       GLU  64  -7.178  -5.885   6.017
  460   1HG   GLU  64          2HG       GLU  64  -9.009  -5.407   7.245
  461   2HG   GLU  64          1HG       GLU  64  -9.569  -7.078   7.265
  462    H    VAL  65           H        VAL  65  -6.618  -6.491   3.439
  463    HA   VAL  65           HA       VAL  65  -7.976  -4.165   2.607
  464    HB   VAL  65           HB       VAL  65  -5.823  -5.664   1.105
  465   1HG1  VAL  65          1HG1      VAL  65  -7.140  -3.882  -0.117
  466   2HG1  VAL  65          2HG1      VAL  65  -5.393  -3.655  -0.060
  467   3HG1  VAL  65          3HG1      VAL  65  -6.438  -2.722   1.011
  468   1HG2  VAL  65          1HG2      VAL  65  -4.295  -3.998   2.220
  469   2HG2  VAL  65          2HG2      VAL  65  -4.972  -5.229   3.282
  470   3HG2  VAL  65          3HG2      VAL  65  -5.637  -3.600   3.291
  471    H    ASP  66           H        ASP  66  -7.519  -7.304   0.992
  472    HA   ASP  66           HA       ASP  66  -9.235  -6.620  -1.196
  473   1HB   ASP  66          2HB       ASP  66  -7.973  -9.210  -0.298
  474   2HB   ASP  66          1HB       ASP  66  -9.019  -9.102  -1.711
  475    H    GLU  67           H        GLU  67 -11.130  -5.969   0.002
  476    HA   GLU  67           HA       GLU  67 -12.568  -7.675   1.707
  477   1HB   GLU  67          2HB       GLU  67 -12.979  -5.114   0.406
  478   2HB   GLU  67          1HB       GLU  67 -14.466  -6.062   0.440
  479   1HG   GLU  67          2HG       GLU  67 -12.764  -5.504   2.859
  480   2HG   GLU  67          1HG       GLU  67 -14.164  -4.537   2.379
  481    H    ASP  68           H        ASP  68 -12.410  -7.434  -1.767
  482    HA   ASP  68           HA       ASP  68 -14.749  -9.016  -2.263
  483   1HB   ASP  68          2HB       ASP  68 -14.001  -9.004  -4.600
  484   2HB   ASP  68          1HB       ASP  68 -13.943  -7.384  -3.911
  485    H    GLY  69           H        GLY  69 -11.362  -9.645  -1.743
  486   1HA   GLY  69          2HA       GLY  69 -10.465 -11.715  -1.102
  487   2HA   GLY  69          1HA       GLY  69 -11.927 -12.501  -1.676
  488    H    SER  70           H        SER  70  -9.356 -10.477  -3.099
  489    HA   SER  70           HA       SER  70  -9.176 -12.443  -5.288
  490   1HB   SER  70          2HB       SER  70  -8.152 -10.372  -6.525
  491   2HB   SER  70          1HB       SER  70  -9.907 -10.512  -6.359
  492    HG   SER  70           HG       SER  70  -9.732  -9.134  -4.517
  493    H    GLY  71           H        GLY  71  -7.409 -10.464  -2.999
  494   1HA   GLY  71          2HA       GLY  71  -5.314 -11.012  -2.092
  495   2HA   GLY  71          1HA       GLY  71  -5.060 -12.141  -3.421
  496    H    THR  72           H        THR  72  -6.084  -9.619  -5.069
  497    HA   THR  72           HA       THR  72  -3.374  -8.538  -5.407
  498    HB   THR  72           HB       THR  72  -4.154  -7.826  -7.646
  499    HG1  THR  72           1HG      THR  72  -6.522  -9.233  -6.980
  500   1HG2  THR  72          1HG2      THR  72  -4.989 -10.648  -7.635
  501   2HG2  THR  72          2HG2      THR  72  -3.382 -10.300  -6.998
  502   3HG2  THR  72          3HG2      THR  72  -3.805  -9.811  -8.639
  503    H    ILE  73           H        ILE  73  -2.965  -6.384  -5.257
  504    HA   ILE  73           HA       ILE  73  -5.112  -4.736  -4.142
  505    HB   ILE  73           HB       ILE  73  -2.149  -4.169  -4.247
  506   1HG1  ILE  73          2HG1      ILE  73  -3.720  -5.018  -1.816
  507   2HG1  ILE  73          1HG1      ILE  73  -2.945  -6.196  -2.878
  508   1HG2  ILE  73          1HG2      ILE  73  -3.759  -2.867  -2.188
  509   2HG2  ILE  73          2HG2      ILE  73  -4.217  -2.410  -3.829
  510   3HG2  ILE  73          3HG2      ILE  73  -2.554  -2.189  -3.284
  511   1HD1  ILE  73          1HD1      ILE  73  -1.569  -5.673  -0.939
  512   2HD1  ILE  73          2HD1      ILE  73  -1.546  -3.973  -1.407
  513   3HD1  ILE  73          3HD1      ILE  73  -0.781  -5.183  -2.438
  514    H    ASP  74           H        ASP  74  -6.173  -3.436  -5.466
  515    HA   ASP  74           HA       ASP  74  -5.399  -2.862  -8.109
  516   1HB   ASP  74          2HB       ASP  74  -7.393  -1.364  -6.393
  517   2HB   ASP  74          1HB       ASP  74  -7.305  -1.342  -8.156
  518    H    PHE  75           H        PHE  75  -5.747  -0.248  -8.629
  519    HA   PHE  75           HA       PHE  75  -3.236   0.875  -8.079
  520   1HB   PHE  75          2HB       PHE  75  -4.947   1.364  -9.990
  521   2HB   PHE  75          1HB       PHE  75  -5.587   2.567  -8.868
  522    HD1  PHE  75           1HD      PHE  75  -3.924   4.283  -7.930
  523    HD2  PHE  75           2HD      PHE  75  -3.146   1.875 -11.351
  524    HE1  PHE  75           1HE      PHE  75  -2.196   5.877  -8.655
  525    HE2  PHE  75           2HE      PHE  75  -1.416   3.464 -12.082
  526    HZ   PHE  75           HZ       PHE  75  -0.939   5.468 -10.733
  527    H    GLU  76           H        GLU  76  -6.372   2.281  -7.115
  528    HA   GLU  76           HA       GLU  76  -5.192   3.883  -5.081
  529   1HB   GLU  76          2HB       GLU  76  -8.075   3.169  -5.633
  530   2HB   GLU  76          1HB       GLU  76  -7.563   4.350  -4.434
  531   1HG   GLU  76          2HG       GLU  76  -8.114   5.648  -6.259
  532   2HG   GLU  76          1HG       GLU  76  -6.363   5.501  -6.390
  533    H    GLU  77           H        GLU  77  -6.488   0.672  -5.173
  534    HA   GLU  77           HA       GLU  77  -7.273   0.240  -2.570
  535   1HB   GLU  77          2HB       GLU  77  -6.249  -1.443  -4.760
  536   2HB   GLU  77          1HB       GLU  77  -6.058  -2.128  -3.151
  537   1HG   GLU  77          2HG       GLU  77  -8.487  -1.715  -2.771
  538   2HG   GLU  77          1HG       GLU  77  -8.613  -1.247  -4.470
  539    H    PHE  78           H        PHE  78  -4.060   0.735  -3.789
  540    HA   PHE  78           HA       PHE  78  -2.634  -0.435  -1.633
  541   1HB   PHE  78          2HB       PHE  78  -1.763   0.288  -3.960
  542   2HB   PHE  78          1HB       PHE  78  -1.609   1.894  -3.244
  543    HD1  PHE  78           1HD      PHE  78   0.526   2.414  -2.620
  544    HD2  PHE  78           2HD      PHE  78  -0.815  -1.601  -2.183
  545    HE1  PHE  78           1HE      PHE  78   2.711   1.791  -1.680
  546    HE2  PHE  78           2HE      PHE  78   1.369  -2.231  -1.242
  547    HZ   PHE  78           HZ       PHE  78   3.134  -0.534  -0.988
  548    H    LEU  79           H        LEU  79  -4.532   2.375  -1.815
  549    HA   LEU  79           HA       LEU  79  -3.125   3.683   0.391
  550   1HB   LEU  79          2HB       LEU  79  -5.497   4.553  -1.268
  551   2HB   LEU  79          1HB       LEU  79  -4.816   5.490   0.049
  552    HG   LEU  79           HG       LEU  79  -2.661   4.918  -1.663
  553   1HD1  LEU  79          1HD1      LEU  79  -3.615   6.089  -3.746
  554   2HD1  LEU  79          2HD1      LEU  79  -5.184   5.554  -3.146
  555   3HD1  LEU  79          3HD1      LEU  79  -3.935   4.369  -3.527
  556   1HD2  LEU  79          1HD2      LEU  79  -2.638   7.331  -1.992
  557   2HD2  LEU  79          2HD2      LEU  79  -2.970   6.932  -0.306
  558   3HD2  LEU  79          3HD2      LEU  79  -4.283   7.444  -1.368
  559    H    VAL  80           H        VAL  80  -6.295   2.317  -0.417
  560    HA   VAL  80           HA       VAL  80  -7.483   2.754   2.103
  561    HB   VAL  80           HB       VAL  80  -8.685   2.165  -0.049
  562   1HG1  VAL  80          1HG1      VAL  80  -7.283   0.210  -0.614
  563   2HG1  VAL  80          2HG1      VAL  80  -9.007  -0.154  -0.608
  564   3HG1  VAL  80          3HG1      VAL  80  -7.993  -0.658   0.745
  565   1HG2  VAL  80          1HG2      VAL  80  -9.603   0.334   2.120
  566   2HG2  VAL  80          2HG2      VAL  80 -10.536   1.430   1.101
  567   3HG2  VAL  80          3HG2      VAL  80  -9.551   2.072   2.415
  568    H    MET  81           H        MET  81  -5.377   0.259   0.877
  569    HA   MET  81           HA       MET  81  -5.822  -1.791   2.686
  570   1HB   MET  81          2HB       MET  81  -3.276  -2.196   2.370
  571   2HB   MET  81          1HB       MET  81  -4.337  -2.339   0.980
  572   1HG   MET  81          2HG       MET  81  -3.496  -0.519  -0.032
  573   2HG   MET  81          1HG       MET  81  -3.128   0.307   1.480
  574   1HE   MET  81          1HE       MET  81  -1.798  -1.134   3.134
  575   2HE   MET  81          2HE       MET  81  -0.095  -0.814   2.787
  576   3HE   MET  81          3HE       MET  81  -0.730  -2.458   2.668
  577    H    MET  82           H        MET  82  -3.819   1.080   2.984
  578    HA   MET  82           HA       MET  82  -2.910   0.415   5.629
  579   1HB   MET  82          2HB       MET  82  -2.094   2.163   3.589
  580   2HB   MET  82          1HB       MET  82  -2.591   3.205   4.922
  581   1HG   MET  82          2HG       MET  82  -1.094   1.958   6.426
  582   2HG   MET  82          1HG       MET  82  -0.563   0.984   5.057
  583   1HE   MET  82          1HE       MET  82   0.169   3.950   2.713
  584   2HE   MET  82          2HE       MET  82  -0.263   2.247   2.859
  585   3HE   MET  82          3HE       MET  82   1.430   2.735   2.913
  586    H    VAL  83           H        VAL  83  -5.466   2.313   4.193
  587    HA   VAL  83           HA       VAL  83  -6.162   3.896   6.406
  588    HB   VAL  83           HB       VAL  83  -7.943   2.824   4.207
  589   1HG1  VAL  83          1HG1      VAL  83  -8.415   4.832   6.376
  590   2HG1  VAL  83          2HG1      VAL  83  -9.454   3.517   5.825
  591   3HG1  VAL  83          3HG1      VAL  83  -9.258   4.962   4.831
  592   1HG2  VAL  83          1HG2      VAL  83  -7.389   4.641   2.926
  593   2HG2  VAL  83          2HG2      VAL  83  -5.857   4.369   3.761
  594   3HG2  VAL  83          3HG2      VAL  83  -6.955   5.630   4.321
  595    H    ARG  84           H        ARG  84  -7.200   0.656   5.422
  596    HA   ARG  84           HA       ARG  84  -9.143   0.298   7.431
  597   1HB   ARG  84          2HB       ARG  84  -7.508  -1.755   5.931
  598   2HB   ARG  84          1HB       ARG  84  -8.924  -2.115   6.909
  599   1HG   ARG  84          2HG       ARG  84  -9.905  -0.209   5.240
  600   2HG   ARG  84          1HG       ARG  84  -8.729  -1.022   4.199
  601   1HD   ARG  84          2HD       ARG  84 -10.056  -2.795   3.967
  602   2HD   ARG  84          1HD       ARG  84 -10.273  -2.937   5.710
  603    HE   ARG  84           HE       ARG  84 -12.080  -1.734   3.830
  604   1HH1  ARG  84          1HH1      ARG  84 -11.059  -1.804   7.167
  605   2HH1  ARG  84          2HH1      ARG  84 -12.569  -1.210   7.772
  606   1HH2  ARG  84          1HH2      ARG  84 -14.066  -0.951   4.623
  607   2HH2  ARG  84          2HH2      ARG  84 -14.276  -0.726   6.327
  608    H    GLN  85           H        GLN  85  -5.728   0.320   7.592
  609    HA   GLN  85           HA       GLN  85  -5.777  -1.101  10.168
  610   1HB   GLN  85          2HB       GLN  85  -3.267  -0.388   8.675
  611   2HB   GLN  85          1HB       GLN  85  -3.515  -1.651   9.881
  612   1HG   GLN  85          2HG       GLN  85  -4.473  -1.624   7.030
  613   2HG   GLN  85          1HG       GLN  85  -3.260  -2.686   7.753
  614   1HE2  GLN  85          1HE2      GLN  85  -4.249  -3.753   9.868
  615   2HE2  GLN  85          2HE2      GLN  85  -5.755  -4.554   9.597
  616    H    MET  86           H        MET  86  -5.221   1.942   8.640
  617    HA   MET  86           HA       MET  86  -3.732   3.130  10.770
  618   1HB   MET  86          2HB       MET  86  -4.989   4.051   8.241
  619   2HB   MET  86          1HB       MET  86  -4.698   5.270   9.483
  620   1HG   MET  86          2HG       MET  86  -2.311   4.371   9.554
  621   2HG   MET  86          1HG       MET  86  -2.709   3.549   8.041
  622   1HE   MET  86          1HE       MET  86  -1.415   5.904   5.679
  623   2HE   MET  86          2HE       MET  86  -2.998   5.138   5.543
  624   3HE   MET  86          3HE       MET  86  -1.662   4.273   6.299
  625    H    LYS  87           H        LYS  87  -7.134   3.047   9.830
  626    HA   LYS  87           HA       LYS  87  -8.016   4.888  11.811
  627   1HB   LYS  87          2HB       LYS  87  -9.335   2.940   9.971
  628   2HB   LYS  87          1HB       LYS  87 -10.268   3.592  11.318
  629   1HG   LYS  87          2HG       LYS  87 -10.588   5.518  10.266
  630   2HG   LYS  87          1HG       LYS  87  -8.864   5.687   9.910
  631   1HD   LYS  87          2HD       LYS  87  -9.681   5.539   7.782
  632   2HD   LYS  87          1HD       LYS  87  -9.425   3.825   8.115
  633   1HE   LYS  87          2HE       LYS  87 -11.765   3.572   8.718
  634   2HE   LYS  87          1HE       LYS  87 -12.035   5.296   8.470
  635   1HZ   LYS  87          1HZ       LYS  87 -11.314   4.919   6.117
  636   2HZ   LYS  87          2HZ       LYS  87 -12.781   4.190   6.538
  637   3HZ   LYS  87          3HZ       LYS  87 -11.375   3.257   6.422
  638    H    GLU  88           H        GLU  88  -8.124   1.335  11.606
  639    HA   GLU  88           HA       GLU  88  -8.319  -0.282  13.201
  640   1HB   GLU  88          2HB       GLU  88  -6.348   1.362  14.054
  641   2HB   GLU  88          1HB       GLU  88  -7.459   1.487  15.410
  642   1HG   GLU  88          2HG       GLU  88  -7.285  -1.244  14.789
  643   2HG   GLU  88          1HG       GLU  88  -5.639  -0.614  14.742
  644    H    ASP  89           H        ASP  89 -10.555  -0.438  13.201
  645    HA   ASP  89           HA       ASP  89 -12.059   1.221  15.074
  646   1HB   ASP  89          2HB       ASP  89 -12.748   0.539  12.616
  647   2HB   ASP  89          1HB       ASP  89 -13.340  -0.917  13.421
  648    H    ALA  90           H        ALA  90 -10.973  -2.068  14.612
  649    HA   ALA  90           HA       ALA  90 -10.993  -3.902  15.959
  650   1HB   ALA  90          1HB       ALA  90 -11.467  -3.218  18.500
  651   2HB   ALA  90          2HB       ALA  90 -11.071  -1.627  17.848
  652   3HB   ALA  90          3HB       ALA  90  -9.913  -2.952  17.709
  653   2H    ARG 115          HN2       ARG 115   2.546  -2.090   9.282
  654    H    ARG 115           H        ARG 115   1.714  -2.406  10.750
  655   3H    ARG 115          HN3       ARG 115   1.651  -3.543   9.469
  656    HA   ARG 115           HA       ARG 115   0.621  -1.751   8.109
  657   1HB   ARG 115          2HB       ARG 115  -1.609  -2.177   9.239
  658   2HB   ARG 115          1HB       ARG 115  -0.676  -3.609   8.828
  659   1HG   ARG 115          2HG       ARG 115  -0.247  -2.521  11.533
  660   2HG   ARG 115          1HG       ARG 115  -1.836  -3.218  11.213
  661   1HD   ARG 115          2HD       ARG 115  -0.014  -5.017  10.102
  662   2HD   ARG 115          1HD       ARG 115   0.700  -4.531  11.640
  663    HE   ARG 115           HE       ARG 115  -1.859  -5.081  12.304
  664   1HH1  ARG 115          1HH1      ARG 115   0.581  -6.868  10.564
  665   2HH1  ARG 115          2HH1      ARG 115  -0.020  -8.414  11.060
  666   1HH2  ARG 115          1HH2      ARG 115  -2.652  -7.114  12.957
  667   2HH2  ARG 115          2HH2      ARG 115  -1.855  -8.554  12.418
  668    H    MET 116           H        MET 116  -1.228  -0.109   8.593
  669    HA   MET 116           HA       MET 116  -1.853   1.952   9.315
  670   1HB   MET 116          2HB       MET 116  -2.104   0.967  11.513
  671   2HB   MET 116          1HB       MET 116  -0.379   1.114  11.817
  672   1HG   MET 116          2HG       MET 116  -1.289   3.692  11.167
  673   2HG   MET 116          1HG       MET 116  -2.470   3.008  12.283
  674   1HE   MET 116          1HE       MET 116  -1.018   3.999  15.481
  675   2HE   MET 116          2HE       MET 116  -2.367   3.332  14.561
  676   3HE   MET 116          3HE       MET 116  -1.781   4.959  14.212
  677    H    SER 117           H        SER 117   1.354   1.636  10.838
  678    HA   SER 117           HA       SER 117   2.123   4.187   9.671
  679   1HB   SER 117          2HB       SER 117   3.859   4.261  11.245
  680   2HB   SER 117          1HB       SER 117   2.553   3.457  12.115
  681    HG   SER 117           HG       SER 117   3.558   1.457  11.580
  682    H    ALA 118           H        ALA 118   1.806   2.110   7.802
  683    HA   ALA 118           HA       ALA 118   4.281   0.879   7.141
  684   1HB   ALA 118          1HB       ALA 118   2.706  -0.294   6.056
  685   2HB   ALA 118          2HB       ALA 118   2.909   0.918   4.792
  686   3HB   ALA 118          3HB       ALA 118   1.604   1.080   5.966
  687    H    ASP 119           H        ASP 119   3.221   4.067   6.912
  688    HA   ASP 119           HA       ASP 119   4.065   5.114   4.566
  689   1HB   ASP 119          2HB       ASP 119   3.109   6.421   6.428
  690   2HB   ASP 119          1HB       ASP 119   4.643   6.301   7.285
  691    H    ALA 120           H        ALA 120   6.104   3.781   7.068
  692    HA   ALA 120           HA       ALA 120   8.558   4.899   6.507
  693   1HB   ALA 120          1HB       ALA 120   7.659   2.306   7.602
  694   2HB   ALA 120          2HB       ALA 120   8.766   3.502   8.276
  695   3HB   ALA 120          3HB       ALA 120   9.327   2.384   7.033
  696    H    MET 121           H        MET 121   7.363   1.833   5.106
  697    HA   MET 121           HA       MET 121   9.389   1.599   3.180
  698   1HB   MET 121          2HB       MET 121   7.985  -0.294   3.756
  699   2HB   MET 121          1HB       MET 121   6.555   0.543   3.171
  700   1HG   MET 121          2HG       MET 121   8.066   0.591   0.944
  701   2HG   MET 121          1HG       MET 121   8.651  -0.896   1.691
  702   1HE   MET 121          1HE       MET 121   4.835   0.327   2.192
  703   2HE   MET 121          2HE       MET 121   4.271  -0.060   0.567
  704   3HE   MET 121          3HE       MET 121   5.543   1.140   0.795
  705    H    LEU 122           H        LEU 122   6.357   3.334   3.212
  706    HA   LEU 122           HA       LEU 122   6.238   3.942   0.448
  707   1HB   LEU 122          2HB       LEU 122   5.023   5.191   2.903
  708   2HB   LEU 122          1HB       LEU 122   4.775   5.879   1.313
  709    HG   LEU 122           HG       LEU 122   3.786   3.687   0.593
  710   1HD1  LEU 122          1HD1      LEU 122   4.860   2.341   2.405
  711   2HD1  LEU 122          2HD1      LEU 122   3.130   2.067   2.217
  712   3HD1  LEU 122          3HD1      LEU 122   3.724   3.070   3.539
  713   1HD2  LEU 122          1HD2      LEU 122   1.677   4.273   1.312
  714   2HD2  LEU 122          2HD2      LEU 122   2.561   5.777   1.567
  715   3HD2  LEU 122          3HD2      LEU 122   2.230   4.707   2.930
  716    H    ARG 123           H        ARG 123   7.751   5.474   3.227
  717    HA   ARG 123           HA       ARG 123   8.709   7.694   1.600
  718   1HB   ARG 123          2HB       ARG 123   7.920   8.152   3.881
  719   2HB   ARG 123          1HB       ARG 123   9.139   7.062   4.526
  720   1HG   ARG 123          2HG       ARG 123  10.872   8.522   4.083
  721   2HG   ARG 123          1HG       ARG 123   9.961   9.389   2.845
  722   1HD   ARG 123          2HD       ARG 123   8.965  10.747   4.344
  723   2HD   ARG 123          1HD       ARG 123   8.799   9.468   5.546
  724    HE   ARG 123           HE       ARG 123  10.897  11.396   5.368
  725   1HH1  ARG 123          1HH1      ARG 123  10.158   8.135   6.367
  726   2HH1  ARG 123          2HH1      ARG 123  11.436   8.069   7.534
  727   1HH2  ARG 123          1HH2      ARG 123  12.580  11.311   6.902
  728   2HH2  ARG 123          2HH2      ARG 123  12.811   9.871   7.838
  729    H    ALA 124           H        ALA 124   9.580   4.675   1.615
  730    HA   ALA 124           HA       ALA 124  12.374   4.791   2.258
  731   1HB   ALA 124          1HB       ALA 124  10.747   2.758   2.286
  732   2HB   ALA 124          2HB       ALA 124  12.428   2.529   1.805
  733   3HB   ALA 124          3HB       ALA 124  11.165   2.636   0.576
  734    H    LEU 125           H        LEU 125  10.780   3.935  -0.803
  735    HA   LEU 125           HA       LEU 125  13.112   4.615  -2.310
  736   1HB   LEU 125          2HB       LEU 125  10.346   3.943  -3.303
  737   2HB   LEU 125          1HB       LEU 125  11.832   3.900  -4.236
  738    HG   LEU 125           HG       LEU 125  11.538   2.192  -1.795
  739   1HD1  LEU 125          1HD1      LEU 125  10.926   0.431  -3.679
  740   2HD1  LEU 125          2HD1      LEU 125  10.192   1.859  -4.406
  741   3HD1  LEU 125          3HD1      LEU 125   9.700   1.337  -2.794
  742   1HD2  LEU 125          1HD2      LEU 125  13.416   1.200  -2.501
  743   2HD2  LEU 125          2HD2      LEU 125  13.628   2.658  -3.472
  744   3HD2  LEU 125          3HD2      LEU 125  12.909   1.216  -4.191
  745    H    LEU 126           H        LEU 126  10.308   6.348  -1.305
  746    HA   LEU 126           HA       LEU 126  11.272   8.660  -2.751
  747   1HB   LEU 126          2HB       LEU 126   8.617   7.392  -3.197
  748   2HB   LEU 126          1HB       LEU 126   8.731   9.139  -3.259
  749    HG   LEU 126           HG       LEU 126  10.345   7.248  -4.971
  750   1HD1  LEU 126          1HD1      LEU 126   8.387   7.019  -6.048
  751   2HD1  LEU 126          2HD1      LEU 126   8.756   8.626  -6.671
  752   3HD1  LEU 126          3HD1      LEU 126   7.679   8.442  -5.286
  753   1HD2  LEU 126          1HD2      LEU 126  11.642   9.133  -4.925
  754   2HD2  LEU 126          2HD2      LEU 126  10.272  10.205  -4.633
  755   3HD2  LEU 126          3HD2      LEU 126  10.546   9.543  -6.245
  756    H    GLY 127           H        GLY 127  11.465  10.250  -1.340
  757   1HA   GLY 127          2HA       GLY 127   9.319  10.887   0.484
  758   2HA   GLY 127          1HA       GLY 127  10.770  10.292   1.276
  759    H    SER 128           H        SER 128  10.542  12.337  -1.603
  760    HA   SER 128           HA       SER 128  12.055  14.396  -0.142
  761   1HB   SER 128          2HB       SER 128  12.742  15.176  -2.437
  762   2HB   SER 128          1HB       SER 128  13.320  13.566  -2.011
  763    HG   SER 128           HG       SER 128  12.021  12.694  -3.463
  764    H    LYS 129           H        LYS 129  11.638  16.655  -0.799
  765    HA   LYS 129           HA       LYS 129   8.942  17.137  -1.827
  766   1HB   LYS 129          2HB       LYS 129   9.566  17.236   0.913
  767   2HB   LYS 129          1HB       LYS 129   9.468  18.912   0.390
  768   1HG   LYS 129          2HG       LYS 129   7.248  18.828   0.111
  769   2HG   LYS 129          1HG       LYS 129   7.293  17.206  -0.584
  770   1HD   LYS 129          2HD       LYS 129   6.188  16.823   1.404
  771   2HD   LYS 129          1HD       LYS 129   7.858  16.484   1.862
  772   1HE   LYS 129          2HE       LYS 129   7.201  17.851   3.587
  773   2HE   LYS 129          1HE       LYS 129   7.890  19.028   2.471
  774   1HZ   LYS 129          1HZ       LYS 129   5.387  19.019   1.629
  775   2HZ   LYS 129          2HZ       LYS 129   5.928  20.042   2.863
  776   3HZ   LYS 129          3HZ       LYS 129   5.116  18.609   3.249
  777    H    HIS 130           H        HIS 130   8.993  18.674  -3.320
  778    HA   HIS 130           HA       HIS 130  11.346  20.135  -3.906
  779   1HB   HIS 130          2HB       HIS 130   8.898  19.581  -5.191
  780   2HB   HIS 130          1HB       HIS 130   9.009  21.336  -5.095
  781    HD1  HIS 130           1HD      HIS 130  12.266  21.156  -5.363
  782    HD2  HIS 130           2HD      HIS 130   9.382  19.680  -7.964
  783    HE1  HIS 130           1HE      HIS 130  13.406  20.975  -7.598
  784    HE2  HIS 130           2HE      HIS 130  11.666  19.995  -9.134
  785    H    LYS 131           H        LYS 131   8.156  21.590  -3.306
  786    HA   LYS 131           HA       LYS 131   9.467  23.905  -2.126
  787   1HB   LYS 131          2HB       LYS 131   6.881  23.355  -3.407
  788   2HB   LYS 131          1HB       LYS 131   6.778  24.430  -2.018
  789   1HG   LYS 131          2HG       LYS 131   7.065  25.875  -3.805
  790   2HG   LYS 131          1HG       LYS 131   8.693  25.725  -3.139
  791   1HD   LYS 131          2HD       LYS 131   8.996  25.507  -5.449
  792   2HD   LYS 131          1HD       LYS 131   9.015  23.847  -4.852
  793   1HE   LYS 131          2HE       LYS 131   6.464  23.924  -5.358
  794   2HE   LYS 131          1HE       LYS 131   6.894  25.285  -6.392
  795   1HZ   LYS 131          1HZ       LYS 131   8.545  23.774  -7.465
  796   2HZ   LYS 131          2HZ       LYS 131   6.929  23.341  -7.718
  797   3HZ   LYS 131          3HZ       LYS 131   7.865  22.491  -6.595
  Start of MODEL    9
    1   2H    ALA   1          HN2       ALA   1 -25.056   3.778  -7.944
    2    H    ALA   1           H        ALA   1 -23.566   4.453  -8.462
    3   3H    ALA   1          HN3       ALA   1 -24.682   3.856  -9.617
    4    HA   ALA   1           HA       ALA   1 -24.423   1.655  -8.765
    5   1HB   ALA   1          1HB       ALA   1 -23.027   1.835 -10.540
    6   2HB   ALA   1          2HB       ALA   1 -21.805   1.617  -9.287
    7   3HB   ALA   1          3HB       ALA   1 -22.184   3.235  -9.878
    8    H    SER   2           H        SER   2 -24.420   0.735  -6.827
    9    HA   SER   2           HA       SER   2 -22.776   1.793  -4.682
   10   1HB   SER   2          2HB       SER   2 -23.957   0.128  -3.277
   11   2HB   SER   2          1HB       SER   2 -25.077   1.161  -4.166
   12    HG   SER   2           HG       SER   2 -24.788  -1.520  -4.258
   13    H    MET   3           H        MET   3 -20.762   1.137  -4.397
   14    HA   MET   3           HA       MET   3 -20.100  -1.675  -4.513
   15   1HB   MET   3          2HB       MET   3 -19.423   0.152  -6.680
   16   2HB   MET   3          1HB       MET   3 -17.999  -0.612  -5.986
   17   1HG   MET   3          2HG       MET   3 -18.784  -2.772  -6.493
   18   2HG   MET   3          1HG       MET   3 -20.408  -2.182  -6.843
   19   1HE   MET   3          1HE       MET   3 -20.431  -0.576 -10.034
   20   2HE   MET   3          2HE       MET   3 -19.256   0.489  -9.260
   21   3HE   MET   3          3HE       MET   3 -20.613  -0.151  -8.332
   22    H    THR   4           H        THR   4 -17.412  -1.623  -4.362
   23    HA   THR   4           HA       THR   4 -16.977  -0.514  -1.751
   24    HB   THR   4           HB       THR   4 -16.067  -2.711  -2.406
   25    HG1  THR   4           1HG      THR   4 -13.982  -0.870  -1.877
   26   1HG2  THR   4          1HG2      THR   4 -14.767  -3.097  -4.160
   27   2HG2  THR   4          2HG2      THR   4 -13.752  -1.695  -3.822
   28   3HG2  THR   4          3HG2      THR   4 -15.249  -1.500  -4.733
   29    H    ASP   5           H        ASP   5 -16.662   1.611  -1.572
   30    HA   ASP   5           HA       ASP   5 -14.960   2.966  -3.544
   31   1HB   ASP   5          2HB       ASP   5 -16.966   4.063  -1.565
   32   2HB   ASP   5          1HB       ASP   5 -15.938   5.066  -2.592
   33    H    GLN   6           H        GLN   6 -14.570   1.486  -0.674
   34    HA   GLN   6           HA       GLN   6 -13.353   3.214   1.076
   35   1HB   GLN   6          2HB       GLN   6 -12.173   1.315   1.976
   36   2HB   GLN   6          1HB       GLN   6 -13.784   0.804   1.491
   37   1HG   GLN   6          2HG       GLN   6 -12.705   0.034  -0.683
   38   2HG   GLN   6          1HG       GLN   6 -11.164   0.237   0.148
   39   1HE2  GLN   6          1HE2      GLN   6 -10.404  -1.510   1.080
   40   2HE2  GLN   6          2HE2      GLN   6 -11.330  -2.850   1.656
   41    H    GLN   7           H        GLN   7 -12.135   2.020  -1.959
   42    HA   GLN   7           HA       GLN   7  -9.401   2.681  -1.534
   43   1HB   GLN   7          2HB       GLN   7 -10.800   2.538  -4.202
   44   2HB   GLN   7          1HB       GLN   7  -9.095   2.276  -3.868
   45   1HG   GLN   7          2HG       GLN   7  -9.404   0.140  -3.290
   46   2HG   GLN   7          1HG       GLN   7 -10.895   0.482  -2.416
   47   1HE2  GLN   7          1HE2      GLN   7 -12.853   0.629  -3.607
   48   2HE2  GLN   7          2HE2      GLN   7 -13.021  -0.171  -5.128
   49    H    ALA   8           H        ALA   8 -12.199   4.491  -2.450
   50    HA   ALA   8           HA       ALA   8 -10.717   6.714  -3.536
   51   1HB   ALA   8          1HB       ALA   8 -12.734   6.726  -4.566
   52   2HB   ALA   8          2HB       ALA   8 -13.171   7.737  -3.188
   53   3HB   ALA   8          3HB       ALA   8 -13.569   6.018  -3.183
   54    H    GLU   9           H        GLU   9 -12.661   6.117  -0.608
   55    HA   GLU   9           HA       GLU   9 -12.297   8.595   0.612
   56   1HB   GLU   9          2HB       GLU   9 -12.440   5.938   2.048
   57   2HB   GLU   9          1HB       GLU   9 -12.879   7.515   2.692
   58   1HG   GLU   9          2HG       GLU   9 -14.325   6.798   0.259
   59   2HG   GLU   9          1HG       GLU   9 -14.605   5.698   1.613
   60    H    ALA  10           H        ALA  10 -10.266   5.748   0.510
   61    HA   ALA  10           HA       ALA  10  -8.373   6.181   2.415
   62   1HB   ALA  10          1HB       ALA  10  -6.798   5.280   0.463
   63   2HB   ALA  10          2HB       ALA  10  -8.367   4.964  -0.284
   64   3HB   ALA  10          3HB       ALA  10  -7.975   4.254   1.283
   65    H    ARG  11           H        ARG  11  -8.174   7.403  -0.932
   66    HA   ARG  11           HA       ARG  11  -5.878   8.920  -0.688
   67   1HB   ARG  11          2HB       ARG  11  -7.655   8.441  -2.687
   68   2HB   ARG  11          1HB       ARG  11  -8.012  10.127  -2.334
   69   1HG   ARG  11          2HG       ARG  11  -6.098  10.850  -3.240
   70   2HG   ARG  11          1HG       ARG  11  -5.155   9.529  -2.548
   71   1HD   ARG  11          2HD       ARG  11  -5.007   9.020  -4.776
   72   2HD   ARG  11          1HD       ARG  11  -6.447   8.102  -4.335
   73    HE   ARG  11           HE       ARG  11  -7.618   9.401  -5.787
   74   1HH1  ARG  11          1HH1      ARG  11  -4.796  11.190  -4.780
   75   2HH1  ARG  11          2HH1      ARG  11  -5.125  12.535  -5.818
   76   1HH2  ARG  11          1HH2      ARG  11  -8.051  11.169  -7.154
   77   2HH2  ARG  11          2HH2      ARG  11  -6.972  12.524  -7.167
   78    H    ALA  12           H        ALA  12  -9.089   9.589   0.456
   79    HA   ALA  12           HA       ALA  12  -8.420  12.360   1.087
   80   1HB   ALA  12          1HB       ALA  12 -10.759  12.584   1.727
   81   2HB   ALA  12          2HB       ALA  12 -11.003  10.853   1.488
   82   3HB   ALA  12          3HB       ALA  12 -10.616  11.888   0.112
   83    H    PHE  13           H        PHE  13  -8.521   9.260   2.574
   84    HA   PHE  13           HA       PHE  13  -8.920  10.165   5.260
   85   1HB   PHE  13          2HB       PHE  13  -8.133   7.582   3.969
   86   2HB   PHE  13          1HB       PHE  13  -7.866   7.790   5.703
   87    HD1  PHE  13           1HD      PHE  13  -9.912   6.143   3.723
   88    HD2  PHE  13           2HD      PHE  13 -10.179   9.297   6.568
   89    HE1  PHE  13           1HE      PHE  13 -12.262   5.554   4.150
   90    HE2  PHE  13           2HE      PHE  13 -12.529   8.713   7.001
   91    HZ   PHE  13           HZ       PHE  13 -13.574   6.839   5.791
   92    H    LEU  14           H        LEU  14  -6.236  10.098   3.132
   93    HA   LEU  14           HA       LEU  14  -4.425  10.629   5.395
   94   1HB   LEU  14          2HB       LEU  14  -3.482   9.609   2.736
   95   2HB   LEU  14          1HB       LEU  14  -2.652   9.571   4.287
   96    HG   LEU  14           HG       LEU  14  -5.123   8.049   4.374
   97   1HD1  LEU  14          1HD1      LEU  14  -5.043   7.243   2.275
   98   2HD1  LEU  14          2HD1      LEU  14  -3.776   6.211   2.937
   99   3HD1  LEU  14          3HD1      LEU  14  -3.349   7.678   2.055
  100   1HD2  LEU  14          1HD2      LEU  14  -2.473   6.770   4.623
  101   2HD2  LEU  14          2HD2      LEU  14  -3.884   6.676   5.675
  102   3HD2  LEU  14          3HD2      LEU  14  -2.825   8.085   5.745
  103    H    SER  15           H        SER  15  -2.483  11.954   4.720
  104    HA   SER  15           HA       SER  15  -3.444  14.310   3.321
  105   1HB   SER  15          2HB       SER  15  -0.656  14.196   4.361
  106   2HB   SER  15          1HB       SER  15  -1.860  15.488   4.483
  107    HG   SER  15           HG       SER  15  -2.799  14.462   6.178
  108    H    GLU  16           H        GLU  16  -2.017  15.420   1.745
  109    HA   GLU  16           HA       GLU  16  -1.451  13.883  -0.476
  110   1HB   GLU  16          2HB       GLU  16  -1.360  16.570   0.124
  111   2HB   GLU  16          1HB       GLU  16   0.326  16.200  -0.207
  112   1HG   GLU  16          2HG       GLU  16  -1.266  14.975  -2.214
  113   2HG   GLU  16          1HG       GLU  16  -1.778  16.653  -2.040
  114    H    GLU  17           H        GLU  17   0.466  14.473   2.344
  115    HA   GLU  17           HA       GLU  17   3.012  13.789   1.412
  116   1HB   GLU  17          2HB       GLU  17   1.648  13.942   4.035
  117   2HB   GLU  17          1HB       GLU  17   3.081  12.920   3.977
  118   1HG   GLU  17          2HG       GLU  17   2.962  15.818   3.173
  119   2HG   GLU  17          1HG       GLU  17   3.608  15.192   4.689
  120    H    MET  18           H        MET  18   0.651  11.750   3.139
  121    HA   MET  18           HA       MET  18   2.029   9.340   2.906
  122   1HB   MET  18          2HB       MET  18  -0.315  10.144   4.070
  123   2HB   MET  18          1HB       MET  18  -0.901   9.114   2.765
  124   1HG   MET  18          2HG       MET  18  -0.695   7.660   4.549
  125   2HG   MET  18          1HG       MET  18   0.791   7.393   3.639
  126   1HE   MET  18          1HE       MET  18   1.432   7.090   7.646
  127   2HE   MET  18          2HE       MET  18   1.006   6.155   6.212
  128   3HE   MET  18          3HE       MET  18  -0.224   7.108   7.040
  129    H    ILE  19           H        ILE  19   0.307  11.129   0.524
  130    HA   ILE  19           HA       ILE  19  -0.185   8.891  -1.229
  131    HB   ILE  19           HB       ILE  19  -0.471  11.871  -1.550
  132   1HG1  ILE  19          2HG1      ILE  19  -2.482   9.610  -1.656
  133   2HG1  ILE  19          1HG1      ILE  19  -2.182  10.638  -0.251
  134   1HG2  ILE  19          1HG2      ILE  19  -0.576   9.745  -3.649
  135   2HG2  ILE  19          2HG2      ILE  19   0.138  11.358  -3.717
  136   3HG2  ILE  19          3HG2      ILE  19  -1.615  11.165  -3.775
  137   1HD1  ILE  19          1HD1      ILE  19  -3.904  11.082  -2.482
  138   2HD1  ILE  19          2HD1      ILE  19  -2.697  12.365  -2.402
  139   3HD1  ILE  19          3HD1      ILE  19  -3.721  12.029  -1.006
  140    H    ALA  20           H        ALA  20   1.801  11.836  -1.545
  141    HA   ALA  20           HA       ALA  20   3.236  11.173  -3.785
  142   1HB   ALA  20          1HB       ALA  20   4.939  12.729  -3.007
  143   2HB   ALA  20          2HB       ALA  20   4.267  12.664  -1.377
  144   3HB   ALA  20          3HB       ALA  20   3.320  13.355  -2.694
  145    H    GLU  21           H        GLU  21   3.574   9.897  -0.577
  146    HA   GLU  21           HA       GLU  21   6.115   8.619  -1.159
  147   1HB   GLU  21          2HB       GLU  21   4.377   8.282   1.291
  148   2HB   GLU  21          1HB       GLU  21   6.080   7.874   1.128
  149   1HG   GLU  21          2HG       GLU  21   6.748  10.098   1.185
  150   2HG   GLU  21          1HG       GLU  21   5.137  10.692   0.784
  151    H    PHE  22           H        PHE  22   2.712   7.901  -0.964
  152    HA   PHE  22           HA       PHE  22   2.793   5.102  -0.866
  153   1HB   PHE  22          2HB       PHE  22   0.828   7.172  -1.464
  154   2HB   PHE  22          1HB       PHE  22   0.586   5.732  -2.445
  155    HD1  PHE  22           1HD      PHE  22   1.421   3.621  -0.561
  156    HD2  PHE  22           2HD      PHE  22  -0.912   7.123   0.059
  157    HE1  PHE  22           1HE      PHE  22   0.282   2.523   1.322
  158    HE2  PHE  22           2HE      PHE  22  -2.052   6.034   1.946
  159    HZ   PHE  22           HZ       PHE  22  -1.457   3.732   2.578
  160    H    LYS  23           H        LYS  23   3.138   7.379  -3.498
  161    HA   LYS  23           HA       LYS  23   3.029   5.417  -5.578
  162   1HB   LYS  23          2HB       LYS  23   2.421   7.774  -5.962
  163   2HB   LYS  23          1HB       LYS  23   4.085   8.251  -5.626
  164   1HG   LYS  23          2HG       LYS  23   3.672   6.233  -7.749
  165   2HG   LYS  23          1HG       LYS  23   3.152   7.885  -8.092
  166   1HD   LYS  23          2HD       LYS  23   5.628   8.243  -6.942
  167   2HD   LYS  23          1HD       LYS  23   5.842   6.765  -7.890
  168   1HE   LYS  23          2HE       LYS  23   6.225   8.163  -9.601
  169   2HE   LYS  23          1HE       LYS  23   4.472   8.351  -9.635
  170   1HZ   LYS  23          1HZ       LYS  23   5.908  10.076  -7.788
  171   2HZ   LYS  23          2HZ       LYS  23   4.589  10.421  -8.790
  172   3HZ   LYS  23          3HZ       LYS  23   6.153  10.391  -9.433
  173    H    ALA  24           H        ALA  24   5.397   6.388  -3.347
  174    HA   ALA  24           HA       ALA  24   7.806   6.311  -4.607
  175   1HB   ALA  24          1HB       ALA  24   7.630   6.680  -2.239
  176   2HB   ALA  24          2HB       ALA  24   8.730   5.332  -2.529
  177   3HB   ALA  24          3HB       ALA  24   7.084   5.022  -1.981
  178    H    ALA  25           H        ALA  25   6.706   3.363  -2.967
  179    HA   ALA  25           HA       ALA  25   8.360   1.698  -4.568
  180   1HB   ALA  25          1HB       ALA  25   7.777   1.212  -2.222
  181   2HB   ALA  25          2HB       ALA  25   7.433  -0.135  -3.309
  182   3HB   ALA  25          3HB       ALA  25   6.119   0.887  -2.728
  183    H    PHE  26           H        PHE  26   5.444   3.117  -5.330
  184    HA   PHE  26           HA       PHE  26   3.838   1.227  -6.468
  185   1HB   PHE  26          2HB       PHE  26   3.807   3.905  -6.456
  186   2HB   PHE  26          1HB       PHE  26   4.320   3.647  -8.119
  187    HD1  PHE  26           1HD      PHE  26   2.814   2.832  -9.760
  188    HD2  PHE  26           2HD      PHE  26   1.639   3.026  -5.675
  189    HE1  PHE  26           1HE      PHE  26   0.477   2.423 -10.417
  190    HE2  PHE  26           2HE      PHE  26  -0.699   2.616  -6.323
  191    HZ   PHE  26           HZ       PHE  26  -1.282   2.314  -8.697
  192    H    ASP  27           H        ASP  27   6.955   2.288  -7.608
  193    HA   ASP  27           HA       ASP  27   6.635   1.009 -10.190
  194   1HB   ASP  27          2HB       ASP  27   8.973   2.418  -8.891
  195   2HB   ASP  27          1HB       ASP  27   9.038   1.698 -10.498
  196    H    MET  28           H        MET  28   8.868   0.616  -7.431
  197    HA   MET  28           HA       MET  28  10.058  -1.752  -8.306
  198   1HB   MET  28          2HB       MET  28   9.652  -0.612  -5.545
  199   2HB   MET  28          1HB       MET  28  10.548  -2.099  -5.825
  200   1HG   MET  28          2HG       MET  28  11.458   0.024  -7.562
  201   2HG   MET  28          1HG       MET  28  11.540   0.492  -5.860
  202   1HE   MET  28          1HE       MET  28  15.068  -0.495  -7.252
  203   2HE   MET  28          2HE       MET  28  14.643   0.321  -5.747
  204   3HE   MET  28          3HE       MET  28  13.817   0.749  -7.245
  205    H    PHE  29           H        PHE  29   7.081  -1.212  -6.521
  206    HA   PHE  29           HA       PHE  29   6.562  -3.775  -5.589
  207   1HB   PHE  29          2HB       PHE  29   4.988  -1.366  -6.180
  208   2HB   PHE  29          1HB       PHE  29   4.064  -2.864  -6.311
  209    HD1  PHE  29           1HD      PHE  29   5.305  -0.384  -4.117
  210    HD2  PHE  29           2HD      PHE  29   4.219  -4.489  -4.315
  211    HE1  PHE  29           1HE      PHE  29   5.046  -0.423  -1.674
  212    HE2  PHE  29           2HE      PHE  29   3.953  -4.536  -1.872
  213    HZ   PHE  29           HZ       PHE  29   4.366  -2.504  -0.545
  214    H    ASP  30           H        ASP  30   4.839  -2.459  -8.407
  215    HA   ASP  30           HA       ASP  30   4.100  -4.935  -9.447
  216   1HB   ASP  30          2HB       ASP  30   4.372  -2.216 -10.718
  217   2HB   ASP  30          1HB       ASP  30   3.798  -3.621 -11.622
  218    H    ALA  31           H        ALA  31   5.280  -6.484 -10.298
  219    HA   ALA  31           HA       ALA  31   7.975  -5.938 -11.240
  220   1HB   ALA  31          1HB       ALA  31   6.508  -8.558 -10.951
  221   2HB   ALA  31          2HB       ALA  31   7.597  -7.846  -9.759
  222   3HB   ALA  31          3HB       ALA  31   8.221  -8.365 -11.324
  223    H    ASP  32           H        ASP  32   5.025  -7.486 -12.486
  224    HA   ASP  32           HA       ASP  32   6.093  -7.456 -15.189
  225   1HB   ASP  32          2HB       ASP  32   3.982  -8.626 -15.773
  226   2HB   ASP  32          1HB       ASP  32   4.881  -9.443 -14.490
  227    H    GLY  33           H        GLY  33   3.813  -5.724 -13.204
  228   1HA   GLY  33          2HA       GLY  33   2.852  -3.654 -13.565
  229   2HA   GLY  33          1HA       GLY  33   3.672  -3.590 -15.118
  230    H    GLY  34           H        GLY  34   1.188  -5.721 -13.688
  231   1HA   GLY  34          2HA       GLY  34  -0.960  -4.801 -15.214
  232   2HA   GLY  34          1HA       GLY  34  -0.181  -6.086 -16.136
  233    H    GLY  35           H        GLY  35  -0.484  -5.896 -12.617
  234   1HA   GLY  35          2HA       GLY  35  -2.710  -7.698 -12.500
  235   2HA   GLY  35          1HA       GLY  35  -1.180  -8.514 -12.182
  236    H    ASP  36           H        ASP  36  -1.723  -5.184 -11.269
  237    HA   ASP  36           HA       ASP  36  -1.651  -4.151  -9.238
  238   1HB   ASP  36          2HB       ASP  36  -3.415  -6.520  -8.620
  239   2HB   ASP  36          1HB       ASP  36  -3.134  -5.210  -7.468
  240    H    ILE  37           H        ILE  37  -1.443  -4.843  -6.677
  241    HA   ILE  37           HA       ILE  37   1.130  -6.225  -6.586
  242    HB   ILE  37           HB       ILE  37  -0.263  -4.418  -4.613
  243   1HG1  ILE  37          2HG1      ILE  37   2.322  -4.102  -6.153
  244   2HG1  ILE  37          1HG1      ILE  37   0.784  -3.348  -6.585
  245   1HG2  ILE  37          1HG2      ILE  37   0.907  -6.110  -3.350
  246   2HG2  ILE  37          2HG2      ILE  37   1.779  -4.580  -3.244
  247   3HG2  ILE  37          3HG2      ILE  37   2.366  -5.858  -4.308
  248   1HD1  ILE  37          1HD1      ILE  37   2.028  -2.888  -3.905
  249   2HD1  ILE  37          2HD1      ILE  37   0.848  -1.904  -4.772
  250   3HD1  ILE  37          3HD1      ILE  37   2.524  -1.960  -5.320
  251    H    SER  38           H        SER  38   1.346  -8.197  -5.767
  252    HA   SER  38           HA       SER  38  -0.923  -9.363  -4.305
  253   1HB   SER  38          2HB       SER  38   1.242 -11.119  -5.334
  254   2HB   SER  38          1HB       SER  38  -0.509 -11.370  -5.317
  255    HG   SER  38           HG       SER  38  -0.516  -9.653  -6.997
  256    H    THR  39           H        THR  39   0.399 -11.558  -3.200
  257    HA   THR  39           HA       THR  39   1.441 -10.424  -0.826
  258    HB   THR  39           HB       THR  39   1.957 -12.790  -0.213
  259    HG1  THR  39           1HG      THR  39   1.267 -14.392  -1.707
  260   1HG2  THR  39          1HG2      THR  39  -0.454 -13.666  -0.657
  261   2HG2  THR  39          2HG2      THR  39  -0.739 -12.012  -1.198
  262   3HG2  THR  39          3HG2      THR  39  -0.182 -12.318   0.447
  263    H    LYS  40           H        LYS  40   2.967 -12.077  -3.563
  264    HA   LYS  40           HA       LYS  40   5.588 -12.065  -2.498
  265   1HB   LYS  40          2HB       LYS  40   4.498 -12.337  -5.293
  266   2HB   LYS  40          1HB       LYS  40   6.232 -12.346  -4.968
  267   1HG   LYS  40          2HG       LYS  40   5.824 -14.253  -3.387
  268   2HG   LYS  40          1HG       LYS  40   4.167 -14.309  -4.002
  269   1HD   LYS  40          2HD       LYS  40   6.386 -14.323  -5.979
  270   2HD   LYS  40          1HD       LYS  40   6.111 -15.791  -5.041
  271   1HE   LYS  40          2HE       LYS  40   4.145 -16.236  -6.066
  272   2HE   LYS  40          1HE       LYS  40   3.707 -14.533  -6.193
  273   1HZ   LYS  40          1HZ       LYS  40   5.936 -15.398  -7.844
  274   2HZ   LYS  40          2HZ       LYS  40   4.660 -14.349  -8.209
  275   3HZ   LYS  40          3HZ       LYS  40   4.423 -16.022  -8.272
  276    H    GLU  41           H        GLU  41   3.853  -9.830  -4.621
  277    HA   GLU  41           HA       GLU  41   5.968  -8.149  -5.295
  278   1HB   GLU  41          2HB       GLU  41   3.025  -7.591  -4.955
  279   2HB   GLU  41          1HB       GLU  41   4.157  -6.391  -5.564
  280   1HG   GLU  41          2HG       GLU  41   4.643  -8.659  -7.094
  281   2HG   GLU  41          1HG       GLU  41   2.890  -8.595  -6.927
  282    H    LEU  42           H        LEU  42   4.306  -8.507  -2.289
  283    HA   LEU  42           HA       LEU  42   5.081  -5.927  -1.268
  284   1HB   LEU  42          2HB       LEU  42   3.408  -8.140  -0.404
  285   2HB   LEU  42          1HB       LEU  42   4.406  -7.527   0.908
  286    HG   LEU  42           HG       LEU  42   2.298  -6.405   0.987
  287   1HD1  LEU  42          1HD1      LEU  42   3.052  -4.007   0.372
  288   2HD1  LEU  42          2HD1      LEU  42   4.603  -4.764   0.012
  289   3HD1  LEU  42          3HD1      LEU  42   3.917  -4.886   1.631
  290   1HD2  LEU  42          1HD2      LEU  42   2.626  -6.336  -1.922
  291   2HD2  LEU  42          2HD2      LEU  42   1.974  -4.855  -1.219
  292   3HD2  LEU  42          3HD2      LEU  42   1.161  -6.397  -0.942
  293    H    GLY  43           H        GLY  43   5.884  -9.266  -0.298
  294   1HA   GLY  43          2HA       GLY  43   7.882  -8.778   1.501
  295   2HA   GLY  43          1HA       GLY  43   7.875 -10.172   0.423
  296    H    THR  44           H        THR  44   8.064  -8.366  -1.952
  297    HA   THR  44           HA       THR  44  10.871  -8.393  -2.220
  298    HB   THR  44           HB       THR  44   8.593  -7.316  -3.845
  299    HG1  THR  44           1HG      THR  44   9.248  -9.528  -3.949
  300   1HG2  THR  44          1HG2      THR  44  10.000  -5.631  -4.488
  301   2HG2  THR  44          2HG2      THR  44  10.439  -6.900  -5.633
  302   3HG2  THR  44          3HG2      THR  44  11.456  -6.592  -4.225
  303    H    VAL  45           H        VAL  45   8.974  -5.475  -2.774
  304    HA   VAL  45           HA       VAL  45  11.003  -3.671  -2.214
  305    HB   VAL  45           HB       VAL  45   9.075  -3.004  -3.468
  306   1HG1  VAL  45          1HG1      VAL  45   6.876  -2.674  -2.270
  307   2HG1  VAL  45          2HG1      VAL  45   7.543  -3.646  -0.958
  308   3HG1  VAL  45          3HG1      VAL  45   7.355  -4.344  -2.569
  309   1HG2  VAL  45          1HG2      VAL  45   8.479  -1.266  -1.207
  310   2HG2  VAL  45          2HG2      VAL  45   9.174  -0.879  -2.782
  311   3HG2  VAL  45          3HG2      VAL  45  10.209  -1.470  -1.482
  312    H    MET  46           H        MET  46   8.594  -5.069  -0.051
  313    HA   MET  46           HA       MET  46   9.059  -3.324   2.121
  314   1HB   MET  46          2HB       MET  46   7.792  -6.028   1.847
  315   2HB   MET  46          1HB       MET  46   8.022  -5.303   3.439
  316   1HG   MET  46          2HG       MET  46   6.862  -3.351   1.740
  317   2HG   MET  46          1HG       MET  46   5.954  -4.853   1.551
  318   1HE   MET  46          1HE       MET  46   7.299  -2.162   3.607
  319   2HE   MET  46          2HE       MET  46   6.593  -2.290   5.218
  320   3HE   MET  46          3HE       MET  46   5.652  -1.597   3.895
  321    H    ARG  47           H        ARG  47  10.630  -6.298   1.103
  322    HA   ARG  47           HA       ARG  47  12.104  -6.535   3.582
  323   1HB   ARG  47          2HB       ARG  47  12.149  -8.081   0.998
  324   2HB   ARG  47          1HB       ARG  47  13.301  -8.383   2.290
  325   1HG   ARG  47          2HG       ARG  47  11.607  -9.087   3.776
  326   2HG   ARG  47          1HG       ARG  47  10.330  -8.485   2.716
  327   1HD   ARG  47          2HD       ARG  47  10.239 -10.700   2.190
  328   2HD   ARG  47          1HD       ARG  47  11.444 -10.171   1.012
  329    HE   ARG  47           HE       ARG  47  11.885 -11.833   3.349
  330   1HH1  ARG  47          1HH1      ARG  47  13.327  -9.912   0.811
  331   2HH1  ARG  47          2HH1      ARG  47  14.874 -10.677   0.944
  332   1HH2  ARG  47          1HH2      ARG  47  13.920 -12.834   3.521
  333   2HH2  ARG  47          2HH2      ARG  47  15.211 -12.334   2.480
  334    H    MET  48           H        MET  48  12.597  -5.170   0.419
  335    HA   MET  48           HA       MET  48  15.457  -4.851   0.886
  336   1HB   MET  48          2HB       MET  48  15.516  -3.929  -1.394
  337   2HB   MET  48          1HB       MET  48  14.767  -5.525  -1.344
  338   1HG   MET  48          2HG       MET  48  12.830  -4.762  -2.123
  339   2HG   MET  48          1HG       MET  48  12.847  -3.359  -1.057
  340   1HE   MET  48          1HE       MET  48  12.743  -0.843  -3.724
  341   2HE   MET  48          2HE       MET  48  12.347  -1.374  -2.089
  342   3HE   MET  48          3HE       MET  48  11.596  -2.160  -3.478
  343    H    LEU  49           H        LEU  49  12.991  -3.303   2.145
  344    HA   LEU  49           HA       LEU  49  14.210  -0.643   1.801
  345   1HB   LEU  49          2HB       LEU  49  11.342  -1.460   2.085
  346   2HB   LEU  49          1HB       LEU  49  11.856   0.139   2.589
  347    HG   LEU  49           HG       LEU  49  11.975  -1.025  -0.190
  348   1HD1  LEU  49          1HD1      LEU  49  10.666   1.220  -0.518
  349   2HD1  LEU  49          2HD1      LEU  49  10.315   1.019   1.198
  350   3HD1  LEU  49          3HD1      LEU  49   9.841  -0.231   0.049
  351   1HD2  LEU  49          1HD2      LEU  49  13.548   1.113   1.034
  352   2HD2  LEU  49          2HD2      LEU  49  12.688   1.606  -0.424
  353   3HD2  LEU  49          3HD2      LEU  49  13.800   0.238  -0.476
  354    H    GLY  50           H        GLY  50  12.652  -2.875   4.058
  355   1HA   GLY  50          2HA       GLY  50  14.298  -2.478   6.199
  356   2HA   GLY  50          1HA       GLY  50  13.114  -1.180   6.337
  357    H    GLN  51           H        GLN  51  10.871  -2.627   5.343
  358    HA   GLN  51           HA       GLN  51  10.030  -3.893   7.735
  359   1HB   GLN  51          2HB       GLN  51   8.765  -2.799   5.554
  360   2HB   GLN  51          1HB       GLN  51   8.466  -4.523   5.334
  361   1HG   GLN  51          2HG       GLN  51   6.641  -3.770   6.560
  362   2HG   GLN  51          1HG       GLN  51   7.689  -4.519   7.764
  363   1HE2  GLN  51          1HE2      GLN  51   5.706  -2.040   7.356
  364   2HE2  GLN  51          2HE2      GLN  51   6.446  -0.853   8.369
  365    H    ASN  52           H        ASN  52   9.175  -6.116   7.871
  366    HA   ASN  52           HA       ASN  52  10.426  -8.029   6.055
  367   1HB   ASN  52          2HB       ASN  52  11.769  -7.421   8.303
  368   2HB   ASN  52          1HB       ASN  52  10.702  -8.678   8.936
  369   1HD2  ASN  52          1HD2      ASN  52  13.478  -7.980   7.094
  370   2HD2  ASN  52          2HD2      ASN  52  13.874  -9.601   6.644
  371    HA   PRO  53           HA       PRO  53   6.193  -9.205   7.832
  372   1HB   PRO  53          2HB       PRO  53   4.595  -8.594   5.758
  373   2HB   PRO  53          1HB       PRO  53   5.030  -7.397   6.983
  374   1HG   PRO  53          2HG       PRO  53   6.182  -7.811   4.249
  375   2HG   PRO  53          1HG       PRO  53   5.740  -6.296   5.058
  376   1HD   PRO  53          2HD       PRO  53   8.299  -7.231   4.923
  377   2HD   PRO  53          1HD       PRO  53   7.699  -6.217   6.255
  378    H    THR  54           H        THR  54   6.529 -11.372   7.726
  379    HA   THR  54           HA       THR  54   7.315 -12.808   5.449
  380    HB   THR  54           HB       THR  54   6.055 -14.709   6.916
  381    HG1  THR  54           1HG      THR  54   5.355 -13.810   8.668
  382   1HG2  THR  54          1HG2      THR  54   8.232 -15.220   6.809
  383   2HG2  THR  54          2HG2      THR  54   8.280 -14.483   8.411
  384   3HG2  THR  54          3HG2      THR  54   8.746 -13.543   6.994
  385    H    LYS  55           H        LYS  55   5.737 -14.877   4.951
  386    HA   LYS  55           HA       LYS  55   3.803 -13.891   3.194
  387   1HB   LYS  55          2HB       LYS  55   4.850 -16.098   2.950
  388   2HB   LYS  55          1HB       LYS  55   4.014 -16.658   4.398
  389   1HG   LYS  55          2HG       LYS  55   2.841 -17.489   2.504
  390   2HG   LYS  55          1HG       LYS  55   1.855 -16.218   3.231
  391   1HD   LYS  55          2HD       LYS  55   2.990 -14.654   1.533
  392   2HD   LYS  55          1HD       LYS  55   3.467 -16.135   0.702
  393   1HE   LYS  55          2HE       LYS  55   0.656 -16.133   1.438
  394   2HE   LYS  55          1HE       LYS  55   1.077 -14.774   0.399
  395   1HZ   LYS  55          1HZ       LYS  55   0.479 -16.550  -1.008
  396   2HZ   LYS  55          2HZ       LYS  55   1.434 -17.661  -0.163
  397   3HZ   LYS  55          3HZ       LYS  55   2.167 -16.451  -1.090
  398    H    CYS  56           H        CYS  56   3.510 -15.115   6.491
  399    HA   CYS  56           HA       CYS  56   0.665 -15.063   6.558
  400   1HB   CYS  56          2HB       CYS  56   2.852 -15.407   8.548
  401   2HB   CYS  56          1HB       CYS  56   1.266 -14.931   9.160
  402    HG   CYS  56           HG       CYS  56   1.236 -17.473   9.189
  403    H    GLU  57           H        GLU  57   3.188 -12.756   7.375
  404    HA   GLU  57           HA       GLU  57   1.595 -10.872   8.723
  405   1HB   GLU  57          2HB       GLU  57   4.066 -10.380   7.047
  406   2HB   GLU  57          1HB       GLU  57   3.391  -9.276   8.247
  407   1HG   GLU  57          2HG       GLU  57   4.465 -12.027   8.836
  408   2HG   GLU  57          1HG       GLU  57   5.343 -10.517   9.075
  409    H    LEU  58           H        LEU  58   2.655 -10.957   5.327
  410    HA   LEU  58           HA       LEU  58   1.068  -8.723   4.562
  411   1HB   LEU  58          2HB       LEU  58   2.120 -10.853   2.712
  412   2HB   LEU  58          1HB       LEU  58   1.775  -9.169   2.339
  413    HG   LEU  58           HG       LEU  58   3.878  -9.797   4.370
  414   1HD1  LEU  58          1HD1      LEU  58   4.711 -11.203   2.738
  415   2HD1  LEU  58          2HD1      LEU  58   5.476  -9.666   2.333
  416   3HD1  LEU  58          3HD1      LEU  58   4.073 -10.222   1.418
  417   1HD2  LEU  58          1HD2      LEU  58   4.782  -7.759   2.853
  418   2HD2  LEU  58          2HD2      LEU  58   3.765  -7.546   4.278
  419   3HD2  LEU  58          3HD2      LEU  58   3.042  -7.539   2.670
  420    H    ASP  59           H        ASP  59   0.503 -12.152   4.763
  421    HA   ASP  59           HA       ASP  59  -1.768 -12.265   3.064
  422   1HB   ASP  59          2HB       ASP  59  -0.545 -14.047   5.118
  423   2HB   ASP  59          1HB       ASP  59  -2.223 -14.349   4.660
  424    H    ALA  60           H        ALA  60  -1.288 -11.268   6.348
  425    HA   ALA  60           HA       ALA  60  -4.055 -11.470   7.080
  426   1HB   ALA  60          1HB       ALA  60  -1.563 -10.575   8.381
  427   2HB   ALA  60          2HB       ALA  60  -2.875 -11.574   9.006
  428   3HB   ALA  60          3HB       ALA  60  -3.052  -9.820   8.949
  429    H    ILE  61           H        ILE  61  -1.963  -9.046   5.702
  430    HA   ILE  61           HA       ILE  61  -3.852  -6.900   6.088
  431    HB   ILE  61           HB       ILE  61  -1.193  -7.110   4.693
  432   1HG1  ILE  61          2HG1      ILE  61  -0.999  -5.048   6.419
  433   2HG1  ILE  61          1HG1      ILE  61  -2.248  -5.996   7.231
  434   1HG2  ILE  61          1HG2      ILE  61  -2.278  -5.646   3.246
  435   2HG2  ILE  61          2HG2      ILE  61  -1.466  -4.578   4.391
  436   3HG2  ILE  61          3HG2      ILE  61  -3.196  -4.888   4.547
  437   1HD1  ILE  61          1HD1      ILE  61  -0.829  -7.747   7.650
  438   2HD1  ILE  61          2HD1      ILE  61   0.265  -6.369   7.784
  439   3HD1  ILE  61          3HD1      ILE  61   0.245  -7.340   6.312
  440    H    ILE  62           H        ILE  62  -2.391  -8.416   3.196
  441    HA   ILE  62           HA       ILE  62  -3.903  -7.341   1.210
  442    HB   ILE  62           HB       ILE  62  -3.015 -10.216   1.444
  443   1HG1  ILE  62          2HG1      ILE  62  -1.796  -7.784   0.118
  444   2HG1  ILE  62          1HG1      ILE  62  -1.179  -8.627   1.542
  445   1HG2  ILE  62          1HG2      ILE  62  -4.183 -10.635  -0.400
  446   2HG2  ILE  62          2HG2      ILE  62  -3.150  -9.490  -1.254
  447   3HG2  ILE  62          3HG2      ILE  62  -4.669  -8.946  -0.542
  448   1HD1  ILE  62          1HD1      ILE  62  -1.513 -10.184  -0.957
  449   2HD1  ILE  62          2HD1      ILE  62  -0.305 -10.326   0.319
  450   3HD1  ILE  62          3HD1      ILE  62  -0.187  -9.025  -0.865
  451    H    CYS  63           H        CYS  63  -4.843 -10.000   3.348
  452    HA   CYS  63           HA       CYS  63  -7.257 -10.682   2.095
  453   1HB   CYS  63          2HB       CYS  63  -6.026 -11.927   3.963
  454   2HB   CYS  63          1HB       CYS  63  -6.798 -10.796   5.078
  455    HG   CYS  63           HG       CYS  63  -8.421 -12.710   5.056
  456    H    GLU  64           H        GLU  64  -6.555  -8.360   4.684
  457    HA   GLU  64           HA       GLU  64  -9.273  -7.484   4.907
  458   1HB   GLU  64          2HB       GLU  64  -7.105  -7.285   6.529
  459   2HB   GLU  64          1HB       GLU  64  -7.122  -5.676   5.824
  460   1HG   GLU  64          2HG       GLU  64  -8.357  -5.556   7.827
  461   2HG   GLU  64          1HG       GLU  64  -9.527  -5.507   6.510
  462    H    VAL  65           H        VAL  65  -6.432  -6.500   3.127
  463    HA   VAL  65           HA       VAL  65  -7.326  -3.962   2.278
  464    HB   VAL  65           HB       VAL  65  -5.391  -5.883   0.968
  465   1HG1  VAL  65          1HG1      VAL  65  -4.573  -3.912  -0.276
  466   2HG1  VAL  65          2HG1      VAL  65  -5.924  -2.977   0.364
  467   3HG1  VAL  65          3HG1      VAL  65  -6.228  -4.350  -0.700
  468   1HG2  VAL  65          1HG2      VAL  65  -5.121  -3.724   3.008
  469   2HG2  VAL  65          2HG2      VAL  65  -3.792  -4.015   1.885
  470   3HG2  VAL  65          3HG2      VAL  65  -4.356  -5.309   2.937
  471    H    ASP  66           H        ASP  66  -7.465  -7.163   0.749
  472    HA   ASP  66           HA       ASP  66  -8.968  -6.209  -1.503
  473   1HB   ASP  66          2HB       ASP  66  -8.068  -8.909  -0.544
  474   2HB   ASP  66          1HB       ASP  66  -9.237  -8.774  -1.857
  475    H    GLU  67           H        GLU  67 -11.061  -5.787  -1.494
  476    HA   GLU  67           HA       GLU  67 -12.747  -6.799   0.648
  477   1HB   GLU  67          2HB       GLU  67 -14.444  -5.257  -0.272
  478   2HB   GLU  67          1HB       GLU  67 -12.926  -4.440   0.100
  479   1HG   GLU  67          2HG       GLU  67 -13.240  -5.442  -2.660
  480   2HG   GLU  67          1HG       GLU  67 -14.276  -4.090  -2.182
  481    H    ASP  68           H        ASP  68 -12.162  -7.325  -2.730
  482    HA   ASP  68           HA       ASP  68 -14.574  -8.968  -2.978
  483   1HB   ASP  68          2HB       ASP  68 -14.075  -9.001  -5.382
  484   2HB   ASP  68          1HB       ASP  68 -14.151  -7.351  -4.772
  485    H    GLY  69           H        GLY  69 -11.986  -9.658  -1.498
  486   1HA   GLY  69          2HA       GLY  69 -10.601 -11.473  -1.225
  487   2HA   GLY  69          1HA       GLY  69 -11.965 -12.384  -1.854
  488    H    SER  70           H        SER  70  -9.627 -10.104  -3.285
  489    HA   SER  70           HA       SER  70  -9.168 -12.076  -5.420
  490   1HB   SER  70          2HB       SER  70  -8.118  -9.745  -6.390
  491   2HB   SER  70          1HB       SER  70  -9.769 -10.301  -6.693
  492    HG   SER  70           HG       SER  70  -8.839  -8.339  -4.915
  493    H    GLY  71           H        GLY  71  -7.690 -10.424  -2.805
  494   1HA   GLY  71          2HA       GLY  71  -5.568 -10.589  -1.931
  495   2HA   GLY  71          1HA       GLY  71  -5.259 -11.870  -3.101
  496    H    THR  72           H        THR  72  -6.346  -9.022  -4.577
  497    HA   THR  72           HA       THR  72  -3.575  -8.263  -5.226
  498    HB   THR  72           HB       THR  72  -4.484  -7.484  -7.413
  499    HG1  THR  72           1HG      THR  72  -6.541  -7.847  -7.945
  500   1HG2  THR  72          1HG2      THR  72  -3.533  -9.809  -7.071
  501   2HG2  THR  72          2HG2      THR  72  -4.569  -9.562  -8.477
  502   3HG2  THR  72          3HG2      THR  72  -5.205 -10.367  -7.042
  503    H    ILE  73           H        ILE  73  -3.086  -6.068  -5.439
  504    HA   ILE  73           HA       ILE  73  -5.072  -4.251  -4.231
  505    HB   ILE  73           HB       ILE  73  -2.081  -3.919  -4.187
  506   1HG1  ILE  73          2HG1      ILE  73  -3.797  -4.868  -1.886
  507   2HG1  ILE  73          1HG1      ILE  73  -2.942  -5.979  -2.960
  508   1HG2  ILE  73          1HG2      ILE  73  -3.775  -1.964  -3.889
  509   2HG2  ILE  73          2HG2      ILE  73  -2.402  -2.109  -2.792
  510   3HG2  ILE  73          3HG2      ILE  73  -4.000  -2.653  -2.281
  511   1HD1  ILE  73          1HD1      ILE  73  -1.581  -3.809  -1.387
  512   2HD1  ILE  73          2HD1      ILE  73  -0.832  -5.144  -2.263
  513   3HD1  ILE  73          3HD1      ILE  73  -1.782  -5.464  -0.812
  514    H    ASP  74           H        ASP  74  -5.953  -3.007  -5.784
  515    HA   ASP  74           HA       ASP  74  -4.585  -2.395  -8.218
  516   1HB   ASP  74          2HB       ASP  74  -6.560  -1.126  -8.819
  517   2HB   ASP  74          1HB       ASP  74  -7.053  -2.651  -8.083
  518    H    PHE  75           H        PHE  75  -5.198   0.248  -8.721
  519    HA   PHE  75           HA       PHE  75  -2.980   1.586  -7.730
  520   1HB   PHE  75          2HB       PHE  75  -5.497   2.481  -9.086
  521   2HB   PHE  75          1HB       PHE  75  -4.365   3.686  -8.468
  522    HD1  PHE  75           1HD      PHE  75  -2.587   4.362  -9.777
  523    HD2  PHE  75           2HD      PHE  75  -4.504   0.661 -10.632
  524    HE1  PHE  75           1HE      PHE  75  -1.228   4.135 -11.815
  525    HE2  PHE  75           2HE      PHE  75  -3.149   0.426 -12.672
  526    HZ   PHE  75           HZ       PHE  75  -1.508   2.164 -13.266
  527    H    GLU  76           H        GLU  76  -6.218   2.867  -7.063
  528    HA   GLU  76           HA       GLU  76  -5.484   4.288  -4.795
  529   1HB   GLU  76          2HB       GLU  76  -8.213   3.156  -5.423
  530   2HB   GLU  76          1HB       GLU  76  -7.871   4.475  -4.312
  531   1HG   GLU  76          2HG       GLU  76  -7.152   4.605  -7.220
  532   2HG   GLU  76          1HG       GLU  76  -8.734   5.089  -6.613
  533    H    GLU  77           H        GLU  77  -6.407   0.934  -5.113
  534    HA   GLU  77           HA       GLU  77  -7.137   0.330  -2.512
  535   1HB   GLU  77          2HB       GLU  77  -6.129  -1.169  -4.820
  536   2HB   GLU  77          1HB       GLU  77  -5.748  -1.914  -3.275
  537   1HG   GLU  77          2HG       GLU  77  -8.174  -1.716  -2.685
  538   2HG   GLU  77          1HG       GLU  77  -8.466  -1.220  -4.357
  539    H    PHE  78           H        PHE  78  -3.967   0.975  -3.813
  540    HA   PHE  78           HA       PHE  78  -2.427  -0.179  -1.745
  541   1HB   PHE  78          2HB       PHE  78  -1.630   0.654  -4.032
  542   2HB   PHE  78          1HB       PHE  78  -1.613   2.268  -3.315
  543    HD1  PHE  78           1HD      PHE  78  -0.540  -1.116  -2.153
  544    HD2  PHE  78           2HD      PHE  78   0.519   2.949  -2.837
  545    HE1  PHE  78           1HE      PHE  78   1.701  -1.549  -1.234
  546    HE2  PHE  78           2HE      PHE  78   2.762   2.521  -1.921
  547    HZ   PHE  78           HZ       PHE  78   3.352   0.273  -1.115
  548    H    LEU  79           H        LEU  79  -4.442   2.570  -1.745
  549    HA   LEU  79           HA       LEU  79  -3.033   3.786   0.512
  550   1HB   LEU  79          2HB       LEU  79  -5.495   4.714  -0.977
  551   2HB   LEU  79          1HB       LEU  79  -4.675   5.606   0.291
  552    HG   LEU  79           HG       LEU  79  -2.665   5.111  -1.558
  553   1HD1  LEU  79          1HD1      LEU  79  -5.296   5.352  -2.903
  554   2HD1  LEU  79          2HD1      LEU  79  -3.836   4.498  -3.405
  555   3HD1  LEU  79          3HD1      LEU  79  -3.939   6.251  -3.582
  556   1HD2  LEU  79          1HD2      LEU  79  -4.381   7.583  -1.416
  557   2HD2  LEU  79          2HD2      LEU  79  -2.687   7.473  -1.895
  558   3HD2  LEU  79          3HD2      LEU  79  -3.151   7.170  -0.221
  559    H    VAL  80           H        VAL  80  -6.183   2.378  -0.316
  560    HA   VAL  80           HA       VAL  80  -7.324   2.654   2.247
  561    HB   VAL  80           HB       VAL  80  -8.558   2.127   0.096
  562   1HG1  VAL  80          1HG1      VAL  80  -7.798  -0.713   0.752
  563   2HG1  VAL  80          2HG1      VAL  80  -7.100   0.230  -0.564
  564   3HG1  VAL  80          3HG1      VAL  80  -8.820  -0.161  -0.575
  565   1HG2  VAL  80          1HG2      VAL  80  -9.560   0.119   1.970
  566   2HG2  VAL  80          2HG2      VAL  80 -10.328   1.582   1.353
  567   3HG2  VAL  80          3HG2      VAL  80  -9.208   1.681   2.711
  568    H    MET  81           H        MET  81  -5.234   0.247   0.818
  569    HA   MET  81           HA       MET  81  -5.533  -1.895   2.527
  570   1HB   MET  81          2HB       MET  81  -2.974  -2.173   2.144
  571   2HB   MET  81          1HB       MET  81  -4.061  -2.290   0.771
  572   1HG   MET  81          2HG       MET  81  -3.262  -0.456  -0.197
  573   2HG   MET  81          1HG       MET  81  -3.034   0.398   1.328
  574   1HE   MET  81          1HE       MET  81   0.318  -0.794   2.620
  575   2HE   MET  81          2HE       MET  81  -0.983  -1.972   2.832
  576   3HE   MET  81          3HE       MET  81  -1.315  -0.249   3.006
  577    H    MET  82           H        MET  82  -3.622   1.025   2.963
  578    HA   MET  82           HA       MET  82  -2.744   0.210   5.595
  579   1HB   MET  82          2HB       MET  82  -1.959   2.181   3.617
  580   2HB   MET  82          1HB       MET  82  -2.042   2.874   5.239
  581   1HG   MET  82          2HG       MET  82  -0.735   0.584   5.776
  582   2HG   MET  82          1HG       MET  82  -0.188   0.876   4.126
  583   1HE   MET  82          1HE       MET  82   0.719   3.456   3.433
  584   2HE   MET  82          2HE       MET  82   0.960   4.694   4.667
  585   3HE   MET  82          3HE       MET  82  -0.663   4.090   4.326
  586    H    VAL  83           H        VAL  83  -5.248   2.131   4.172
  587    HA   VAL  83           HA       VAL  83  -5.844   3.783   6.391
  588    HB   VAL  83           HB       VAL  83  -7.648   2.808   4.167
  589   1HG1  VAL  83          1HG1      VAL  83  -8.273   4.265   6.565
  590   2HG1  VAL  83          2HG1      VAL  83  -9.348   3.691   5.291
  591   3HG1  VAL  83          3HG1      VAL  83  -8.571   5.267   5.144
  592   1HG2  VAL  83          1HG2      VAL  83  -6.769   5.610   4.246
  593   2HG2  VAL  83          2HG2      VAL  83  -6.902   4.499   2.884
  594   3HG2  VAL  83          3HG2      VAL  83  -5.490   4.435   3.940
  595    H    ARG  84           H        ARG  84  -6.910   0.566   5.412
  596    HA   ARG  84           HA       ARG  84  -8.874   0.267   7.444
  597   1HB   ARG  84          2HB       ARG  84  -7.379  -1.872   5.918
  598   2HB   ARG  84          1HB       ARG  84  -8.863  -2.100   6.832
  599   1HG   ARG  84          2HG       ARG  84  -9.640  -0.136   5.166
  600   2HG   ARG  84          1HG       ARG  84  -8.440  -0.953   4.155
  601   1HD   ARG  84          2HD       ARG  84  -9.735  -2.766   3.878
  602   2HD   ARG  84          1HD       ARG  84 -10.266  -2.763   5.560
  603    HE   ARG  84           HE       ARG  84 -11.475  -0.630   4.163
  604   1HH1  ARG  84          1HH1      ARG  84 -11.598  -4.106   4.453
  605   2HH1  ARG  84          2HH1      ARG  84 -13.266  -4.209   4.001
  606   1HH2  ARG  84          1HH2      ARG  84 -13.671  -0.765   3.569
  607   2HH2  ARG  84          2HH2      ARG  84 -14.443  -2.314   3.499
  608    H    GLN  85           H        GLN  85  -5.470   0.174   7.496
  609    HA   GLN  85           HA       GLN  85  -5.435  -1.391   9.982
  610   1HB   GLN  85          2HB       GLN  85  -3.040  -0.458   8.396
  611   2HB   GLN  85          1HB       GLN  85  -3.093  -1.705   9.643
  612   1HG   GLN  85          2HG       GLN  85  -4.522  -1.915   7.003
  613   2HG   GLN  85          1HG       GLN  85  -2.901  -2.550   7.304
  614   1HE2  GLN  85          1HE2      GLN  85  -4.357  -4.447   6.524
  615   2HE2  GLN  85          2HE2      GLN  85  -5.017  -5.421   7.788
  616    H    MET  86           H        MET  86  -4.813   1.747   8.611
  617    HA   MET  86           HA       MET  86  -3.439   2.874  10.818
  618   1HB   MET  86          2HB       MET  86  -4.761   3.876   8.355
  619   2HB   MET  86          1HB       MET  86  -4.536   5.038   9.664
  620   1HG   MET  86          2HG       MET  86  -2.117   4.416   9.687
  621   2HG   MET  86          1HG       MET  86  -2.416   3.452   8.235
  622   1HE   MET  86          1HE       MET  86  -2.580   4.837   5.603
  623   2HE   MET  86          2HE       MET  86  -1.269   4.164   6.571
  624   3HE   MET  86          3HE       MET  86  -1.106   5.770   5.863
  625    H    LYS  87           H        LYS  87  -6.816   3.233   9.733
  626    HA   LYS  87           HA       LYS  87  -7.616   4.546  12.143
  627   1HB   LYS  87          2HB       LYS  87  -9.121   3.417   9.787
  628   2HB   LYS  87          1HB       LYS  87  -9.951   4.114  11.180
  629   1HG   LYS  87          2HG       LYS  87  -9.823   5.820   9.567
  630   2HG   LYS  87          1HG       LYS  87  -8.596   6.205  10.781
  631   1HD   LYS  87          2HD       LYS  87  -6.890   5.893   9.335
  632   2HD   LYS  87          1HD       LYS  87  -7.681   4.532   8.539
  633   1HE   LYS  87          2HE       LYS  87  -7.645   6.167   6.889
  634   2HE   LYS  87          1HE       LYS  87  -9.269   6.302   7.562
  635   1HZ   LYS  87          1HZ       LYS  87  -8.675   8.473   7.595
  636   2HZ   LYS  87          2HZ       LYS  87  -7.021   8.154   7.747
  637   3HZ   LYS  87          3HZ       LYS  87  -8.032   8.037   9.099
  638    H    GLU  88           H        GLU  88  -8.090   1.296  10.798
  639    HA   GLU  88           HA       GLU  88  -8.599  -0.700  11.771
  640   1HB   GLU  88          2HB       GLU  88  -7.157   0.785  13.812
  641   2HB   GLU  88          1HB       GLU  88  -8.303  -0.345  14.518
  642   1HG   GLU  88          2HG       GLU  88  -7.150  -1.907  12.637
  643   2HG   GLU  88          1HG       GLU  88  -5.809  -0.842  13.056
  644    H    ASP  89           H        ASP  89  -9.557   1.315  14.527
  645    HA   ASP  89           HA       ASP  89 -12.295   0.301  14.206
  646   1HB   ASP  89          2HB       ASP  89 -11.106   1.613  16.656
  647   2HB   ASP  89          1HB       ASP  89 -12.612   0.696  16.550
  648    H    ALA  90           H        ALA  90 -12.976   1.804  12.648
  649    HA   ALA  90           HA       ALA  90 -12.849   4.638  13.270
  650   1HB   ALA  90          1HB       ALA  90 -12.652   3.455  10.931
  651   2HB   ALA  90          2HB       ALA  90 -13.418   5.036  11.087
  652   3HB   ALA  90          3HB       ALA  90 -14.410   3.584  10.965
  653   2H    ARG 115          HN2       ARG 115  -1.098  -2.403   8.901
  654    H    ARG 115           H        ARG 115  -0.281  -3.837   8.431
  655   3H    ARG 115          HN3       ARG 115   0.281  -2.933   9.773
  656    HA   ARG 115           HA       ARG 115   1.717  -2.410   8.086
  657   1HB   ARG 115          2HB       ARG 115  -0.458  -3.157   6.488
  658   2HB   ARG 115          1HB       ARG 115  -0.149  -1.476   6.073
  659   1HG   ARG 115          2HG       ARG 115   1.233  -2.503   4.590
  660   2HG   ARG 115          1HG       ARG 115   2.344  -2.319   5.949
  661   1HD   ARG 115          2HD       ARG 115   0.969  -4.737   6.368
  662   2HD   ARG 115          1HD       ARG 115   1.423  -4.713   4.665
  663    HE   ARG 115           HE       ARG 115   3.651  -4.812   5.270
  664   1HH1  ARG 115          1HH1      ARG 115   1.663  -4.386   8.109
  665   2HH1  ARG 115          2HH1      ARG 115   2.949  -4.735   9.212
  666   1HH2  ARG 115          1HH2      ARG 115   5.340  -5.271   6.721
  667   2HH2  ARG 115          2HH2      ARG 115   5.036  -5.237   8.427
  668    H    MET 116           H        MET 116   0.088  -0.982  10.140
  669    HA   MET 116           HA       MET 116  -0.458   1.634   9.141
  670   1HB   MET 116          2HB       MET 116  -1.586   0.763  11.133
  671   2HB   MET 116          1HB       MET 116  -0.046   0.674  11.979
  672   1HG   MET 116          2HG       MET 116   0.159   3.148  11.691
  673   2HG   MET 116          1HG       MET 116  -1.489   3.148  11.065
  674   1HE   MET 116          1HE       MET 116  -0.410   3.827  15.249
  675   2HE   MET 116          2HE       MET 116  -0.100   4.668  13.731
  676   3HE   MET 116          3HE       MET 116   0.786   3.193  14.119
  677    H    SER 117           H        SER 117   0.688   3.565   9.556
  678    HA   SER 117           HA       SER 117   2.555   4.867   9.542
  679   1HB   SER 117          2HB       SER 117   2.649   4.477  11.892
  680   2HB   SER 117          1HB       SER 117   3.315   2.861  11.666
  681    HG   SER 117           HG       SER 117   4.610   5.286  10.955
  682    H    ALA 118           H        ALA 118   2.402   2.947   7.519
  683    HA   ALA 118           HA       ALA 118   5.011   1.739   7.224
  684   1HB   ALA 118          1HB       ALA 118   2.672   0.932   6.309
  685   2HB   ALA 118          2HB       ALA 118   4.164   0.612   5.423
  686   3HB   ALA 118          3HB       ALA 118   3.118   1.948   4.938
  687    H    ASP 119           H        ASP 119   4.093   4.825   7.104
  688    HA   ASP 119           HA       ASP 119   4.757   5.986   4.738
  689   1HB   ASP 119          2HB       ASP 119   4.063   7.109   6.919
  690   2HB   ASP 119          1HB       ASP 119   5.764   7.058   7.373
  691    H    ALA 120           H        ALA 120   6.893   4.412   6.994
  692    HA   ALA 120           HA       ALA 120   9.355   5.447   6.193
  693   1HB   ALA 120          1HB       ALA 120  10.261   3.851   7.507
  694   2HB   ALA 120          2HB       ALA 120   9.313   2.558   6.772
  695   3HB   ALA 120          3HB       ALA 120   8.589   3.593   8.003
  696    H    MET 121           H        MET 121   7.941   2.348   5.099
  697    HA   MET 121           HA       MET 121   9.733   1.939   2.989
  698   1HB   MET 121          2HB       MET 121   8.343   0.124   3.757
  699   2HB   MET 121          1HB       MET 121   6.879   1.011   3.360
  700   1HG   MET 121          2HG       MET 121   7.968   0.954   0.933
  701   2HG   MET 121          1HG       MET 121   8.729  -0.488   1.605
  702   1HE   MET 121          1HE       MET 121   4.898   0.767   2.443
  703   2HE   MET 121          2HE       MET 121   4.260   0.220   0.894
  704   3HE   MET 121          3HE       MET 121   5.544   1.429   0.941
  705    H    LEU 122           H        LEU 122   6.702   3.693   3.180
  706    HA   LEU 122           HA       LEU 122   6.395   4.210   0.423
  707   1HB   LEU 122          2HB       LEU 122   5.347   5.498   2.924
  708   2HB   LEU 122          1HB       LEU 122   5.026   6.210   1.356
  709    HG   LEU 122           HG       LEU 122   4.011   3.990   0.677
  710   1HD1  LEU 122          1HD1      LEU 122   5.111   2.730   2.570
  711   2HD1  LEU 122          2HD1      LEU 122   3.394   2.411   2.328
  712   3HD1  LEU 122          3HD1      LEU 122   3.919   3.469   3.638
  713   1HD2  LEU 122          1HD2      LEU 122   1.974   4.434   2.289
  714   2HD2  LEU 122          2HD2      LEU 122   2.407   5.583   1.023
  715   3HD2  LEU 122          3HD2      LEU 122   2.902   5.879   2.689
  716    H    ARG 123           H        ARG 123   8.141   5.842   3.004
  717    HA   ARG 123           HA       ARG 123   8.940   8.002   1.216
  718   1HB   ARG 123          2HB       ARG 123   8.331   8.420   3.616
  719   2HB   ARG 123          1HB       ARG 123   9.770   7.525   4.082
  720   1HG   ARG 123          2HG       ARG 123  11.060   9.302   3.788
  721   2HG   ARG 123          1HG       ARG 123  10.424   9.571   2.164
  722   1HD   ARG 123          2HD       ARG 123   8.652  10.305   4.412
  723   2HD   ARG 123          1HD       ARG 123  10.091  11.300   4.192
  724    HE   ARG 123           HE       ARG 123   8.686  10.904   1.743
  725   1HH1  ARG 123          1HH1      ARG 123   8.684  12.762   4.698
  726   2HH1  ARG 123          2HH1      ARG 123   7.842  14.104   4.001
  727   1HH2  ARG 123          1HH2      ARG 123   7.577  12.669   0.824
  728   2HH2  ARG 123          2HH2      ARG 123   7.213  14.052   1.802
  729    H    ALA 124           H        ALA 124   9.839   4.995   1.232
  730    HA   ALA 124           HA       ALA 124  12.695   5.231   1.588
  731   1HB   ALA 124          1HB       ALA 124  12.793   2.929   1.340
  732   2HB   ALA 124          2HB       ALA 124  11.347   2.872   0.332
  733   3HB   ALA 124          3HB       ALA 124  11.205   3.172   2.065
  734    H    LEU 125           H        LEU 125  10.824   3.955  -1.158
  735    HA   LEU 125           HA       LEU 125  12.935   4.629  -2.982
  736   1HB   LEU 125          2HB       LEU 125  10.174   3.614  -3.635
  737   2HB   LEU 125          1HB       LEU 125  11.604   3.533  -4.649
  738    HG   LEU 125           HG       LEU 125  11.612   2.176  -1.986
  739   1HD1  LEU 125          1HD1      LEU 125  10.836   0.115  -3.214
  740   2HD1  LEU 125          2HD1      LEU 125  10.280   1.194  -4.492
  741   3HD1  LEU 125          3HD1      LEU 125   9.602   1.324  -2.870
  742   1HD2  LEU 125          1HD2      LEU 125  13.540   2.500  -3.814
  743   2HD2  LEU 125          2HD2      LEU 125  12.809   1.014  -4.422
  744   3HD2  LEU 125          3HD2      LEU 125  13.426   1.083  -2.771
  745    H    LEU 126           H        LEU 126  10.390   6.395  -1.693
  746    HA   LEU 126           HA       LEU 126   9.336   7.829  -3.807
  747   1HB   LEU 126          2HB       LEU 126   8.898   7.936  -1.224
  748   2HB   LEU 126          1HB       LEU 126  10.072   9.237  -1.273
  749    HG   LEU 126           HG       LEU 126   7.376   9.129  -2.610
  750   1HD1  LEU 126          1HD1      LEU 126   8.145  11.513  -1.141
  751   2HD1  LEU 126          2HD1      LEU 126   8.184  10.060  -0.144
  752   3HD1  LEU 126          3HD1      LEU 126   6.705  10.507  -0.994
  753   1HD2  LEU 126          1HD2      LEU 126   7.904  11.275  -3.645
  754   2HD2  LEU 126          2HD2      LEU 126   8.986  10.009  -4.225
  755   3HD2  LEU 126          3HD2      LEU 126   9.554  11.175  -3.029
  756    H    GLY 127           H        GLY 127  10.630   8.504  -5.439
  757   1HA   GLY 127          2HA       GLY 127  11.798  10.488  -6.216
  758   2HA   GLY 127          1HA       GLY 127  12.727  10.454  -4.724
  759    H    SER 128           H        SER 128  13.881  10.614  -7.279
  760    HA   SER 128           HA       SER 128  15.654   8.347  -7.141
  761   1HB   SER 128          2HB       SER 128  13.510   7.962  -8.766
  762   2HB   SER 128          1HB       SER 128  14.642   8.707  -9.895
  763    HG   SER 128           HG       SER 128  14.670   6.215  -8.789
  764    H    LYS 129           H        LYS 129  17.576   8.630  -8.408
  765    HA   LYS 129           HA       LYS 129  17.931  11.306  -9.559
  766   1HB   LYS 129          2HB       LYS 129  19.127  10.305  -7.126
  767   2HB   LYS 129          1HB       LYS 129  20.369  10.687  -8.310
  768   1HG   LYS 129          2HG       LYS 129  18.439  12.792  -8.266
  769   2HG   LYS 129          1HG       LYS 129  18.972  12.450  -6.618
  770   1HD   LYS 129          2HD       LYS 129  21.352  12.470  -7.669
  771   2HD   LYS 129          1HD       LYS 129  20.570  13.358  -8.979
  772   1HE   LYS 129          2HE       LYS 129  21.408  14.992  -7.495
  773   2HE   LYS 129          1HE       LYS 129  19.669  14.920  -7.208
  774   1HZ   LYS 129          1HZ       LYS 129  20.199  13.369  -5.329
  775   2HZ   LYS 129          2HZ       LYS 129  20.707  14.967  -5.107
  776   3HZ   LYS 129          3HZ       LYS 129  21.829  13.775  -5.533
  777    H    HIS 130           H        HIS 130  18.930  11.279 -11.467
  778    HA   HIS 130           HA       HIS 130  20.538   8.913 -12.173
  779   1HB   HIS 130          2HB       HIS 130  18.142   9.919 -13.430
  780   2HB   HIS 130          1HB       HIS 130  19.488   9.963 -14.564
  781    HD1  HIS 130           1HD      HIS 130  16.937   7.970 -14.527
  782    HD2  HIS 130           2HD      HIS 130  20.856   7.091 -13.462
  783    HE1  HIS 130           1HE      HIS 130  17.165   5.480 -14.800
  784    HE2  HIS 130           2HE      HIS 130  19.521   4.961 -14.073
  785    H    LYS 131           H        LYS 131  22.076   9.316 -13.967
  786    HA   LYS 131           HA       LYS 131  22.841  12.091 -14.379
  787   1HB   LYS 131          2HB       LYS 131  24.010  10.780 -12.301
  788   2HB   LYS 131          1HB       LYS 131  25.120  10.385 -13.606
  789   1HG   LYS 131          2HG       LYS 131  26.042  12.395 -13.508
  790   2HG   LYS 131          1HG       LYS 131  24.471  13.178 -13.687
  791   1HD   LYS 131          2HD       LYS 131  24.999  13.966 -11.622
  792   2HD   LYS 131          1HD       LYS 131  24.271  12.434 -11.131
  793   1HE   LYS 131          2HE       LYS 131  26.200  12.185  -9.992
  794   2HE   LYS 131          1HE       LYS 131  26.813  11.643 -11.553
  795   1HZ   LYS 131          1HZ       LYS 131  26.901  14.507 -11.071
  796   2HZ   LYS 131          2HZ       LYS 131  28.037  13.498 -11.816
  797   3HZ   LYS 131          3HZ       LYS 131  27.948  13.570 -10.129
  Start of MODEL   10
    1   2H    ALA   1          HN2       ALA   1 -20.364   3.260 -15.367
    2    H    ALA   1           H        ALA   1 -21.165   2.108 -14.379
    3   3H    ALA   1          HN3       ALA   1 -21.140   3.760 -13.921
    4    HA   ALA   1           HA       ALA   1 -18.975   1.795 -13.909
    5   1HB   ALA   1          1HB       ALA   1 -17.348   3.352 -14.061
    6   2HB   ALA   1          2HB       ALA   1 -18.319   4.600 -13.281
    7   3HB   ALA   1          3HB       ALA   1 -18.568   4.227 -14.987
    8    H    SER   2           H        SER   2 -19.547   0.799 -12.056
    9    HA   SER   2           HA       SER   2 -19.405   2.334  -9.611
   10   1HB   SER   2          2HB       SER   2 -21.889   2.167 -10.558
   11   2HB   SER   2          1HB       SER   2 -21.815   0.586  -9.781
   12    HG   SER   2           HG       SER   2 -21.218   1.673  -7.844
   13    H    MET   3           H        MET   3 -19.009   1.055  -7.766
   14    HA   MET   3           HA       MET   3 -19.073  -1.759  -7.731
   15   1HB   MET   3          2HB       MET   3 -16.758  -0.577  -9.003
   16   2HB   MET   3          1HB       MET   3 -16.285  -1.485  -7.575
   17   1HG   MET   3          2HG       MET   3 -17.857  -2.514  -9.925
   18   2HG   MET   3          1HG       MET   3 -16.186  -2.901  -9.513
   19   1HE   MET   3          1HE       MET   3 -19.654  -4.891  -9.221
   20   2HE   MET   3          2HE       MET   3 -19.744  -3.142  -9.000
   21   3HE   MET   3          3HE       MET   3 -20.057  -4.221  -7.639
   22    H    THR   4           H        THR   4 -16.860   0.802  -6.598
   23    HA   THR   4           HA       THR   4 -17.875   0.889  -3.985
   24    HB   THR   4           HB       THR   4 -16.910  -1.401  -3.890
   25    HG1  THR   4           1HG      THR   4 -15.976  -1.081  -1.924
   26   1HG2  THR   4          1HG2      THR   4 -14.224  -0.071  -4.084
   27   2HG2  THR   4          2HG2      THR   4 -14.971  -0.985  -5.394
   28   3HG2  THR   4          3HG2      THR   4 -14.567  -1.788  -3.877
   29    H    ASP   5           H        ASP   5 -17.408   2.886  -3.392
   30    HA   ASP   5           HA       ASP   5 -15.210   4.313  -4.604
   31   1HB   ASP   5          2HB       ASP   5 -17.513   5.059  -2.839
   32   2HB   ASP   5          1HB       ASP   5 -16.152   6.170  -3.014
   33    H    GLN   6           H        GLN   6 -15.269   2.221  -2.108
   34    HA   GLN   6           HA       GLN   6 -14.085   3.450   0.062
   35   1HB   GLN   6          2HB       GLN   6 -13.177   1.258   0.643
   36   2HB   GLN   6          1HB       GLN   6 -14.835   1.119   0.075
   37   1HG   GLN   6          2HG       GLN   6 -14.176  -0.400  -1.383
   38   2HG   GLN   6          1HG       GLN   6 -13.195   0.825  -2.187
   39   1HE2  GLN   6          1HE2      GLN   6 -10.995   1.018  -1.612
   40   2HE2  GLN   6          2HE2      GLN   6 -10.143  -0.300  -0.891
   41    H    GLN   7           H        GLN   7 -12.723   2.769  -3.047
   42    HA   GLN   7           HA       GLN   7  -9.982   3.008  -2.194
   43   1HB   GLN   7          2HB       GLN   7 -10.674   3.400  -5.048
   44   2HB   GLN   7          1HB       GLN   7  -9.387   2.446  -4.324
   45   1HG   GLN   7          2HG       GLN   7 -11.455   0.974  -3.535
   46   2HG   GLN   7          1HG       GLN   7 -12.175   1.695  -4.975
   47   1HE2  GLN   7          1HE2      GLN   7 -11.536  -1.067  -4.527
   48   2HE2  GLN   7          2HE2      GLN   7 -10.392  -1.523  -5.738
   49    H    ALA   8           H        ALA   8 -12.445   5.207  -2.713
   50    HA   ALA   8           HA       ALA   8 -10.728   7.322  -3.712
   51   1HB   ALA   8          1HB       ALA   8 -12.606   8.418  -4.315
   52   2HB   ALA   8          2HB       ALA   8 -13.465   7.983  -2.837
   53   3HB   ALA   8          3HB       ALA   8 -13.334   6.820  -4.156
   54    H    GLU   9           H        GLU   9 -12.739   6.707  -0.833
   55    HA   GLU   9           HA       GLU   9 -12.087   8.990   0.610
   56   1HB   GLU   9          2HB       GLU   9 -12.480   6.285   1.884
   57   2HB   GLU   9          1HB       GLU   9 -12.885   7.863   2.545
   58   1HG   GLU   9          2HG       GLU   9 -14.532   8.061   0.607
   59   2HG   GLU   9          1HG       GLU   9 -14.279   6.326   0.381
   60    H    ALA  10           H        ALA  10 -10.447   5.878   0.428
   61    HA   ALA  10           HA       ALA  10  -8.522   6.027   2.331
   62   1HB   ALA  10          1HB       ALA  10  -8.814   4.750  -0.264
   63   2HB   ALA  10          2HB       ALA  10  -8.151   4.115   1.245
   64   3HB   ALA  10          3HB       ALA  10  -7.128   5.057   0.160
   65    H    ARG  11           H        ARG  11  -8.118   7.282  -0.989
   66    HA   ARG  11           HA       ARG  11  -5.643   8.482  -0.655
   67   1HB   ARG  11          2HB       ARG  11  -7.245   8.200  -2.755
   68   2HB   ARG  11          1HB       ARG  11  -7.676   9.857  -2.352
   69   1HG   ARG  11          2HG       ARG  11  -5.458  10.613  -2.676
   70   2HG   ARG  11          1HG       ARG  11  -4.835   8.965  -2.750
   71   1HD   ARG  11          2HD       ARG  11  -5.059   9.044  -4.958
   72   2HD   ARG  11          1HD       ARG  11  -6.805   9.119  -4.733
   73    HE   ARG  11           HE       ARG  11  -6.050  11.693  -4.441
   74   1HH1  ARG  11          1HH1      ARG  11  -5.412   9.301  -6.901
   75   2HH1  ARG  11          2HH1      ARG  11  -5.277  10.466  -8.174
   76   1HH2  ARG  11          1HH2      ARG  11  -5.874  13.226  -6.116
   77   2HH2  ARG  11          2HH2      ARG  11  -5.539  12.694  -7.730
   78    H    ALA  12           H        ALA  12  -8.759   9.497   0.455
   79    HA   ALA  12           HA       ALA  12  -7.801  12.175   1.116
   80   1HB   ALA  12          1HB       ALA  12 -10.124  12.622   1.763
   81   2HB   ALA  12          2HB       ALA  12 -10.536  10.941   1.423
   82   3HB   ALA  12          3HB       ALA  12 -10.010  12.002   0.116
   83    H    PHE  13           H        PHE  13  -8.259   9.091   2.570
   84    HA   PHE  13           HA       PHE  13  -8.665   9.948   5.248
   85   1HB   PHE  13          2HB       PHE  13  -8.310   7.440   3.843
   86   2HB   PHE  13          1HB       PHE  13  -7.402   7.450   5.358
   87    HD1  PHE  13           1HD      PHE  13 -10.548   6.891   3.864
   88    HD2  PHE  13           2HD      PHE  13  -8.713   8.249   7.455
   89    HE1  PHE  13           1HE      PHE  13 -12.619   6.408   5.101
   90    HE2  PHE  13           2HE      PHE  13 -10.780   7.767   8.700
   91    HZ   PHE  13           HZ       PHE  13 -12.738   6.845   7.522
   92    H    LEU  14           H        LEU  14  -5.945  10.070   3.237
   93    HA   LEU  14           HA       LEU  14  -4.207  10.459   5.582
   94   1HB   LEU  14          2HB       LEU  14  -3.169   9.476   2.942
   95   2HB   LEU  14          1HB       LEU  14  -2.391   9.419   4.519
   96    HG   LEU  14           HG       LEU  14  -4.846   7.904   4.569
   97   1HD1  LEU  14          1HD1      LEU  14  -3.034   7.486   2.250
   98   2HD1  LEU  14          2HD1      LEU  14  -4.783   7.289   2.371
   99   3HD1  LEU  14          3HD1      LEU  14  -3.708   6.070   3.058
  100   1HD2  LEU  14          1HD2      LEU  14  -3.598   6.507   5.821
  101   2HD2  LEU  14          2HD2      LEU  14  -2.481   7.872   5.854
  102   3HD2  LEU  14          3HD2      LEU  14  -2.231   6.555   4.707
  103    H    SER  15           H        SER  15  -2.237  11.789   5.027
  104    HA   SER  15           HA       SER  15  -3.118  14.192   3.670
  105   1HB   SER  15          2HB       SER  15  -0.336  14.001   4.701
  106   2HB   SER  15          1HB       SER  15  -1.530  15.294   4.891
  107    HG   SER  15           HG       SER  15  -1.001  14.034   6.830
  108    H    GLU  16           H        GLU  16  -1.703  15.309   2.109
  109    HA   GLU  16           HA       GLU  16  -1.142  13.819  -0.144
  110   1HB   GLU  16          2HB       GLU  16  -0.158  16.483   0.824
  111   2HB   GLU  16          1HB       GLU  16   0.490  15.798  -0.660
  112   1HG   GLU  16          2HG       GLU  16  -1.273  17.258  -1.261
  113   2HG   GLU  16          1HG       GLU  16  -1.850  15.610  -1.503
  114    H    GLU  17           H        GLU  17   0.779  14.333   2.691
  115    HA   GLU  17           HA       GLU  17   3.313  13.613   1.728
  116   1HB   GLU  17          2HB       GLU  17   1.978  13.799   4.370
  117   2HB   GLU  17          1HB       GLU  17   3.408  12.776   4.295
  118   1HG   GLU  17          2HG       GLU  17   4.502  14.676   4.732
  119   2HG   GLU  17          1HG       GLU  17   4.302  14.976   3.006
  120    H    MET  18           H        MET  18   0.856  11.655   3.406
  121    HA   MET  18           HA       MET  18   2.225   9.204   3.161
  122   1HB   MET  18          2HB       MET  18   0.026  10.033   4.519
  123   2HB   MET  18          1HB       MET  18  -0.727   9.104   3.224
  124   1HG   MET  18          2HG       MET  18  -0.464   7.480   4.794
  125   2HG   MET  18          1HG       MET  18   1.051   7.304   3.912
  126   1HE   MET  18          1HE       MET  18  -0.024   6.716   7.244
  127   2HE   MET  18          2HE       MET  18   1.623   6.693   7.878
  128   3HE   MET  18          3HE       MET  18   1.251   5.876   6.360
  129    H    ILE  19           H        ILE  19   0.343  11.025   0.916
  130    HA   ILE  19           HA       ILE  19  -0.327   8.813  -0.795
  131    HB   ILE  19           HB       ILE  19  -0.506  11.801  -1.121
  132   1HG1  ILE  19          2HG1      ILE  19  -2.634   9.650  -1.095
  133   2HG1  ILE  19          1HG1      ILE  19  -2.164  10.610   0.311
  134   1HG2  ILE  19          1HG2      ILE  19  -0.794   9.675  -3.188
  135   2HG2  ILE  19          2HG2      ILE  19  -0.119  11.300  -3.325
  136   3HG2  ILE  19          3HG2      ILE  19  -1.867  11.073  -3.243
  137   1HD1  ILE  19          1HD1      ILE  19  -3.709  11.397  -2.100
  138   2HD1  ILE  19          2HD1      ILE  19  -2.729  12.616  -1.285
  139   3HD1  ILE  19          3HD1      ILE  19  -3.995  11.765  -0.398
  140    H    ALA  20           H        ALA  20   1.712  11.686  -1.340
  141    HA   ALA  20           HA       ALA  20   2.987  10.888  -3.632
  142   1HB   ALA  20          1HB       ALA  20   4.764  12.270  -1.768
  143   2HB   ALA  20          2HB       ALA  20   3.177  13.020  -1.941
  144   3HB   ALA  20          3HB       ALA  20   4.188  12.756  -3.362
  145    H    GLU  21           H        GLU  21   3.514   9.777  -0.385
  146    HA   GLU  21           HA       GLU  21   6.002   8.440  -1.057
  147   1HB   GLU  21          2HB       GLU  21   4.394   8.309   1.501
  148   2HB   GLU  21          1HB       GLU  21   6.050   7.764   1.274
  149   1HG   GLU  21          2HG       GLU  21   5.328  10.614   0.763
  150   2HG   GLU  21          1HG       GLU  21   5.591  10.042   2.410
  151    H    PHE  22           H        PHE  22   2.613   7.721  -0.587
  152    HA   PHE  22           HA       PHE  22   2.762   4.926  -0.379
  153   1HB   PHE  22          2HB       PHE  22   0.697   6.924  -0.853
  154   2HB   PHE  22          1HB       PHE  22   0.403   5.453  -1.773
  155    HD1  PHE  22           1HD      PHE  22  -0.794   6.914   0.904
  156    HD2  PHE  22           2HD      PHE  22   1.376   3.367  -0.001
  157    HE1  PHE  22           1HE      PHE  22  -1.706   5.845   2.923
  158    HE2  PHE  22           2HE      PHE  22   0.466   2.291   2.015
  159    HZ   PHE  22           HZ       PHE  22  -1.077   3.532   3.481
  160    H    LYS  23           H        LYS  23   2.821   7.092  -3.127
  161    HA   LYS  23           HA       LYS  23   2.624   4.994  -5.084
  162   1HB   LYS  23          2HB       LYS  23   1.805   7.287  -5.517
  163   2HB   LYS  23          1HB       LYS  23   3.463   7.879  -5.418
  164   1HG   LYS  23          2HG       LYS  23   2.999   5.687  -7.326
  165   2HG   LYS  23          1HG       LYS  23   2.232   7.228  -7.717
  166   1HD   LYS  23          2HD       LYS  23   4.295   8.359  -7.769
  167   2HD   LYS  23          1HD       LYS  23   5.132   7.035  -6.948
  168   1HE   LYS  23          2HE       LYS  23   4.332   5.682  -9.068
  169   2HE   LYS  23          1HE       LYS  23   4.291   7.288  -9.796
  170   1HZ   LYS  23          1HZ       LYS  23   6.646   6.053  -8.471
  171   2HZ   LYS  23          2HZ       LYS  23   6.606   7.589  -9.178
  172   3HZ   LYS  23          3HZ       LYS  23   6.425   6.211 -10.142
  173    H    ALA  24           H        ALA  24   5.087   6.160  -3.112
  174    HA   ALA  24           HA       ALA  24   7.394   6.285  -4.513
  175   1HB   ALA  24          1HB       ALA  24   6.955   4.833  -1.908
  176   2HB   ALA  24          2HB       ALA  24   7.357   6.537  -2.122
  177   3HB   ALA  24          3HB       ALA  24   8.531   5.294  -2.550
  178    H    ALA  25           H        ALA  25   6.618   3.189  -2.955
  179    HA   ALA  25           HA       ALA  25   8.284   1.727  -4.727
  180   1HB   ALA  25          1HB       ALA  25   7.878   1.057  -2.403
  181   2HB   ALA  25          2HB       ALA  25   7.506  -0.238  -3.542
  182   3HB   ALA  25          3HB       ALA  25   6.200   0.695  -2.811
  183    H    PHE  26           H        PHE  26   5.216   2.963  -5.225
  184    HA   PHE  26           HA       PHE  26   3.669   1.069  -6.397
  185   1HB   PHE  26          2HB       PHE  26   3.131   3.503  -6.205
  186   2HB   PHE  26          1HB       PHE  26   4.151   3.794  -7.609
  187    HD1  PHE  26           1HD      PHE  26   1.379   1.484  -6.645
  188    HD2  PHE  26           2HD      PHE  26   3.054   4.051  -9.597
  189    HE1  PHE  26           1HE      PHE  26  -0.535   1.027  -8.123
  190    HE2  PHE  26           2HE      PHE  26   1.142   3.600 -11.080
  191    HZ   PHE  26           HZ       PHE  26  -0.656   2.087 -10.342
  192    H    ASP  27           H        ASP  27   6.647   2.376  -7.674
  193    HA   ASP  27           HA       ASP  27   6.276   1.198 -10.286
  194   1HB   ASP  27          2HB       ASP  27   8.325   2.895  -8.968
  195   2HB   ASP  27          1HB       ASP  27   8.883   1.859 -10.278
  196    H    MET  28           H        MET  28   8.724   0.738  -7.725
  197    HA   MET  28           HA       MET  28   9.842  -1.594  -8.769
  198   1HB   MET  28          2HB       MET  28   9.632  -0.810  -5.855
  199   2HB   MET  28          1HB       MET  28  10.774  -1.958  -6.540
  200   1HG   MET  28          2HG       MET  28  10.719   0.836  -7.573
  201   2HG   MET  28          1HG       MET  28  11.494   0.493  -6.023
  202   1HE   MET  28          1HE       MET  28  14.283   0.812  -6.639
  203   2HE   MET  28          2HE       MET  28  14.758  -0.883  -6.745
  204   3HE   MET  28          3HE       MET  28  13.504  -0.388  -5.608
  205    H    PHE  29           H        PHE  29   6.936  -1.109  -6.919
  206    HA   PHE  29           HA       PHE  29   6.528  -3.676  -5.907
  207   1HB   PHE  29          2HB       PHE  29   4.941  -1.277  -6.331
  208   2HB   PHE  29          1HB       PHE  29   3.988  -2.739  -6.588
  209    HD1  PHE  29           1HD      PHE  29   4.112  -4.530  -4.750
  210    HD2  PHE  29           2HD      PHE  29   5.280  -0.484  -4.185
  211    HE1  PHE  29           1HE      PHE  29   3.844  -4.798  -2.324
  212    HE2  PHE  29           2HE      PHE  29   5.019  -0.742  -1.754
  213    HZ   PHE  29           HZ       PHE  29   4.299  -2.902  -0.818
  214    H    ASP  30           H        ASP  30   4.665  -2.395  -8.648
  215    HA   ASP  30           HA       ASP  30   3.855  -4.849  -9.643
  216   1HB   ASP  30          2HB       ASP  30   4.203  -2.168 -10.974
  217   2HB   ASP  30          1HB       ASP  30   3.564  -3.568 -11.841
  218    H    ALA  31           H        ALA  31   4.953  -6.459 -10.483
  219    HA   ALA  31           HA       ALA  31   7.640  -6.028 -11.519
  220   1HB   ALA  31          1HB       ALA  31   7.933  -8.379 -11.364
  221   2HB   ALA  31          2HB       ALA  31   6.197  -8.652 -11.225
  222   3HB   ALA  31          3HB       ALA  31   7.076  -7.878  -9.907
  223    H    ASP  32           H        ASP  32   4.595  -7.521 -12.585
  224    HA   ASP  32           HA       ASP  32   5.555  -7.770 -15.302
  225   1HB   ASP  32          2HB       ASP  32   3.282  -8.682 -15.750
  226   2HB   ASP  32          1HB       ASP  32   4.117  -9.520 -14.439
  227    H    GLY  33           H        GLY  33   3.704  -5.532 -13.416
  228   1HA   GLY  33          2HA       GLY  33   3.150  -3.347 -13.987
  229   2HA   GLY  33          1HA       GLY  33   3.645  -3.681 -15.640
  230    H    GLY  34           H        GLY  34   1.342  -5.646 -13.863
  231   1HA   GLY  34          2HA       GLY  34  -1.033  -4.407 -14.654
  232   2HA   GLY  34          1HA       GLY  34  -0.578  -5.532 -15.932
  233    H    GLY  35           H        GLY  35  -0.086  -5.916 -12.446
  234   1HA   GLY  35          2HA       GLY  35  -2.217  -7.922 -12.359
  235   2HA   GLY  35          1HA       GLY  35  -0.577  -8.464 -12.010
  236    H    ASP  36           H        ASP  36  -1.409  -5.258 -11.059
  237    HA   ASP  36           HA       ASP  36  -1.540  -4.264  -9.018
  238   1HB   ASP  36          2HB       ASP  36  -3.280  -6.685  -8.716
  239   2HB   ASP  36          1HB       ASP  36  -2.988  -5.638  -7.322
  240    H    ILE  37           H        ILE  37  -1.385  -4.918  -6.473
  241    HA   ILE  37           HA       ILE  37   1.224  -6.228  -6.267
  242    HB   ILE  37           HB       ILE  37  -0.249  -4.392  -4.380
  243   1HG1  ILE  37          2HG1      ILE  37   2.346  -4.038  -5.893
  244   2HG1  ILE  37          1HG1      ILE  37   0.790  -3.358  -6.381
  245   1HG2  ILE  37          1HG2      ILE  37   1.766  -4.448  -2.976
  246   2HG2  ILE  37          2HG2      ILE  37   2.428  -5.721  -4.002
  247   3HG2  ILE  37          3HG2      ILE  37   0.966  -6.017  -3.062
  248   1HD1  ILE  37          1HD1      ILE  37   2.049  -2.754  -3.727
  249   2HD1  ILE  37          2HD1      ILE  37   0.745  -1.895  -4.548
  250   3HD1  ILE  37          3HD1      ILE  37   2.388  -1.816  -5.182
  251    H    SER  38           H        SER  38   1.266  -8.279  -5.671
  252    HA   SER  38           HA       SER  38  -0.943  -9.385  -4.104
  253   1HB   SER  38          2HB       SER  38  -0.250 -10.520  -6.220
  254   2HB   SER  38          1HB       SER  38   1.323 -10.848  -5.484
  255    HG   SER  38           HG       SER  38  -1.125 -11.670  -4.318
  256    H    THR  39           H        THR  39   0.407 -11.573  -2.978
  257    HA   THR  39           HA       THR  39   1.409 -10.409  -0.601
  258    HB   THR  39           HB       THR  39   2.022 -12.809  -0.038
  259    HG1  THR  39           1HG      THR  39   1.716 -14.331  -1.484
  260   1HG2  THR  39          1HG2      THR  39  -0.760 -12.063  -0.848
  261   2HG2  THR  39          2HG2      THR  39  -0.066 -12.172   0.770
  262   3HG2  THR  39          3HG2      THR  39  -0.384 -13.640  -0.156
  263    H    LYS  40           H        LYS  40   2.968 -11.913  -3.385
  264    HA   LYS  40           HA       LYS  40   5.589 -11.870  -2.249
  265   1HB   LYS  40          2HB       LYS  40   6.340 -12.417  -4.544
  266   2HB   LYS  40          1HB       LYS  40   5.053 -13.480  -3.974
  267   1HG   LYS  40          2HG       LYS  40   3.625 -11.536  -5.228
  268   2HG   LYS  40          1HG       LYS  40   5.094 -11.588  -6.212
  269   1HD   LYS  40          2HD       LYS  40   4.552 -13.573  -7.096
  270   2HD   LYS  40          1HD       LYS  40   4.077 -14.237  -5.532
  271   1HE   LYS  40          2HE       LYS  40   2.248 -12.224  -6.651
  272   2HE   LYS  40          1HE       LYS  40   2.362 -13.727  -7.568
  273   1HZ   LYS  40          1HZ       LYS  40   1.396 -13.294  -4.826
  274   2HZ   LYS  40          2HZ       LYS  40   2.059 -14.794  -5.237
  275   3HZ   LYS  40          3HZ       LYS  40   0.711 -14.211  -6.074
  276    H    GLU  41           H        GLU  41   3.762  -9.735  -4.379
  277    HA   GLU  41           HA       GLU  41   5.837  -8.048  -5.180
  278   1HB   GLU  41          2HB       GLU  41   2.883  -7.619  -4.833
  279   2HB   GLU  41          1HB       GLU  41   3.934  -6.317  -5.366
  280   1HG   GLU  41          2HG       GLU  41   4.563  -8.544  -6.959
  281   2HG   GLU  41          1HG       GLU  41   2.804  -8.465  -6.875
  282    H    LEU  42           H        LEU  42   4.272  -8.343  -2.118
  283    HA   LEU  42           HA       LEU  42   5.004  -5.716  -1.195
  284   1HB   LEU  42          2HB       LEU  42   3.360  -7.879  -0.271
  285   2HB   LEU  42          1HB       LEU  42   4.463  -7.395   1.012
  286    HG   LEU  42           HG       LEU  42   2.427  -6.177   1.284
  287   1HD1  LEU  42          1HD1      LEU  42   4.219  -4.813   1.886
  288   2HD1  LEU  42          2HD1      LEU  42   3.247  -3.796   0.824
  289   3HD1  LEU  42          3HD1      LEU  42   4.715  -4.559   0.213
  290   1HD2  LEU  42          1HD2      LEU  42   2.331  -6.254  -1.527
  291   2HD2  LEU  42          2HD2      LEU  42   2.354  -4.553  -1.061
  292   3HD2  LEU  42          3HD2      LEU  42   1.117  -5.629  -0.412
  293    H    GLY  43           H        GLY  43   5.959  -8.997  -0.150
  294   1HA   GLY  43          2HA       GLY  43   8.019  -8.358   1.539
  295   2HA   GLY  43          1HA       GLY  43   8.005  -9.805   0.533
  296    H    THR  44           H        THR  44   8.030  -8.192  -1.947
  297    HA   THR  44           HA       THR  44  10.778  -8.161  -2.428
  298    HB   THR  44           HB       THR  44   8.362  -7.136  -3.846
  299    HG1  THR  44           1HG      THR  44   9.111  -9.277  -4.112
  300   1HG2  THR  44          1HG2      THR  44  10.035  -6.538  -5.760
  301   2HG2  THR  44          2HG2      THR  44  11.119  -6.176  -4.416
  302   3HG2  THR  44          3HG2      THR  44   9.574  -5.333  -4.553
  303    H    VAL  45           H        VAL  45   8.834  -5.225  -2.727
  304    HA   VAL  45           HA       VAL  45  10.967  -3.464  -2.301
  305    HB   VAL  45           HB       VAL  45   8.947  -2.791  -3.466
  306   1HG1  VAL  45          1HG1      VAL  45   7.676  -3.737  -1.010
  307   2HG1  VAL  45          2HG1      VAL  45   7.031  -3.596  -2.645
  308   3HG1  VAL  45          3HG1      VAL  45   7.052  -2.188  -1.582
  309   1HG2  VAL  45          1HG2      VAL  45   9.326  -0.671  -2.904
  310   2HG2  VAL  45          2HG2      VAL  45  10.311  -1.267  -1.569
  311   3HG2  VAL  45          3HG2      VAL  45   8.605  -0.900  -1.311
  312    H    MET  46           H        MET  46   8.835  -5.056  -0.057
  313    HA   MET  46           HA       MET  46   9.351  -3.286   2.129
  314   1HB   MET  46          2HB       MET  46   8.016  -5.954   1.835
  315   2HB   MET  46          1HB       MET  46   8.362  -5.307   3.439
  316   1HG   MET  46          2HG       MET  46   7.155  -3.237   1.947
  317   2HG   MET  46          1HG       MET  46   6.208  -4.702   1.670
  318   1HE   MET  46          1HE       MET  46   6.576  -2.225   5.456
  319   2HE   MET  46          2HE       MET  46   6.068  -1.624   3.876
  320   3HE   MET  46          3HE       MET  46   7.706  -2.242   4.102
  321    H    ARG  47           H        ARG  47  10.807  -6.244   0.930
  322    HA   ARG  47           HA       ARG  47  12.444  -6.564   3.301
  323   1HB   ARG  47          2HB       ARG  47  12.311  -8.061   0.687
  324   2HB   ARG  47          1HB       ARG  47  13.495  -8.424   1.934
  325   1HG   ARG  47          2HG       ARG  47  11.813  -9.084   3.467
  326   2HG   ARG  47          1HG       ARG  47  10.531  -8.455   2.432
  327   1HD   ARG  47          2HD       ARG  47  11.109 -10.129   0.726
  328   2HD   ARG  47          1HD       ARG  47  12.358 -10.772   1.799
  329    HE   ARG  47           HE       ARG  47   9.731 -10.717   2.971
  330   1HH1  ARG  47          1HH1      ARG  47  11.954 -12.557   1.006
  331   2HH1  ARG  47          2HH1      ARG  47  11.209 -14.077   1.366
  332   1HH2  ARG  47          1HH2      ARG  47   8.749 -12.716   3.444
  333   2HH2  ARG  47          2HH2      ARG  47   9.389 -14.169   2.750
  334    H    MET  48           H        MET  48  12.729  -5.180   0.116
  335    HA   MET  48           HA       MET  48  15.617  -4.904   0.372
  336   1HB   MET  48          2HB       MET  48  15.552  -3.994  -1.887
  337   2HB   MET  48          1HB       MET  48  14.682  -5.524  -1.809
  338   1HG   MET  48          2HG       MET  48  12.803  -4.588  -2.511
  339   2HG   MET  48          1HG       MET  48  12.920  -3.291  -1.324
  340   1HE   MET  48          1HE       MET  48  12.791  -0.553  -3.691
  341   2HE   MET  48          2HE       MET  48  12.213  -1.400  -2.256
  342   3HE   MET  48          3HE       MET  48  11.652  -1.891  -3.855
  343    H    LEU  49           H        LEU  49  13.281  -3.349   1.844
  344    HA   LEU  49           HA       LEU  49  14.511  -0.700   1.466
  345   1HB   LEU  49          2HB       LEU  49  11.661  -1.488   1.940
  346   2HB   LEU  49          1HB       LEU  49  12.232   0.089   2.449
  347    HG   LEU  49           HG       LEU  49  12.174  -0.994  -0.364
  348   1HD1  LEU  49          1HD1      LEU  49  10.031  -0.260   0.113
  349   2HD1  LEU  49          2HD1      LEU  49  10.778   1.171  -0.597
  350   3HD1  LEU  49          3HD1      LEU  49  10.598   1.045   1.153
  351   1HD2  LEU  49          1HD2      LEU  49  14.090   0.260  -0.465
  352   2HD2  LEU  49          2HD2      LEU  49  13.579   1.350   0.823
  353   3HD2  LEU  49          3HD2      LEU  49  12.877   1.498  -0.788
  354    H    GLY  50           H        GLY  50  13.068  -2.954   3.783
  355   1HA   GLY  50          2HA       GLY  50  14.864  -2.686   5.806
  356   2HA   GLY  50          1HA       GLY  50  13.774  -1.325   6.057
  357    H    GLN  51           H        GLN  51  11.405  -2.694   5.138
  358    HA   GLN  51           HA       GLN  51  10.619  -3.898   7.581
  359   1HB   GLN  51          2HB       GLN  51   9.303  -2.783   5.445
  360   2HB   GLN  51          1HB       GLN  51   8.937  -4.496   5.249
  361   1HG   GLN  51          2HG       GLN  51   7.215  -3.944   6.596
  362   2HG   GLN  51          1HG       GLN  51   8.414  -4.270   7.847
  363   1HE2  GLN  51          1HE2      GLN  51   7.241  -2.899   9.249
  364   2HE2  GLN  51          2HE2      GLN  51   7.366  -1.181   9.124
  365    H    ASN  52           H        ASN  52   9.762  -6.076   7.849
  366    HA   ASN  52           HA       ASN  52  10.784  -8.075   5.983
  367   1HB   ASN  52          2HB       ASN  52  12.318  -7.445   8.123
  368   2HB   ASN  52          1HB       ASN  52  11.301  -8.707   8.823
  369   1HD2  ASN  52          1HD2      ASN  52  13.749  -7.957   6.487
  370   2HD2  ASN  52          2HD2      ASN  52  14.175  -9.586   6.104
  371    HA   PRO  53           HA       PRO  53   6.655  -8.997   8.129
  372   1HB   PRO  53          2HB       PRO  53   4.993  -8.584   6.037
  373   2HB   PRO  53          1HB       PRO  53   5.457  -7.290   7.150
  374   1HG   PRO  53          2HG       PRO  53   6.541  -7.931   4.433
  375   2HG   PRO  53          1HG       PRO  53   6.126  -6.355   5.128
  376   1HD   PRO  53          2HD       PRO  53   8.676  -7.283   5.001
  377   2HD   PRO  53          1HD       PRO  53   8.107  -6.203   6.293
  378    H    THR  54           H        THR  54   6.742 -11.160   8.259
  379    HA   THR  54           HA       THR  54   7.555 -12.924   6.264
  380    HB   THR  54           HB       THR  54   5.565 -13.964   8.185
  381    HG1  THR  54           1HG      THR  54   7.977 -12.756   9.055
  382   1HG2  THR  54          1HG2      THR  54   7.853 -14.926   6.834
  383   2HG2  THR  54          2HG2      THR  54   6.744 -15.802   7.888
  384   3HG2  THR  54          3HG2      THR  54   8.167 -15.012   8.568
  385    H    LYS  55           H        LYS  55   5.731 -14.910   5.956
  386    HA   LYS  55           HA       LYS  55   4.124 -13.947   3.842
  387   1HB   LYS  55          2HB       LYS  55   5.090 -16.355   4.403
  388   2HB   LYS  55          1HB       LYS  55   3.500 -16.561   5.140
  389   1HG   LYS  55          2HG       LYS  55   3.296 -17.386   2.955
  390   2HG   LYS  55          1HG       LYS  55   2.533 -15.795   2.926
  391   1HD   LYS  55          2HD       LYS  55   4.797 -14.918   2.130
  392   2HD   LYS  55          1HD       LYS  55   5.216 -16.607   1.840
  393   1HE   LYS  55          2HE       LYS  55   2.917 -16.610   0.559
  394   2HE   LYS  55          1HE       LYS  55   3.220 -14.876   0.462
  395   1HZ   LYS  55          1HZ       LYS  55   5.345 -16.758  -0.304
  396   2HZ   LYS  55          2HZ       LYS  55   5.065 -15.179  -0.845
  397   3HZ   LYS  55          3HZ       LYS  55   4.085 -16.445  -1.390
  398    H    CYS  56           H        CYS  56   3.208 -15.275   7.023
  399    HA   CYS  56           HA       CYS  56   0.466 -14.844   6.819
  400   1HB   CYS  56          2HB       CYS  56   2.002 -16.018   8.662
  401   2HB   CYS  56          1HB       CYS  56   1.747 -14.475   9.481
  402    HG   CYS  56           HG       CYS  56  -0.392 -15.387  10.216
  403    H    GLU  57           H        GLU  57   3.053 -12.659   7.728
  404    HA   GLU  57           HA       GLU  57   1.523 -10.596   8.844
  405   1HB   GLU  57          2HB       GLU  57   4.085 -10.347   7.252
  406   2HB   GLU  57          1HB       GLU  57   3.430  -9.146   8.368
  407   1HG   GLU  57          2HG       GLU  57   3.561 -11.327   9.970
  408   2HG   GLU  57          1HG       GLU  57   4.935 -11.607   8.902
  409    H    LEU  58           H        LEU  58   2.842 -10.793   5.535
  410    HA   LEU  58           HA       LEU  58   1.332  -8.597   4.577
  411   1HB   LEU  58          2HB       LEU  58   2.470 -10.831   2.903
  412   2HB   LEU  58          1HB       LEU  58   2.144  -9.175   2.407
  413    HG   LEU  58           HG       LEU  58   4.138  -9.690   4.582
  414   1HD1  LEU  58          1HD1      LEU  58   5.770 -10.438   3.226
  415   2HD1  LEU  58          2HD1      LEU  58   5.194  -9.509   1.842
  416   3HD1  LEU  58          3HD1      LEU  58   4.420 -11.038   2.263
  417   1HD2  LEU  58          1HD2      LEU  58   3.985  -7.443   4.398
  418   2HD2  LEU  58          2HD2      LEU  58   3.388  -7.509   2.739
  419   3HD2  LEU  58          3HD2      LEU  58   5.111  -7.700   3.065
  420    H    ASP  59           H        ASP  59   0.718 -12.029   4.793
  421    HA   ASP  59           HA       ASP  59  -1.513 -12.076   3.020
  422   1HB   ASP  59          2HB       ASP  59  -0.044 -14.044   3.911
  423   2HB   ASP  59          1HB       ASP  59  -1.174 -14.034   5.269
  424    H    ALA  60           H        ALA  60  -1.078 -11.193   6.334
  425    HA   ALA  60           HA       ALA  60  -3.838 -11.463   7.051
  426   1HB   ALA  60          1HB       ALA  60  -2.244 -11.643   8.813
  427   2HB   ALA  60          2HB       ALA  60  -3.148 -10.151   9.079
  428   3HB   ALA  60          3HB       ALA  60  -1.522 -10.088   8.399
  429    H    ILE  61           H        ILE  61  -1.769  -8.917   5.822
  430    HA   ILE  61           HA       ILE  61  -3.697  -6.829   6.206
  431    HB   ILE  61           HB       ILE  61  -1.045  -7.017   4.822
  432   1HG1  ILE  61          2HG1      ILE  61  -0.611  -5.041   6.337
  433   2HG1  ILE  61          1HG1      ILE  61  -2.210  -5.318   7.034
  434   1HG2  ILE  61          1HG2      ILE  61  -2.175  -5.731   3.218
  435   2HG2  ILE  61          2HG2      ILE  61  -1.354  -4.556   4.246
  436   3HG2  ILE  61          3HG2      ILE  61  -3.083  -4.845   4.443
  437   1HD1  ILE  61          1HD1      ILE  61   0.125  -7.217   7.068
  438   2HD1  ILE  61          2HD1      ILE  61  -1.486  -7.585   7.683
  439   3HD1  ILE  61          3HD1      ILE  61  -0.528  -6.309   8.432
  440    H    ILE  62           H        ILE  62  -2.329  -8.330   3.259
  441    HA   ILE  62           HA       ILE  62  -3.932  -7.262   1.338
  442    HB   ILE  62           HB       ILE  62  -2.989 -10.124   1.518
  443   1HG1  ILE  62          2HG1      ILE  62  -1.874  -7.667   0.146
  444   2HG1  ILE  62          1HG1      ILE  62  -1.179  -8.501   1.538
  445   1HG2  ILE  62          1HG2      ILE  62  -3.254  -9.409  -1.168
  446   2HG2  ILE  62          2HG2      ILE  62  -4.741  -8.861  -0.396
  447   3HG2  ILE  62          3HG2      ILE  62  -4.251 -10.550  -0.265
  448   1HD1  ILE  62          1HD1      ILE  62  -0.348 -10.198   0.275
  449   2HD1  ILE  62          2HD1      ILE  62  -0.278  -8.884  -0.899
  450   3HD1  ILE  62          3HD1      ILE  62  -1.600 -10.049  -0.958
  451    H    CYS  63           H        CYS  63  -4.706 -10.153   3.272
  452    HA   CYS  63           HA       CYS  63  -7.176 -10.752   2.163
  453   1HB   CYS  63          2HB       CYS  63  -5.729 -11.917   4.060
  454   2HB   CYS  63          1HB       CYS  63  -6.824 -11.026   5.120
  455    HG   CYS  63           HG       CYS  63  -7.569 -13.443   3.387
  456    H    GLU  64           H        GLU  64  -6.298  -8.354   4.570
  457    HA   GLU  64           HA       GLU  64  -9.038  -7.591   5.080
  458   1HB   GLU  64          2HB       GLU  64  -6.773  -7.368   6.555
  459   2HB   GLU  64          1HB       GLU  64  -6.845  -5.758   5.851
  460   1HG   GLU  64          2HG       GLU  64  -8.147  -5.270   7.591
  461   2HG   GLU  64          1HG       GLU  64  -9.411  -6.104   6.689
  462    H    VAL  65           H        VAL  65  -6.333  -6.541   3.131
  463    HA   VAL  65           HA       VAL  65  -7.344  -4.024   2.335
  464    HB   VAL  65           HB       VAL  65  -5.477  -5.874   0.835
  465   1HG1  VAL  65          1HG1      VAL  65  -6.502  -4.138  -0.580
  466   2HG1  VAL  65          2HG1      VAL  65  -4.763  -3.914  -0.389
  467   3HG1  VAL  65          3HG1      VAL  65  -5.887  -2.904   0.518
  468   1HG2  VAL  65          1HG2      VAL  65  -4.318  -5.464   2.779
  469   2HG2  VAL  65          2HG2      VAL  65  -5.035  -3.873   3.008
  470   3HG2  VAL  65          3HG2      VAL  65  -3.790  -4.113   1.783
  471    H    ASP  66           H        ASP  66  -7.233  -7.115   0.580
  472    HA   ASP  66           HA       ASP  66  -8.884  -6.303  -1.545
  473   1HB   ASP  66          2HB       ASP  66  -7.996  -8.966  -0.479
  474   2HB   ASP  66          1HB       ASP  66  -9.184  -8.881  -1.777
  475    H    GLU  67           H        GLU  67 -10.945  -5.750  -1.436
  476    HA   GLU  67           HA       GLU  67 -12.636  -6.764   0.702
  477   1HB   GLU  67          2HB       GLU  67 -12.937  -4.608  -1.373
  478   2HB   GLU  67          1HB       GLU  67 -14.328  -5.179  -0.451
  479   1HG   GLU  67          2HG       GLU  67 -11.816  -3.940   0.658
  480   2HG   GLU  67          1HG       GLU  67 -13.416  -3.195   0.567
  481    H    ASP  68           H        ASP  68 -12.048  -7.299  -2.655
  482    HA   ASP  68           HA       ASP  68 -14.540  -8.821  -2.934
  483   1HB   ASP  68          2HB       ASP  68 -14.073  -8.806  -5.342
  484   2HB   ASP  68          1HB       ASP  68 -14.075  -7.171  -4.692
  485    H    GLY  69           H        GLY  69 -11.928  -9.612  -1.518
  486   1HA   GLY  69          2HA       GLY  69 -10.610 -11.484  -1.299
  487   2HA   GLY  69          1HA       GLY  69 -12.007 -12.335  -1.937
  488    H    SER  70           H        SER  70  -9.532 -10.138  -3.266
  489    HA   SER  70           HA       SER  70  -9.201 -12.030  -5.499
  490   1HB   SER  70          2HB       SER  70  -8.043  -9.758  -6.418
  491   2HB   SER  70          1HB       SER  70  -9.751 -10.149  -6.657
  492    HG   SER  70           HG       SER  70  -8.869  -8.024  -5.539
  493    H    GLY  71           H        GLY  71  -7.627 -10.551  -2.830
  494   1HA   GLY  71          2HA       GLY  71  -5.518 -10.888  -1.966
  495   2HA   GLY  71          1HA       GLY  71  -5.269 -12.107  -3.214
  496    H    THR  72           H        THR  72  -6.231  -9.188  -4.585
  497    HA   THR  72           HA       THR  72  -3.432  -8.410  -5.067
  498    HB   THR  72           HB       THR  72  -3.943  -7.896  -7.335
  499    HG1  THR  72           1HG      THR  72  -6.641  -8.349  -6.610
  500   1HG2  THR  72          1HG2      THR  72  -5.469 -10.165  -7.802
  501   2HG2  THR  72          2HG2      THR  72  -4.538 -10.532  -6.349
  502   3HG2  THR  72          3HG2      THR  72  -3.710 -10.038  -7.826
  503    H    ILE  73           H        ILE  73  -2.974  -6.217  -5.208
  504    HA   ILE  73           HA       ILE  73  -5.035  -4.475  -4.050
  505    HB   ILE  73           HB       ILE  73  -2.062  -3.985  -4.213
  506   1HG1  ILE  73          2HG1      ILE  73  -3.610  -4.809  -1.755
  507   2HG1  ILE  73          1HG1      ILE  73  -2.824  -5.986  -2.810
  508   1HG2  ILE  73          1HG2      ILE  73  -2.495  -2.252  -2.544
  509   2HG2  ILE  73          2HG2      ILE  73  -4.219  -2.618  -2.606
  510   3HG2  ILE  73          3HG2      ILE  73  -3.406  -1.956  -4.025
  511   1HD1  ILE  73          1HD1      ILE  73  -1.634  -5.006  -0.673
  512   2HD1  ILE  73          2HD1      ILE  73  -1.196  -3.723  -1.800
  513   3HD1  ILE  73          3HD1      ILE  73  -0.737  -5.391  -2.141
  514    H    ASP  74           H        ASP  74  -6.038  -3.119  -5.369
  515    HA   ASP  74           HA       ASP  74  -5.177  -2.649  -8.041
  516   1HB   ASP  74          2HB       ASP  74  -7.531  -2.151  -6.450
  517   2HB   ASP  74          1HB       ASP  74  -7.105  -0.703  -7.369
  518    H    PHE  75           H        PHE  75  -5.661  -0.008  -8.549
  519    HA   PHE  75           HA       PHE  75  -3.196   1.193  -7.963
  520   1HB   PHE  75          2HB       PHE  75  -5.782   2.378  -8.985
  521   2HB   PHE  75          1HB       PHE  75  -4.266   3.277  -8.890
  522    HD1  PHE  75           1HD      PHE  75  -6.034   0.526 -10.559
  523    HD2  PHE  75           2HD      PHE  75  -2.501   2.895 -10.454
  524    HE1  PHE  75           1HE      PHE  75  -5.394  -0.339 -12.772
  525    HE2  PHE  75           2HE      PHE  75  -1.854   2.035 -12.667
  526    HZ   PHE  75           HZ       PHE  75  -3.302   0.417 -13.829
  527    H    GLU  76           H        GLU  76  -6.260   2.771  -7.113
  528    HA   GLU  76           HA       GLU  76  -5.153   4.226  -4.982
  529   1HB   GLU  76          2HB       GLU  76  -8.032   3.510  -5.558
  530   2HB   GLU  76          1HB       GLU  76  -7.524   4.676  -4.343
  531   1HG   GLU  76          2HG       GLU  76  -6.259   5.406  -6.751
  532   2HG   GLU  76          1HG       GLU  76  -7.940   5.049  -7.140
  533    H    GLU  77           H        GLU  77  -6.399   1.003  -5.157
  534    HA   GLU  77           HA       GLU  77  -7.181   0.528  -2.548
  535   1HB   GLU  77          2HB       GLU  77  -6.301  -1.093  -4.817
  536   2HB   GLU  77          1HB       GLU  77  -5.930  -1.826  -3.263
  537   1HG   GLU  77          2HG       GLU  77  -8.292  -1.569  -2.609
  538   2HG   GLU  77          1HG       GLU  77  -8.640  -0.921  -4.217
  539    H    PHE  78           H        PHE  78  -3.993   1.044  -3.808
  540    HA   PHE  78           HA       PHE  78  -2.479  -0.190  -1.770
  541   1HB   PHE  78          2HB       PHE  78  -1.685   0.756  -4.036
  542   2HB   PHE  78          1HB       PHE  78  -1.609   2.314  -3.206
  543    HD1  PHE  78           1HD      PHE  78   0.336   2.915  -2.130
  544    HD2  PHE  78           2HD      PHE  78  -0.434  -1.206  -2.859
  545    HE1  PHE  78           1HE      PHE  78   2.570   2.349  -1.267
  546    HE2  PHE  78           2HE      PHE  78   1.798  -1.779  -1.997
  547    HZ   PHE  78           HZ       PHE  78   3.301  -0.000  -1.199
  548    H    LEU  79           H        LEU  79  -4.470   2.574  -1.704
  549    HA   LEU  79           HA       LEU  79  -3.096   3.707   0.615
  550   1HB   LEU  79          2HB       LEU  79  -5.512   4.674  -0.923
  551   2HB   LEU  79          1HB       LEU  79  -4.779   5.517   0.429
  552    HG   LEU  79           HG       LEU  79  -2.715   5.051  -1.451
  553   1HD1  LEU  79          1HD1      LEU  79  -3.896   6.567  -3.267
  554   2HD1  LEU  79          2HD1      LEU  79  -5.330   5.724  -2.681
  555   3HD1  LEU  79          3HD1      LEU  79  -3.973   4.806  -3.333
  556   1HD2  LEU  79          1HD2      LEU  79  -2.374   6.975  -0.331
  557   2HD2  LEU  79          2HD2      LEU  79  -4.098   7.313  -0.173
  558   3HD2  LEU  79          3HD2      LEU  79  -3.261   7.687  -1.679
  559    H    VAL  80           H        VAL  80  -6.109   2.162  -0.344
  560    HA   VAL  80           HA       VAL  80  -7.417   2.375   2.161
  561    HB   VAL  80           HB       VAL  80  -7.865   0.245   0.070
  562   1HG1  VAL  80          1HG1      VAL  80  -9.386   1.223   2.442
  563   2HG1  VAL  80          2HG1      VAL  80  -9.104  -0.427   1.886
  564   3HG1  VAL  80          3HG1      VAL  80 -10.266   0.599   1.047
  565   1HG2  VAL  80          1HG2      VAL  80  -7.932   2.773  -0.618
  566   2HG2  VAL  80          2HG2      VAL  80  -9.491   2.737   0.205
  567   3HG2  VAL  80          3HG2      VAL  80  -9.186   1.658  -1.155
  568    H    MET  81           H        MET  81  -5.292  -0.021   0.716
  569    HA   MET  81           HA       MET  81  -5.554  -2.196   2.333
  570   1HB   MET  81          2HB       MET  81  -2.957  -2.326   2.091
  571   2HB   MET  81          1HB       MET  81  -3.960  -2.442   0.656
  572   1HG   MET  81          2HG       MET  81  -3.314  -0.427  -0.136
  573   2HG   MET  81          1HG       MET  81  -3.014   0.245   1.471
  574   1HE   MET  81          1HE       MET  81  -0.047  -0.394   2.680
  575   2HE   MET  81          2HE       MET  81  -0.178  -2.143   2.464
  576   3HE   MET  81          3HE       MET  81  -1.591  -1.208   2.955
  577    H    MET  82           H        MET  82  -3.913   0.796   2.994
  578    HA   MET  82           HA       MET  82  -3.087  -0.065   5.641
  579   1HB   MET  82          2HB       MET  82  -2.481   2.229   3.836
  580   2HB   MET  82          1HB       MET  82  -2.152   2.378   5.568
  581   1HG   MET  82          2HG       MET  82  -1.175  -0.132   4.556
  582   2HG   MET  82          1HG       MET  82  -0.536   1.213   3.613
  583   1HE   MET  82          1HE       MET  82  -0.213   3.519   5.271
  584   2HE   MET  82          2HE       MET  82   1.237   2.908   4.478
  585   3HE   MET  82          3HE       MET  82   1.291   3.369   6.182
  586    H    VAL  83           H        VAL  83  -5.486   1.946   4.100
  587    HA   VAL  83           HA       VAL  83  -6.220   3.506   6.346
  588    HB   VAL  83           HB       VAL  83  -7.910   2.674   3.978
  589   1HG1  VAL  83          1HG1      VAL  83  -9.310   4.599   4.526
  590   2HG1  VAL  83          2HG1      VAL  83  -8.330   4.908   5.961
  591   3HG1  VAL  83          3HG1      VAL  83  -9.283   3.428   5.845
  592   1HG2  VAL  83          1HG2      VAL  83  -7.024   5.422   4.009
  593   2HG2  VAL  83          2HG2      VAL  83  -6.853   4.199   2.751
  594   3HG2  VAL  83          3HG2      VAL  83  -5.655   4.309   4.041
  595    H    ARG  84           H        ARG  84  -7.361   0.402   5.088
  596    HA   ARG  84           HA       ARG  84  -9.498   0.037   6.874
  597   1HB   ARG  84          2HB       ARG  84  -7.789  -2.073   5.547
  598   2HB   ARG  84          1HB       ARG  84  -9.376  -2.329   6.258
  599   1HG   ARG  84          2HG       ARG  84  -9.938  -0.343   4.517
  600   2HG   ARG  84          1HG       ARG  84  -8.625  -1.169   3.665
  601   1HD   ARG  84          2HD       ARG  84  -9.914  -2.931   3.178
  602   2HD   ARG  84          1HD       ARG  84 -10.570  -3.010   4.813
  603    HE   ARG  84           HE       ARG  84 -11.813  -1.855   2.531
  604   1HH1  ARG  84          1HH1      ARG  84 -11.484  -1.503   5.988
  605   2HH1  ARG  84          2HH1      ARG  84 -13.012  -0.713   6.179
  606   1HH2  ARG  84          1HH2      ARG  84 -13.823  -0.817   2.780
  607   2HH2  ARG  84          2HH2      ARG  84 -14.342  -0.324   4.358
  608    H    GLN  85           H        GLN  85  -6.070  -0.393   7.253
  609    HA   GLN  85           HA       GLN  85  -6.530  -1.601   9.897
  610   1HB   GLN  85          2HB       GLN  85  -4.352  -2.574   9.800
  611   2HB   GLN  85          1HB       GLN  85  -5.160  -2.930   8.276
  612   1HG   GLN  85          2HG       GLN  85  -3.038  -2.359   7.597
  613   2HG   GLN  85          1HG       GLN  85  -3.911  -0.833   7.406
  614   1HE2  GLN  85          1HE2      GLN  85  -2.116  -2.609   9.904
  615   2HE2  GLN  85          2HE2      GLN  85  -1.256  -1.236  10.502
  616    H    MET  86           H        MET  86  -6.333   1.336   8.827
  617    HA   MET  86           HA       MET  86  -4.282   2.272  10.708
  618   1HB   MET  86          2HB       MET  86  -5.332   3.271   8.154
  619   2HB   MET  86          1HB       MET  86  -5.169   4.515   9.393
  620   1HG   MET  86          2HG       MET  86  -2.795   3.518   9.712
  621   2HG   MET  86          1HG       MET  86  -3.063   2.835   8.105
  622   1HE   MET  86          1HE       MET  86  -1.454   3.778   6.768
  623   2HE   MET  86          2HE       MET  86  -1.421   5.433   6.161
  624   3HE   MET  86          3HE       MET  86  -2.799   4.389   5.802
  625    H    LYS  87           H        LYS  87  -7.652   2.840   9.740
  626    HA   LYS  87           HA       LYS  87  -8.314   4.717  11.694
  627   1HB   LYS  87          2HB       LYS  87  -9.913   2.702  10.146
  628   2HB   LYS  87          1HB       LYS  87 -10.685   3.685  11.390
  629   1HG   LYS  87          2HG       LYS  87 -10.835   5.414  10.015
  630   2HG   LYS  87          1HG       LYS  87  -9.106   5.343   9.652
  631   1HD   LYS  87          2HD       LYS  87 -10.424   5.094   7.619
  632   2HD   LYS  87          1HD       LYS  87  -9.540   3.609   7.972
  633   1HE   LYS  87          2HE       LYS  87 -11.598   2.742   7.482
  634   2HE   LYS  87          1HE       LYS  87 -11.768   2.976   9.221
  635   1HZ   LYS  87          1HZ       LYS  87 -12.836   4.678   7.045
  636   2HZ   LYS  87          2HZ       LYS  87 -12.767   5.198   8.652
  637   3HZ   LYS  87          3HZ       LYS  87 -13.701   3.850   8.240
  638    H    GLU  88           H        GLU  88  -8.097   1.227  11.856
  639    HA   GLU  88           HA       GLU  88  -9.477   0.834  14.276
  640   1HB   GLU  88          2HB       GLU  88  -7.497  -0.715  12.681
  641   2HB   GLU  88          1HB       GLU  88  -7.756  -1.202  14.351
  642   1HG   GLU  88          2HG       GLU  88 -10.303  -1.006  13.550
  643   2HG   GLU  88          1HG       GLU  88  -9.539  -1.407  12.012
  644    H    ASP  89           H        ASP  89  -6.191   1.813  13.571
  645    HA   ASP  89           HA       ASP  89  -5.027   1.367  16.074
  646   1HB   ASP  89          2HB       ASP  89  -4.438   3.428  13.944
  647   2HB   ASP  89          1HB       ASP  89  -3.440   3.218  15.386
  648    H    ALA  90           H        ALA  90  -7.119   3.915  14.929
  649    HA   ALA  90           HA       ALA  90  -6.643   5.848  16.894
  650   1HB   ALA  90          1HB       ALA  90  -7.900   6.520  15.026
  651   2HB   ALA  90          2HB       ALA  90  -9.035   6.554  16.376
  652   3HB   ALA  90          3HB       ALA  90  -9.064   5.211  15.233
  653   2H    ARG 115          HN2       ARG 115   2.639  -2.423  10.767
  654    H    ARG 115           H        ARG 115   3.378  -3.196   9.426
  655   3H    ARG 115          HN3       ARG 115   3.326  -1.485   9.506
  656    HA   ARG 115           HA       ARG 115   1.715  -2.589   7.989
  657   1HB   ARG 115          2HB       ARG 115  -0.274  -3.520   9.074
  658   2HB   ARG 115          1HB       ARG 115   1.166  -4.427   9.513
  659   1HG   ARG 115          2HG       ARG 115   0.788  -2.369  11.438
  660   2HG   ARG 115          1HG       ARG 115  -0.743  -3.215  11.211
  661   1HD   ARG 115          2HD       ARG 115   0.143  -4.618  12.747
  662   2HD   ARG 115          1HD       ARG 115   0.910  -5.320  11.323
  663    HE   ARG 115           HE       ARG 115   2.433  -3.219  12.574
  664   1HH1  ARG 115          1HH1      ARG 115   1.764  -6.645  12.518
  665   2HH1  ARG 115          2HH1      ARG 115   3.283  -7.079  13.225
  666   1HH2  ARG 115          1HH2      ARG 115   4.432  -3.790  13.504
  667   2HH2  ARG 115          2HH2      ARG 115   4.797  -5.460  13.785
  668    H    MET 116           H        MET 116   1.693  -0.686  10.919
  669    HA   MET 116           HA       MET 116  -0.447   1.023   9.910
  670   1HB   MET 116          2HB       MET 116  -0.497   0.402  12.280
  671   2HB   MET 116          1HB       MET 116   1.091   1.122  12.512
  672   1HG   MET 116          2HG       MET 116  -0.220   3.229  11.486
  673   2HG   MET 116          1HG       MET 116  -1.555   2.394  12.280
  674   1HE   MET 116          1HE       MET 116   1.644   4.067  12.322
  675   2HE   MET 116          2HE       MET 116   2.200   4.192  13.992
  676   3HE   MET 116          3HE       MET 116   0.998   5.326  13.375
  677    H    SER 117           H        SER 117   2.738   1.657  11.385
  678    HA   SER 117           HA       SER 117   2.954   4.147   9.936
  679   1HB   SER 117          2HB       SER 117   5.224   4.226  11.109
  680   2HB   SER 117          1HB       SER 117   3.798   4.240  12.146
  681    HG   SER 117           HG       SER 117   5.194   2.741  12.983
  682    H    ALA 118           H        ALA 118   2.751   2.565   7.950
  683    HA   ALA 118           HA       ALA 118   5.214   1.346   7.112
  684   1HB   ALA 118          1HB       ALA 118   2.978   1.981   5.232
  685   2HB   ALA 118          2HB       ALA 118   2.777   0.727   6.455
  686   3HB   ALA 118          3HB       ALA 118   4.063   0.592   5.256
  687    H    ASP 119           H        ASP 119   4.320   4.507   7.379
  688    HA   ASP 119           HA       ASP 119   4.874   5.832   5.071
  689   1HB   ASP 119          2HB       ASP 119   4.303   6.809   7.351
  690   2HB   ASP 119          1HB       ASP 119   6.021   6.705   7.721
  691    H    ALA 120           H        ALA 120   7.119   4.100   7.097
  692    HA   ALA 120           HA       ALA 120   9.535   5.186   6.214
  693   1HB   ALA 120          1HB       ALA 120   9.537   3.712   8.090
  694   2HB   ALA 120          2HB       ALA 120  10.510   2.957   6.828
  695   3HB   ALA 120          3HB       ALA 120   8.866   2.393   7.131
  696    H    MET 121           H        MET 121   8.173   2.070   5.102
  697    HA   MET 121           HA       MET 121   9.809   1.818   2.855
  698   1HB   MET 121          2HB       MET 121   8.507  -0.059   3.669
  699   2HB   MET 121          1HB       MET 121   7.004   0.785   3.324
  700   1HG   MET 121          2HG       MET 121   8.168   0.802   0.878
  701   2HG   MET 121          1HG       MET 121   8.788  -0.710   1.540
  702   1HE   MET 121          1HE       MET 121   4.956   0.707   2.357
  703   2HE   MET 121          2HE       MET 121   4.459   0.433   0.687
  704   3HE   MET 121          3HE       MET 121   5.814   1.505   1.038
  705    H    LEU 122           H        LEU 122   6.810   3.536   3.354
  706    HA   LEU 122           HA       LEU 122   6.221   4.119   0.659
  707   1HB   LEU 122          2HB       LEU 122   5.448   5.294   3.299
  708   2HB   LEU 122          1HB       LEU 122   5.040   6.156   1.829
  709    HG   LEU 122           HG       LEU 122   3.832   4.098   1.047
  710   1HD1  LEU 122          1HD1      LEU 122   3.877   3.155   3.882
  711   2HD1  LEU 122          2HD1      LEU 122   5.134   2.645   2.757
  712   3HD1  LEU 122          3HD1      LEU 122   3.443   2.277   2.418
  713   1HD2  LEU 122          1HD2      LEU 122   2.313   5.624   1.766
  714   2HD2  LEU 122          2HD2      LEU 122   3.063   5.789   3.353
  715   3HD2  LEU 122          3HD2      LEU 122   2.044   4.393   3.000
  716    H    ARG 123           H        ARG 123   8.129   5.784   3.130
  717    HA   ARG 123           HA       ARG 123   8.841   7.898   1.255
  718   1HB   ARG 123          2HB       ARG 123   8.331   8.431   3.626
  719   2HB   ARG 123          1HB       ARG 123   9.728   7.481   4.115
  720   1HG   ARG 123          2HG       ARG 123  11.224   9.047   3.389
  721   2HG   ARG 123          1HG       ARG 123  10.130   9.682   2.160
  722   1HD   ARG 123          2HD       ARG 123   9.539  11.314   3.542
  723   2HD   ARG 123          1HD       ARG 123   8.922  10.119   4.682
  724    HE   ARG 123           HE       ARG 123  11.665  10.233   5.050
  725   1HH1  ARG 123          1HH1      ARG 123   8.938  12.390   5.352
  726   2HH1  ARG 123          2HH1      ARG 123   9.661  13.330   6.613
  727   1HH2  ARG 123          1HH2      ARG 123  12.618  11.468   6.710
  728   2HH2  ARG 123          2HH2      ARG 123  11.751  12.807   7.385
  729    H    ALA 124           H        ALA 124   9.778   4.898   1.315
  730    HA   ALA 124           HA       ALA 124  12.621   5.095   1.619
  731   1HB   ALA 124          1HB       ALA 124  11.678   2.817   0.071
  732   2HB   ALA 124          2HB       ALA 124  10.807   3.024   1.590
  733   3HB   ALA 124          3HB       ALA 124  12.562   2.865   1.598
  734    H    LEU 125           H        LEU 125  10.831   3.977  -1.235
  735    HA   LEU 125           HA       LEU 125  12.927   4.843  -2.987
  736   1HB   LEU 125          2HB       LEU 125  10.176   3.853  -3.718
  737   2HB   LEU 125          1HB       LEU 125  11.595   3.890  -4.750
  738    HG   LEU 125           HG       LEU 125  11.672   2.296  -2.223
  739   1HD1  LEU 125          1HD1      LEU 125  10.898   0.342  -3.636
  740   2HD1  LEU 125          2HD1      LEU 125  10.266   1.540  -4.765
  741   3HD1  LEU 125          3HD1      LEU 125   9.658   1.480  -3.110
  742   1HD2  LEU 125          1HD2      LEU 125  13.484   1.315  -3.142
  743   2HD2  LEU 125          2HD2      LEU 125  13.541   2.810  -4.078
  744   3HD2  LEU 125          3HD2      LEU 125  12.817   1.360  -4.775
  745    H    LEU 126           H        LEU 126  10.052   6.259  -1.751
  746    HA   LEU 126           HA       LEU 126   9.034   8.262  -2.102
  747   1HB   LEU 126          2HB       LEU 126  11.554   8.963  -3.608
  748   2HB   LEU 126          1HB       LEU 126  10.378  10.093  -2.964
  749    HG   LEU 126           HG       LEU 126  11.896   8.218  -1.172
  750   1HD1  LEU 126          1HD1      LEU 126  13.738   9.298  -1.915
  751   2HD1  LEU 126          2HD1      LEU 126  13.175  10.536  -0.792
  752   3HD1  LEU 126          3HD1      LEU 126  12.821  10.681  -2.515
  753   1HD2  LEU 126          1HD2      LEU 126  10.332  10.755  -0.791
  754   2HD2  LEU 126          2HD2      LEU 126  11.430  10.122   0.434
  755   3HD2  LEU 126          3HD2      LEU 126  10.038   9.169  -0.078
  756    H    GLY 127           H        GLY 127   7.968   9.592  -3.720
  757   1HA   GLY 127          2HA       GLY 127   7.821   8.214  -6.332
  758   2HA   GLY 127          1HA       GLY 127   6.431   8.930  -5.529
  759    H    SER 128           H        SER 128   8.133   9.359  -8.130
  760    HA   SER 128           HA       SER 128   8.141  12.298  -7.916
  761   1HB   SER 128          2HB       SER 128  10.385  10.813  -8.309
  762   2HB   SER 128          1HB       SER 128   9.884  11.094  -9.976
  763    HG   SER 128           HG       SER 128   9.705  13.384  -9.270
  764    H    LYS 129           H        LYS 129   5.988  10.513  -8.748
  765    HA   LYS 129           HA       LYS 129   5.501  11.700 -11.370
  766   1HB   LYS 129          2HB       LYS 129   5.404   8.750 -10.769
  767   2HB   LYS 129          1HB       LYS 129   4.525   9.460 -12.116
  768   1HG   LYS 129          2HG       LYS 129   6.419   9.885 -13.312
  769   2HG   LYS 129          1HG       LYS 129   7.424  10.049 -11.872
  770   1HD   LYS 129          2HD       LYS 129   6.482   7.395 -11.889
  771   2HD   LYS 129          1HD       LYS 129   7.000   7.752 -13.538
  772   1HE   LYS 129          2HE       LYS 129   8.766   6.809 -11.991
  773   2HE   LYS 129          1HE       LYS 129   9.186   8.297 -12.839
  774   1HZ   LYS 129          1HZ       LYS 129   9.511   7.960 -10.227
  775   2HZ   LYS 129          2HZ       LYS 129   7.956   8.625 -10.228
  776   3HZ   LYS 129          3HZ       LYS 129   9.237   9.472 -10.936
  777    H    HIS 130           H        HIS 130   3.514  12.525 -11.501
  778    HA   HIS 130           HA       HIS 130   1.294  11.327 -10.079
  779   1HB   HIS 130          2HB       HIS 130   2.670  13.188  -8.678
  780   2HB   HIS 130          1HB       HIS 130   1.536  14.226  -9.536
  781    HD1  HIS 130           1HD      HIS 130  -0.896  14.177  -8.793
  782    HD2  HIS 130           2HD      HIS 130   1.474  11.376  -6.844
  783    HE1  HIS 130           1HE      HIS 130  -2.311  13.291  -6.913
  784    HE2  HIS 130           2HE      HIS 130  -0.821  11.671  -5.688
  785    H    LYS 131           H        LYS 131  -0.746  12.733 -10.458
  786    HA   LYS 131           HA       LYS 131  -0.629  14.032 -13.088
  787   1HB   LYS 131          2HB       LYS 131  -2.043  11.565 -12.368
  788   2HB   LYS 131          1HB       LYS 131  -3.069  12.763 -13.146
  789   1HG   LYS 131          2HG       LYS 131  -0.541  12.488 -14.518
  790   2HG   LYS 131          1HG       LYS 131  -1.382  10.942 -14.385
  791   1HD   LYS 131          2HD       LYS 131  -3.428  12.558 -15.104
  792   2HD   LYS 131          1HD       LYS 131  -2.083  13.361 -15.918
  793   1HE   LYS 131          2HE       LYS 131  -1.469  11.007 -16.761
  794   2HE   LYS 131          1HE       LYS 131  -3.107  10.565 -16.279
  795   1HZ   LYS 131          1HZ       LYS 131  -3.860  12.481 -17.700
  796   2HZ   LYS 131          2HZ       LYS 131  -3.220  11.157 -18.536
  797   3HZ   LYS 131          3HZ       LYS 131  -2.286  12.550 -18.317
  Start of MODEL   11
    1   2H    ALA   1          HN2       ALA   1 -24.248  -0.509  -9.455
    2    H    ALA   1           H        ALA   1 -24.351   0.879  -8.452
    3   3H    ALA   1          HN3       ALA   1 -25.292   0.785  -9.882
    4    HA   ALA   1           HA       ALA   1 -23.336   0.796 -11.211
    5   1HB   ALA   1          1HB       ALA   1 -23.182   3.046 -11.190
    6   2HB   ALA   1          2HB       ALA   1 -22.854   3.116  -9.458
    7   3HB   ALA   1          3HB       ALA   1 -24.508   2.910 -10.036
    8    H    SER   2           H        SER   2 -22.322   1.888  -7.973
    9    HA   SER   2           HA       SER   2 -19.673   0.760  -8.483
   10   1HB   SER   2          2HB       SER   2 -20.601   2.574  -6.243
   11   2HB   SER   2          1HB       SER   2 -18.934   2.105  -6.575
   12    HG   SER   2           HG       SER   2 -18.953   3.854  -7.748
   13    H    MET   3           H        MET   3 -18.572  -0.102  -6.403
   14    HA   MET   3           HA       MET   3 -20.444  -1.754  -4.857
   15   1HB   MET   3          2HB       MET   3 -19.565  -3.138  -6.686
   16   2HB   MET   3          1HB       MET   3 -17.922  -2.761  -6.189
   17   1HG   MET   3          2HG       MET   3 -19.747  -3.976  -4.189
   18   2HG   MET   3          1HG       MET   3 -19.114  -4.998  -5.478
   19   1HE   MET   3          1HE       MET   3 -16.731  -5.126  -6.119
   20   2HE   MET   3          2HE       MET   3 -15.388  -5.102  -4.977
   21   3HE   MET   3          3HE       MET   3 -15.925  -3.605  -5.737
   22    H    THR   4           H        THR   4 -17.087  -0.647  -5.194
   23    HA   THR   4           HA       THR   4 -17.002  -0.183  -2.312
   24    HB   THR   4           HB       THR   4 -16.048  -2.423  -2.614
   25    HG1  THR   4           1HG      THR   4 -13.986  -0.547  -2.120
   26   1HG2  THR   4          1HG2      THR   4 -13.663  -1.434  -4.027
   27   2HG2  THR   4          2HG2      THR   4 -15.115  -1.660  -5.001
   28   3HG2  THR   4          3HG2      THR   4 -14.451  -3.011  -4.081
   29    H    ASP   5           H        ASP   5 -16.651   1.942  -2.261
   30    HA   ASP   5           HA       ASP   5 -14.748   3.119  -4.159
   31   1HB   ASP   5          2HB       ASP   5 -16.928   4.336  -2.463
   32   2HB   ASP   5          1HB       ASP   5 -15.735   5.306  -3.333
   33    H    GLN   6           H        GLN   6 -14.617   1.831  -1.170
   34    HA   GLN   6           HA       GLN   6 -13.448   3.706   0.496
   35   1HB   GLN   6          2HB       GLN   6 -12.455   1.841   1.690
   36   2HB   GLN   6          1HB       GLN   6 -14.090   1.427   1.193
   37   1HG   GLN   6          2HG       GLN   6 -13.398  -0.166  -0.265
   38   2HG   GLN   6          1HG       GLN   6 -11.879   0.656  -0.620
   39   1HE2  GLN   6          1HE2      GLN   6 -10.998  -1.519  -0.395
   40   2HE2  GLN   6          2HE2      GLN   6 -10.584  -2.093   1.180
   41    H    GLN   7           H        GLN   7 -12.164   2.202  -2.336
   42    HA   GLN   7           HA       GLN   7  -9.404   2.573  -1.796
   43   1HB   GLN   7          2HB       GLN   7 -10.624   2.565  -4.545
   44   2HB   GLN   7          1HB       GLN   7  -9.027   2.015  -4.060
   45   1HG   GLN   7          2HG       GLN   7  -9.764  -0.038  -3.713
   46   2HG   GLN   7          1HG       GLN   7 -11.046   0.540  -2.652
   47   1HE2  GLN   7          1HE2      GLN   7 -10.985  -1.584  -4.717
   48   2HE2  GLN   7          2HE2      GLN   7 -12.287  -1.211  -5.789
   49    H    ALA   8           H        ALA   8 -11.926   4.698  -2.766
   50    HA   ALA   8           HA       ALA   8 -10.107   6.696  -3.826
   51   1HB   ALA   8          1HB       ALA   8 -11.987   6.924  -5.060
   52   2HB   ALA   8          2HB       ALA   8 -12.472   7.979  -3.733
   53   3HB   ALA   8          3HB       ALA   8 -13.032   6.306  -3.779
   54    H    GLU   9           H        GLU   9 -12.369   6.358  -1.094
   55    HA   GLU   9           HA       GLU   9 -11.943   8.806   0.136
   56   1HB   GLU   9          2HB       GLU   9 -12.259   6.220   1.660
   57   2HB   GLU   9          1HB       GLU   9 -12.787   7.828   2.139
   58   1HG   GLU   9          2HG       GLU   9 -14.215   7.609  -0.084
   59   2HG   GLU   9          1HG       GLU   9 -14.037   5.888   0.282
   60    H    ALA  10           H        ALA  10 -10.033   5.881   0.168
   61    HA   ALA  10           HA       ALA  10  -8.253   6.221   2.196
   62   1HB   ALA  10          1HB       ALA  10  -7.166   4.541   1.196
   63   2HB   ALA  10          2HB       ALA  10  -6.949   5.453  -0.296
   64   3HB   ALA  10          3HB       ALA  10  -8.462   4.595  -0.001
   65    H    ARG  11           H        ARG  11  -7.681   7.383  -1.128
   66    HA   ARG  11           HA       ARG  11  -5.382   8.834  -0.665
   67   1HB   ARG  11          2HB       ARG  11  -7.194   8.491  -2.793
   68   2HB   ARG  11          1HB       ARG  11  -7.058  10.229  -2.558
   69   1HG   ARG  11          2HG       ARG  11  -4.698  10.166  -2.879
   70   2HG   ARG  11          1HG       ARG  11  -4.687   8.402  -2.857
   71   1HD   ARG  11          2HD       ARG  11  -4.504   9.267  -5.134
   72   2HD   ARG  11          1HD       ARG  11  -5.998   8.357  -4.910
   73    HE   ARG  11           HE       ARG  11  -6.296  11.187  -4.501
   74   1HH1  ARG  11          1HH1      ARG  11  -6.291   8.626  -6.872
   75   2HH1  ARG  11          2HH1      ARG  11  -7.270   9.499  -8.001
   76   1HH2  ARG  11          1HH2      ARG  11  -7.584  12.337  -5.986
   77   2HH2  ARG  11          2HH2      ARG  11  -8.005  11.606  -7.499
   78    H    ALA  12           H        ALA  12  -8.665   9.626   0.134
   79    HA   ALA  12           HA       ALA  12  -8.000  12.395   0.746
   80   1HB   ALA  12          1HB       ALA  12 -10.353  12.699   1.169
   81   2HB   ALA  12          2HB       ALA  12 -10.629  10.958   1.093
   82   3HB   ALA  12          3HB       ALA  12 -10.145  11.839  -0.357
   83    H    PHE  13           H        PHE  13  -8.272   9.342   2.327
   84    HA   PHE  13           HA       PHE  13  -8.778  10.378   4.952
   85   1HB   PHE  13          2HB       PHE  13  -8.718   7.827   3.728
   86   2HB   PHE  13          1HB       PHE  13  -7.521   7.794   5.025
   87    HD1  PHE  13           1HD      PHE  13  -8.559   9.250   7.177
   88    HD2  PHE  13           2HD      PHE  13 -10.697   6.881   4.362
   89    HE1  PHE  13           1HE      PHE  13 -10.356   8.921   8.825
   90    HE2  PHE  13           2HE      PHE  13 -12.499   6.549   6.004
   91    HZ   PHE  13           HZ       PHE  13 -12.330   7.569   8.239
   92    H    LEU  14           H        LEU  14  -5.975   9.874   2.990
   93    HA   LEU  14           HA       LEU  14  -4.230  10.380   5.304
   94   1HB   LEU  14          2HB       LEU  14  -3.316   9.439   2.597
   95   2HB   LEU  14          1HB       LEU  14  -2.453   9.358   4.129
   96    HG   LEU  14           HG       LEU  14  -4.954   7.776   3.540
   97   1HD1  LEU  14          1HD1      LEU  14  -2.127   6.752   3.497
   98   2HD1  LEU  14          2HD1      LEU  14  -3.005   7.229   2.043
   99   3HD1  LEU  14          3HD1      LEU  14  -3.602   5.900   3.037
  100   1HD2  LEU  14          1HD2      LEU  14  -4.228   6.462   5.478
  101   2HD2  LEU  14          2HD2      LEU  14  -4.526   8.148   5.903
  102   3HD2  LEU  14          3HD2      LEU  14  -2.871   7.564   5.711
  103    H    SER  15           H        SER  15  -2.396  11.813   4.971
  104    HA   SER  15           HA       SER  15  -3.193  14.216   3.600
  105   1HB   SER  15          2HB       SER  15  -1.748  13.774   5.856
  106   2HB   SER  15          1HB       SER  15  -0.441  14.034   4.691
  107    HG   SER  15           HG       SER  15  -1.392  16.026   4.167
  108    H    GLU  16           H        GLU  16  -1.738  15.373   2.111
  109    HA   GLU  16           HA       GLU  16  -1.100  13.940  -0.158
  110   1HB   GLU  16          2HB       GLU  16  -1.075  16.582   0.508
  111   2HB   GLU  16          1HB       GLU  16   0.647  16.264   0.350
  112   1HG   GLU  16          2HG       GLU  16   0.191  15.317  -1.909
  113   2HG   GLU  16          1HG       GLU  16  -1.480  15.855  -1.737
  114    H    GLU  17           H        GLU  17   0.724  14.391   2.747
  115    HA   GLU  17           HA       GLU  17   3.294  13.714   1.845
  116   1HB   GLU  17          2HB       GLU  17   1.881  13.835   4.447
  117   2HB   GLU  17          1HB       GLU  17   3.318  12.818   4.394
  118   1HG   GLU  17          2HG       GLU  17   4.301  14.764   4.982
  119   2HG   GLU  17          1HG       GLU  17   4.334  14.975   3.232
  120    H    MET  18           H        MET  18   0.864  11.683   3.487
  121    HA   MET  18           HA       MET  18   2.229   9.263   3.255
  122   1HB   MET  18          2HB       MET  18  -0.001   9.977   4.517
  123   2HB   MET  18          1HB       MET  18  -0.746   9.254   3.092
  124   1HG   MET  18          2HG       MET  18  -0.662   7.510   4.611
  125   2HG   MET  18          1HG       MET  18   0.744   7.229   3.586
  126   1HE   MET  18          1HE       MET  18  -0.332   7.014   7.198
  127   2HE   MET  18          2HE       MET  18   1.251   6.346   7.598
  128   3HE   MET  18          3HE       MET  18   0.379   5.762   6.181
  129    H    ILE  19           H        ILE  19   0.553  11.093   0.866
  130    HA   ILE  19           HA       ILE  19   0.087   8.874  -0.918
  131    HB   ILE  19           HB       ILE  19  -0.180  11.857  -1.232
  132   1HG1  ILE  19          2HG1      ILE  19  -2.167   9.574  -1.313
  133   2HG1  ILE  19          1HG1      ILE  19  -1.942  10.708   0.021
  134   1HG2  ILE  19          1HG2      ILE  19  -0.498   9.737  -3.351
  135   2HG2  ILE  19          2HG2      ILE  19   0.597  11.123  -3.369
  136   3HG2  ILE  19          3HG2      ILE  19  -1.147  11.372  -3.490
  137   1HD1  ILE  19          1HD1      ILE  19  -2.841  11.471  -2.748
  138   2HD1  ILE  19          2HD1      ILE  19  -2.740  12.524  -1.337
  139   3HD1  ILE  19          3HD1      ILE  19  -3.910  11.206  -1.370
  140    H    ALA  20           H        ALA  20   2.062  11.829  -1.223
  141    HA   ALA  20           HA       ALA  20   3.548  11.174  -3.417
  142   1HB   ALA  20          1HB       ALA  20   4.483  12.645  -0.959
  143   2HB   ALA  20          2HB       ALA  20   3.669  13.342  -2.360
  144   3HB   ALA  20          3HB       ALA  20   5.291  12.667  -2.527
  145    H    GLU  21           H        GLU  21   3.823   9.882  -0.205
  146    HA   GLU  21           HA       GLU  21   6.349   8.565  -0.752
  147   1HB   GLU  21          2HB       GLU  21   4.538   8.255   1.648
  148   2HB   GLU  21          1HB       GLU  21   6.222   7.772   1.525
  149   1HG   GLU  21          2HG       GLU  21   6.990   9.965   1.599
  150   2HG   GLU  21          1HG       GLU  21   5.412  10.629   1.183
  151    H    PHE  22           H        PHE  22   2.929   7.849  -0.567
  152    HA   PHE  22           HA       PHE  22   3.044   5.046  -0.568
  153   1HB   PHE  22          2HB       PHE  22   0.840   5.416  -0.360
  154   2HB   PHE  22          1HB       PHE  22   1.041   7.088  -0.858
  155    HD1  PHE  22           1HD      PHE  22   1.175   7.503  -3.426
  156    HD2  PHE  22           2HD      PHE  22  -0.408   3.977  -1.654
  157    HE1  PHE  22           1HE      PHE  22  -0.072   7.032  -5.492
  158    HE2  PHE  22           2HE      PHE  22  -1.656   3.495  -3.719
  159    HZ   PHE  22           HZ       PHE  22  -1.489   5.024  -5.641
  160    H    LYS  23           H        LYS  23   3.278   7.423  -3.118
  161    HA   LYS  23           HA       LYS  23   3.120   5.609  -5.300
  162   1HB   LYS  23          2HB       LYS  23   3.553   8.457  -4.882
  163   2HB   LYS  23          1HB       LYS  23   4.560   7.818  -6.186
  164   1HG   LYS  23          2HG       LYS  23   1.881   6.807  -6.378
  165   2HG   LYS  23          1HG       LYS  23   1.880   8.569  -6.306
  166   1HD   LYS  23          2HD       LYS  23   3.908   8.134  -8.050
  167   2HD   LYS  23          1HD       LYS  23   2.859   6.756  -8.411
  168   1HE   LYS  23          2HE       LYS  23   1.353   9.218  -8.130
  169   2HE   LYS  23          1HE       LYS  23   2.599   9.353  -9.370
  170   1HZ   LYS  23          1HZ       LYS  23   1.572   6.976  -9.967
  171   2HZ   LYS  23          2HZ       LYS  23   1.011   8.423 -10.638
  172   3HZ   LYS  23          3HZ       LYS  23   0.195   7.726  -9.330
  173    H    ALA  24           H        ALA  24   5.577   6.501  -3.112
  174    HA   ALA  24           HA       ALA  24   7.966   6.318  -4.332
  175   1HB   ALA  24          1HB       ALA  24   7.225   4.915  -1.767
  176   2HB   ALA  24          2HB       ALA  24   7.739   6.593  -1.935
  177   3HB   ALA  24          3HB       ALA  24   8.867   5.285  -2.294
  178    H    ALA  25           H        ALA  25   6.811   3.329  -2.798
  179    HA   ALA  25           HA       ALA  25   8.368   1.729  -4.592
  180   1HB   ALA  25          1HB       ALA  25   6.366   0.876  -2.508
  181   2HB   ALA  25          2HB       ALA  25   8.090   1.135  -2.236
  182   3HB   ALA  25          3HB       ALA  25   7.550  -0.161  -3.305
  183    H    PHE  26           H        PHE  26   5.458   3.195  -5.080
  184    HA   PHE  26           HA       PHE  26   3.740   1.283  -6.087
  185   1HB   PHE  26          2HB       PHE  26   3.457   3.849  -5.838
  186   2HB   PHE  26          1HB       PHE  26   4.085   3.918  -7.481
  187    HD1  PHE  26           1HD      PHE  26   1.224   3.275  -5.412
  188    HD2  PHE  26           2HD      PHE  26   2.856   2.704  -9.301
  189    HE1  PHE  26           1HE      PHE  26  -1.029   2.813  -6.285
  190    HE2  PHE  26           2HE      PHE  26   0.605   2.242 -10.181
  191    HZ   PHE  26           HZ       PHE  26  -1.341   2.296  -8.672
  192    H    ASP  27           H        ASP  27   6.718   2.442  -7.433
  193    HA   ASP  27           HA       ASP  27   6.171   1.418 -10.082
  194   1HB   ASP  27          2HB       ASP  27   7.579   3.431  -9.740
  195   2HB   ASP  27          1HB       ASP  27   8.769   2.434  -8.909
  196    H    MET  28           H        MET  28   8.739   0.713  -7.699
  197    HA   MET  28           HA       MET  28   9.610  -1.658  -8.867
  198   1HB   MET  28          2HB       MET  28   9.863  -0.394  -6.201
  199   2HB   MET  28          1HB       MET  28  10.180  -2.122  -6.271
  200   1HG   MET  28          2HG       MET  28  11.917  -1.813  -7.877
  201   2HG   MET  28          1HG       MET  28  11.512  -0.102  -8.058
  202   1HE   MET  28          1HE       MET  28  14.395   0.167  -7.582
  203   2HE   MET  28          2HE       MET  28  14.371   1.185  -6.141
  204   3HE   MET  28          3HE       MET  28  13.144   1.395  -7.389
  205    H    PHE  29           H        PHE  29   6.828  -1.027  -6.901
  206    HA   PHE  29           HA       PHE  29   6.277  -3.531  -5.837
  207   1HB   PHE  29          2HB       PHE  29   4.703  -1.130  -6.541
  208   2HB   PHE  29          1HB       PHE  29   3.781  -2.631  -6.432
  209    HD1  PHE  29           1HD      PHE  29   4.296   0.115  -4.658
  210    HD2  PHE  29           2HD      PHE  29   4.982  -4.063  -4.256
  211    HE1  PHE  29           1HE      PHE  29   4.224   0.345  -2.211
  212    HE2  PHE  29           2HE      PHE  29   4.912  -3.839  -1.808
  213    HZ   PHE  29           HZ       PHE  29   4.532  -1.635  -0.783
  214    H    ASP  30           H        ASP  30   4.758  -2.210  -8.779
  215    HA   ASP  30           HA       ASP  30   3.710  -4.636  -9.675
  216   1HB   ASP  30          2HB       ASP  30   4.317  -2.017 -11.008
  217   2HB   ASP  30          1HB       ASP  30   3.776  -3.395 -11.971
  218    H    ALA  31           H        ALA  31   4.674  -6.374 -10.412
  219    HA   ALA  31           HA       ALA  31   7.457  -6.272 -11.252
  220   1HB   ALA  31          1HB       ALA  31   7.382  -8.695 -11.159
  221   2HB   ALA  31          2HB       ALA  31   5.635  -8.652 -10.922
  222   3HB   ALA  31          3HB       ALA  31   6.710  -8.011  -9.680
  223    H    ASP  32           H        ASP  32   4.361  -7.456 -12.547
  224    HA   ASP  32           HA       ASP  32   5.526  -7.772 -15.189
  225   1HB   ASP  32          2HB       ASP  32   3.271  -8.621 -15.806
  226   2HB   ASP  32          1HB       ASP  32   3.984  -9.488 -14.443
  227    H    GLY  33           H        GLY  33   3.522  -5.538 -13.431
  228   1HA   GLY  33          2HA       GLY  33   3.084  -3.323 -14.013
  229   2HA   GLY  33          1HA       GLY  33   3.702  -3.649 -15.625
  230    H    GLY  34           H        GLY  34   1.192  -5.496 -13.976
  231   1HA   GLY  34          2HA       GLY  34  -1.071  -4.230 -14.970
  232   2HA   GLY  34          1HA       GLY  34  -0.548  -5.361 -16.217
  233    H    GLY  35           H        GLY  35  -0.331  -5.773 -12.706
  234   1HA   GLY  35          2HA       GLY  35  -2.560  -7.644 -12.721
  235   2HA   GLY  35          1HA       GLY  35  -0.974  -8.347 -12.422
  236    H    ASP  36           H        ASP  36  -1.641  -5.130 -11.314
  237    HA   ASP  36           HA       ASP  36  -1.729  -4.222  -9.232
  238   1HB   ASP  36          2HB       ASP  36  -3.351  -6.731  -8.826
  239   2HB   ASP  36          1HB       ASP  36  -3.127  -5.541  -7.538
  240    H    ILE  37           H        ILE  37  -1.425  -4.934  -6.735
  241    HA   ILE  37           HA       ILE  37   1.196  -6.227  -6.696
  242    HB   ILE  37           HB       ILE  37  -0.219  -4.458  -4.707
  243   1HG1  ILE  37          2HG1      ILE  37   2.362  -4.102  -6.247
  244   2HG1  ILE  37          1HG1      ILE  37   0.811  -3.381  -6.688
  245   1HG2  ILE  37          1HG2      ILE  37   2.066  -6.280  -4.327
  246   2HG2  ILE  37          2HG2      ILE  37   0.915  -5.637  -3.156
  247   3HG2  ILE  37          3HG2      ILE  37   2.267  -4.644  -3.699
  248   1HD1  ILE  37          1HD1      ILE  37   2.243  -1.784  -5.556
  249   2HD1  ILE  37          2HD1      ILE  37   2.348  -2.852  -4.157
  250   3HD1  ILE  37          3HD1      ILE  37   0.803  -2.128  -4.601
  251    H    SER  38           H        SER  38   1.331  -8.286  -6.140
  252    HA   SER  38           HA       SER  38  -0.839  -9.553  -4.665
  253   1HB   SER  38          2HB       SER  38  -0.004 -11.614  -5.429
  254   2HB   SER  38          1HB       SER  38   0.309 -10.515  -6.779
  255    HG   SER  38           HG       SER  38   2.280 -11.222  -6.571
  256    H    THR  39           H        THR  39   0.572 -11.624  -3.426
  257    HA   THR  39           HA       THR  39   1.306 -10.395  -0.988
  258    HB   THR  39           HB       THR  39   2.261 -12.869  -0.637
  259    HG1  THR  39           1HG      THR  39   1.028 -14.289  -1.956
  260   1HG2  THR  39          1HG2      THR  39   0.389 -12.092   0.620
  261   2HG2  THR  39          2HG2      THR  39  -0.031 -13.645  -0.102
  262   3HG2  THR  39          3HG2      THR  39  -0.653 -12.151  -0.802
  263    H    LYS  40           H        LYS  40   3.278 -12.237  -3.323
  264    HA   LYS  40           HA       LYS  40   5.744 -11.750  -2.084
  265   1HB   LYS  40          2HB       LYS  40   4.866 -12.653  -4.780
  266   2HB   LYS  40          1HB       LYS  40   6.535 -12.109  -4.607
  267   1HG   LYS  40          2HG       LYS  40   6.379 -13.753  -2.492
  268   2HG   LYS  40          1HG       LYS  40   5.205 -14.527  -3.566
  269   1HD   LYS  40          2HD       LYS  40   7.915 -13.729  -4.571
  270   2HD   LYS  40          1HD       LYS  40   7.687 -15.246  -3.699
  271   1HE   LYS  40          2HE       LYS  40   6.224 -14.404  -6.200
  272   2HE   LYS  40          1HE       LYS  40   7.543 -15.569  -6.120
  273   1HZ   LYS  40          1HZ       LYS  40   4.808 -15.836  -5.024
  274   2HZ   LYS  40          2HZ       LYS  40   6.073 -16.845  -4.534
  275   3HZ   LYS  40          3HZ       LYS  40   5.585 -16.828  -6.153
  276    H    GLU  41           H        GLU  41   3.933  -9.903  -4.467
  277    HA   GLU  41           HA       GLU  41   5.904  -8.123  -5.294
  278   1HB   GLU  41          2HB       GLU  41   2.922  -7.920  -5.051
  279   2HB   GLU  41          1HB       GLU  41   3.863  -6.516  -5.539
  280   1HG   GLU  41          2HG       GLU  41   4.885  -8.226  -7.262
  281   2HG   GLU  41          1HG       GLU  41   3.359  -9.063  -6.981
  282    H    LEU  42           H        LEU  42   4.241  -8.334  -2.269
  283    HA   LEU  42           HA       LEU  42   4.870  -5.635  -1.474
  284   1HB   LEU  42          2HB       LEU  42   3.081  -7.622  -0.613
  285   2HB   LEU  42          1HB       LEU  42   4.183  -7.353   0.733
  286    HG   LEU  42           HG       LEU  42   2.266  -5.927   1.000
  287   1HD1  LEU  42          1HD1      LEU  42   4.333  -4.956   1.730
  288   2HD1  LEU  42          2HD1      LEU  42   3.359  -3.695   0.974
  289   3HD1  LEU  42          3HD1      LEU  42   4.710  -4.413   0.094
  290   1HD2  LEU  42          1HD2      LEU  42   1.435  -5.815  -1.238
  291   2HD2  LEU  42          2HD2      LEU  42   2.888  -4.983  -1.792
  292   3HD2  LEU  42          3HD2      LEU  42   1.769  -4.169  -0.699
  293    H    GLY  43           H        GLY  43   5.839  -8.862  -0.283
  294   1HA   GLY  43          2HA       GLY  43   7.755  -8.107   1.540
  295   2HA   GLY  43          1HA       GLY  43   7.841  -9.589   0.590
  296    H    THR  44           H        THR  44   7.973  -7.992  -1.931
  297    HA   THR  44           HA       THR  44  10.724  -7.977  -2.304
  298    HB   THR  44           HB       THR  44   8.396  -6.827  -3.781
  299    HG1  THR  44           1HG      THR  44  10.427  -8.717  -4.299
  300   1HG2  THR  44          1HG2      THR  44  11.225  -6.027  -4.254
  301   2HG2  THR  44          2HG2      THR  44   9.744  -5.080  -4.398
  302   3HG2  THR  44          3HG2      THR  44  10.147  -6.280  -5.628
  303    H    VAL  45           H        VAL  45   8.868  -4.985  -2.610
  304    HA   VAL  45           HA       VAL  45  11.036  -3.304  -2.035
  305    HB   VAL  45           HB       VAL  45   9.101  -2.551  -3.303
  306   1HG1  VAL  45          1HG1      VAL  45   7.672  -3.179  -0.765
  307   2HG1  VAL  45          2HG1      VAL  45   7.221  -3.530  -2.434
  308   3HG1  VAL  45          3HG1      VAL  45   7.061  -1.890  -1.803
  309   1HG2  VAL  45          1HG2      VAL  45  10.437  -1.097  -1.332
  310   2HG2  VAL  45          2HG2      VAL  45   8.739  -0.658  -1.156
  311   3HG2  VAL  45          3HG2      VAL  45   9.544  -0.454  -2.711
  312    H    MET  46           H        MET  46   8.753  -4.893   0.051
  313    HA   MET  46           HA       MET  46   9.170  -3.187   2.308
  314   1HB   MET  46          2HB       MET  46   7.756  -5.750   1.789
  315   2HB   MET  46          1HB       MET  46   8.198  -5.393   3.458
  316   1HG   MET  46          2HG       MET  46   6.565  -3.606   1.664
  317   2HG   MET  46          1HG       MET  46   5.919  -4.680   2.910
  318   1HE   MET  46          1HE       MET  46   5.332  -3.079   5.541
  319   2HE   MET  46          2HE       MET  46   4.648  -3.240   3.924
  320   3HE   MET  46          3HE       MET  46   5.011  -1.640   4.572
  321    H    ARG  47           H        ARG  47  10.696  -6.080   1.068
  322    HA   ARG  47           HA       ARG  47  12.217  -6.492   3.506
  323   1HB   ARG  47          2HB       ARG  47  12.161  -7.925   0.853
  324   2HB   ARG  47          1HB       ARG  47  13.295  -8.334   2.132
  325   1HG   ARG  47          2HG       ARG  47  11.592  -9.072   3.563
  326   2HG   ARG  47          1HG       ARG  47  10.333  -8.299   2.598
  327   1HD   ARG  47          2HD       ARG  47  10.032 -10.275   1.617
  328   2HD   ARG  47          1HD       ARG  47  11.586 -10.012   0.816
  329    HE   ARG  47           HE       ARG  47  11.028 -11.815   3.006
  330   1HH1  ARG  47          1HH1      ARG  47  13.491 -10.099   1.224
  331   2HH1  ARG  47          2HH1      ARG  47  14.762 -11.174   1.702
  332   1HH2  ARG  47          1HH2      ARG  47  12.697 -13.228   3.635
  333   2HH2  ARG  47          2HH2      ARG  47  14.311 -12.950   3.070
  334    H    MET  48           H        MET  48  12.658  -5.048   0.361
  335    HA   MET  48           HA       MET  48  15.535  -4.820   0.747
  336   1HB   MET  48          2HB       MET  48  15.574  -3.847  -1.490
  337   2HB   MET  48          1HB       MET  48  14.692  -5.375  -1.485
  338   1HG   MET  48          2HG       MET  48  12.841  -4.410  -2.227
  339   2HG   MET  48          1HG       MET  48  12.932  -3.131  -1.018
  340   1HE   MET  48          1HE       MET  48  12.902  -0.367  -3.386
  341   2HE   MET  48          2HE       MET  48  12.317  -1.179  -1.934
  342   3HE   MET  48          3HE       MET  48  11.749  -1.696  -3.522
  343    H    LEU  49           H        LEU  49  13.162  -3.263   2.157
  344    HA   LEU  49           HA       LEU  49  14.440  -0.621   1.890
  345   1HB   LEU  49          2HB       LEU  49  11.565  -1.382   2.270
  346   2HB   LEU  49          1HB       LEU  49  12.147   0.188   2.795
  347    HG   LEU  49           HG       LEU  49  12.143  -0.894  -0.020
  348   1HD1  LEU  49          1HD1      LEU  49  10.531   1.119   1.478
  349   2HD1  LEU  49          2HD1      LEU  49  10.008  -0.127   0.349
  350   3HD1  LEU  49          3HD1      LEU  49  10.798   1.327  -0.252
  351   1HD2  LEU  49          1HD2      LEU  49  12.906   1.562  -0.453
  352   2HD2  LEU  49          2HD2      LEU  49  14.094   0.328  -0.035
  353   3HD2  LEU  49          3HD2      LEU  49  13.524   1.456   1.195
  354    H    GLY  50           H        GLY  50  12.911  -2.923   4.095
  355   1HA   GLY  50          2HA       GLY  50  14.631  -2.717   6.188
  356   2HA   GLY  50          1HA       GLY  50  13.543  -1.351   6.432
  357    H    GLN  51           H        GLN  51  11.205  -2.694   5.377
  358    HA   GLN  51           HA       GLN  51  10.309  -3.938   7.763
  359   1HB   GLN  51          2HB       GLN  51   9.075  -2.758   5.640
  360   2HB   GLN  51          1HB       GLN  51   8.760  -4.461   5.307
  361   1HG   GLN  51          2HG       GLN  51   6.942  -3.984   6.572
  362   2HG   GLN  51          1HG       GLN  51   8.058  -4.463   7.851
  363   1HE2  GLN  51          1HE2      GLN  51   5.723  -2.433   7.392
  364   2HE2  GLN  51          2HE2      GLN  51   6.298  -1.022   8.207
  365    H    ASN  52           H        ASN  52   9.405  -6.123   7.920
  366    HA   ASN  52           HA       ASN  52  10.546  -8.080   6.080
  367   1HB   ASN  52          2HB       ASN  52  11.947  -7.512   8.315
  368   2HB   ASN  52          1HB       ASN  52  10.866  -8.759   8.944
  369   1HD2  ASN  52          1HD2      ASN  52  13.747  -8.827   8.546
  370   2HD2  ASN  52          2HD2      ASN  52  14.058 -10.158   7.490
  371    HA   PRO  53           HA       PRO  53   6.293  -9.067   7.923
  372   1HB   PRO  53          2HB       PRO  53   4.741  -8.525   5.785
  373   2HB   PRO  53          1HB       PRO  53   5.178  -7.285   6.966
  374   1HG   PRO  53          2HG       PRO  53   6.376  -7.846   4.278
  375   2HG   PRO  53          1HG       PRO  53   5.948  -6.287   5.007
  376   1HD   PRO  53          2HD       PRO  53   8.489  -7.257   4.971
  377   2HD   PRO  53          1HD       PRO  53   7.873  -6.203   6.264
  378    H    THR  54           H        THR  54   6.565 -11.242   7.941
  379    HA   THR  54           HA       THR  54   7.373 -12.850   5.813
  380    HB   THR  54           HB       THR  54   5.509 -14.026   7.804
  381    HG1  THR  54           1HG      THR  54   7.029 -13.812   9.450
  382   1HG2  THR  54          1HG2      THR  54   8.054 -15.183   7.932
  383   2HG2  THR  54          2HG2      THR  54   7.719 -14.901   6.224
  384   3HG2  THR  54          3HG2      THR  54   6.595 -15.847   7.200
  385    H    LYS  55           H        LYS  55   5.807 -14.820   5.186
  386    HA   LYS  55           HA       LYS  55   4.018 -13.836   3.299
  387   1HB   LYS  55          2HB       LYS  55   5.042 -16.109   3.282
  388   2HB   LYS  55          1HB       LYS  55   3.945 -16.575   4.582
  389   1HG   LYS  55          2HG       LYS  55   2.941 -17.390   2.643
  390   2HG   LYS  55          1HG       LYS  55   2.062 -15.902   2.998
  391   1HD   LYS  55          2HD       LYS  55   3.854 -14.828   1.418
  392   2HD   LYS  55          1HD       LYS  55   4.024 -16.481   0.823
  393   1HE   LYS  55          2HE       LYS  55   1.328 -16.221   0.851
  394   2HE   LYS  55          1HE       LYS  55   1.814 -14.563   0.500
  395   1HZ   LYS  55          1HZ       LYS  55   1.469 -16.256  -1.418
  396   2HZ   LYS  55          2HZ       LYS  55   3.030 -16.765  -1.016
  397   3HZ   LYS  55          3HZ       LYS  55   2.759 -15.163  -1.484
  398    H    CYS  56           H        CYS  56   3.366 -15.181   6.522
  399    HA   CYS  56           HA       CYS  56   0.552 -14.873   6.374
  400   1HB   CYS  56          2HB       CYS  56   2.207 -16.183   8.068
  401   2HB   CYS  56          1HB       CYS  56   1.827 -14.763   9.044
  402    HG   CYS  56           HG       CYS  56  -0.184 -16.954   8.210
  403    H    GLU  57           H        GLU  57   3.172 -12.774   7.327
  404    HA   GLU  57           HA       GLU  57   1.731 -10.839   8.749
  405   1HB   GLU  57          2HB       GLU  57   4.367 -11.195   7.950
  406   2HB   GLU  57          1HB       GLU  57   3.875  -9.718   7.121
  407   1HG   GLU  57          2HG       GLU  57   3.037  -9.768   9.901
  408   2HG   GLU  57          1HG       GLU  57   4.784  -9.922   9.713
  409    H    LEU  58           H        LEU  58   2.694 -10.842   5.316
  410    HA   LEU  58           HA       LEU  58   1.104  -8.549   4.697
  411   1HB   LEU  58          2HB       LEU  58   2.157 -10.561   2.718
  412   2HB   LEU  58          1HB       LEU  58   1.793  -8.862   2.445
  413    HG   LEU  58           HG       LEU  58   3.942  -9.632   4.386
  414   1HD1  LEU  58          1HD1      LEU  58   4.086 -10.678   1.937
  415   2HD1  LEU  58          2HD1      LEU  58   5.500 -10.083   2.807
  416   3HD1  LEU  58          3HD1      LEU  58   4.723  -9.071   1.590
  417   1HD2  LEU  58          1HD2      LEU  58   4.807  -7.437   3.149
  418   2HD2  LEU  58          2HD2      LEU  58   3.713  -7.378   4.531
  419   3HD2  LEU  58          3HD2      LEU  58   3.074  -7.225   2.894
  420    H    ASP  59           H        ASP  59   0.630 -12.009   4.608
  421    HA   ASP  59           HA       ASP  59  -1.661 -12.071   2.965
  422   1HB   ASP  59          2HB       ASP  59  -0.301 -14.070   3.557
  423   2HB   ASP  59          1HB       ASP  59  -0.936 -13.974   5.203
  424    H    ALA  60           H        ALA  60  -1.190 -11.241   6.297
  425    HA   ALA  60           HA       ALA  60  -3.941 -11.526   7.034
  426   1HB   ALA  60          1HB       ALA  60  -1.667 -11.375   8.474
  427   2HB   ALA  60          2HB       ALA  60  -3.269 -11.059   9.138
  428   3HB   ALA  60          3HB       ALA  60  -2.246  -9.716   8.626
  429    H    ILE  61           H        ILE  61  -1.938  -9.007   5.703
  430    HA   ILE  61           HA       ILE  61  -3.880  -6.924   6.166
  431    HB   ILE  61           HB       ILE  61  -1.228  -7.030   4.751
  432   1HG1  ILE  61          2HG1      ILE  61  -1.092  -4.981   6.498
  433   2HG1  ILE  61          1HG1      ILE  61  -2.308  -5.976   7.304
  434   1HG2  ILE  61          1HG2      ILE  61  -1.490  -4.590   4.332
  435   2HG2  ILE  61          2HG2      ILE  61  -3.197  -4.754   4.746
  436   3HG2  ILE  61          3HG2      ILE  61  -2.540  -5.612   3.351
  437   1HD1  ILE  61          1HD1      ILE  61   0.146  -7.332   6.360
  438   2HD1  ILE  61          2HD1      ILE  61  -0.829  -7.615   7.802
  439   3HD1  ILE  61          3HD1      ILE  61   0.290  -6.252   7.745
  440    H    ILE  62           H        ILE  62  -2.414  -8.334   3.224
  441    HA   ILE  62           HA       ILE  62  -3.982  -7.261   1.279
  442    HB   ILE  62           HB       ILE  62  -3.050 -10.129   1.419
  443   1HG1  ILE  62          2HG1      ILE  62  -1.815  -7.627   0.248
  444   2HG1  ILE  62          1HG1      ILE  62  -1.213  -8.562   1.619
  445   1HG2  ILE  62          1HG2      ILE  62  -4.722  -8.829  -0.494
  446   2HG2  ILE  62          2HG2      ILE  62  -4.112 -10.483  -0.497
  447   3HG2  ILE  62          3HG2      ILE  62  -3.169  -9.194  -1.245
  448   1HD1  ILE  62          1HD1      ILE  62  -0.445 -10.271   0.274
  449   2HD1  ILE  62          2HD1      ILE  62  -0.104  -8.834  -0.689
  450   3HD1  ILE  62          3HD1      ILE  62  -1.507  -9.836  -1.065
  451    H    CYS  63           H        CYS  63  -4.797 -10.059   3.306
  452    HA   CYS  63           HA       CYS  63  -7.202 -10.776   2.092
  453   1HB   CYS  63          2HB       CYS  63  -5.905 -11.978   3.959
  454   2HB   CYS  63          1HB       CYS  63  -6.760 -10.907   5.073
  455    HG   CYS  63           HG       CYS  63  -8.704 -12.395   3.307
  456    H    GLU  64           H        GLU  64  -6.554  -8.441   4.678
  457    HA   GLU  64           HA       GLU  64  -9.295  -7.662   4.951
  458   1HB   GLU  64          2HB       GLU  64  -7.088  -7.360   6.515
  459   2HB   GLU  64          1HB       GLU  64  -7.205  -5.756   5.804
  460   1HG   GLU  64          2HG       GLU  64  -9.474  -5.530   6.626
  461   2HG   GLU  64          1HG       GLU  64  -9.417  -7.166   7.282
  462    H    VAL  65           H        VAL  65  -6.544  -6.623   3.078
  463    HA   VAL  65           HA       VAL  65  -7.541  -4.120   2.219
  464    HB   VAL  65           HB       VAL  65  -5.569  -5.992   0.894
  465   1HG1  VAL  65          1HG1      VAL  65  -6.326  -3.152   0.242
  466   2HG1  VAL  65          2HG1      VAL  65  -6.381  -4.564  -0.815
  467   3HG1  VAL  65          3HG1      VAL  65  -4.827  -3.903  -0.306
  468   1HG2  VAL  65          1HG2      VAL  65  -3.956  -4.191   1.761
  469   2HG2  VAL  65          2HG2      VAL  65  -4.617  -5.338   2.923
  470   3HG2  VAL  65          3HG2      VAL  65  -5.282  -3.710   2.820
  471    H    ASP  66           H        ASP  66  -7.633  -7.361   0.784
  472    HA   ASP  66           HA       ASP  66  -9.261  -6.468  -1.428
  473   1HB   ASP  66          2HB       ASP  66  -8.162  -9.145  -0.586
  474   2HB   ASP  66          1HB       ASP  66  -9.294  -8.984  -1.926
  475    H    GLU  67           H        GLU  67 -11.261  -5.856  -0.782
  476    HA   GLU  67           HA       GLU  67 -12.761  -7.238   1.213
  477   1HB   GLU  67          2HB       GLU  67 -13.083  -4.872  -0.466
  478   2HB   GLU  67          1HB       GLU  67 -14.591  -5.766  -0.266
  479   1HG   GLU  67          2HG       GLU  67 -13.057  -5.355   2.204
  480   2HG   GLU  67          1HG       GLU  67 -13.671  -3.881   1.444
  481    H    ASP  68           H        ASP  68 -12.422  -7.511  -2.232
  482    HA   ASP  68           HA       ASP  68 -14.802  -9.108  -2.574
  483   1HB   ASP  68          2HB       ASP  68 -14.057  -9.329  -4.901
  484   2HB   ASP  68          1HB       ASP  68 -14.025  -7.645  -4.385
  485    H    GLY  69           H        GLY  69 -11.392  -9.629  -2.048
  486   1HA   GLY  69          2HA       GLY  69 -10.518 -11.631  -1.139
  487   2HA   GLY  69          1HA       GLY  69 -11.926 -12.491  -1.743
  488    H    SER  70           H        SER  70  -9.466 -10.417  -3.270
  489    HA   SER  70           HA       SER  70  -9.065 -12.540  -5.268
  490   1HB   SER  70          2HB       SER  70  -7.986 -10.435  -6.503
  491   2HB   SER  70          1HB       SER  70  -9.722 -10.765  -6.567
  492    HG   SER  70           HG       SER  70  -8.389  -8.976  -4.808
  493    H    GLY  71           H        GLY  71  -7.511 -10.520  -2.907
  494   1HA   GLY  71          2HA       GLY  71  -5.445 -10.913  -1.898
  495   2HA   GLY  71          1HA       GLY  71  -5.087 -12.098  -3.153
  496    H    THR  72           H        THR  72  -6.112  -9.556  -4.876
  497    HA   THR  72           HA       THR  72  -3.382  -8.522  -5.191
  498    HB   THR  72           HB       THR  72  -3.968  -7.947  -7.446
  499    HG1  THR  72           1HG      THR  72  -6.056  -8.177  -8.220
  500   1HG2  THR  72          1HG2      THR  72  -5.255 -10.287  -8.031
  501   2HG2  THR  72          2HG2      THR  72  -4.435 -10.660  -6.515
  502   3HG2  THR  72          3HG2      THR  72  -3.509 -10.073  -7.897
  503    H    ILE  73           H        ILE  73  -3.007  -6.295  -5.377
  504    HA   ILE  73           HA       ILE  73  -5.092  -4.636  -4.136
  505    HB   ILE  73           HB       ILE  73  -2.139  -4.056  -4.358
  506   1HG1  ILE  73          2HG1      ILE  73  -3.689  -5.041  -1.948
  507   2HG1  ILE  73          1HG1      ILE  73  -2.667  -6.064  -2.961
  508   1HG2  ILE  73          1HG2      ILE  73  -3.459  -2.048  -4.133
  509   2HG2  ILE  73          2HG2      ILE  73  -2.624  -2.370  -2.614
  510   3HG2  ILE  73          3HG2      ILE  73  -4.342  -2.740  -2.772
  511   1HD1  ILE  73          1HD1      ILE  73  -0.714  -4.837  -2.324
  512   2HD1  ILE  73          2HD1      ILE  73  -1.588  -5.312  -0.867
  513   3HD1  ILE  73          3HD1      ILE  73  -1.689  -3.652  -1.454
  514    H    ASP  74           H        ASP  74  -6.232  -3.479  -5.542
  515    HA   ASP  74           HA       ASP  74  -5.458  -2.914  -8.185
  516   1HB   ASP  74          2HB       ASP  74  -7.736  -2.384  -6.472
  517   2HB   ASP  74          1HB       ASP  74  -7.374  -0.990  -7.493
  518    H    PHE  75           H        PHE  75  -5.973  -0.293  -8.704
  519    HA   PHE  75           HA       PHE  75  -3.512   0.947  -8.267
  520   1HB   PHE  75          2HB       PHE  75  -6.168   1.842  -9.294
  521   2HB   PHE  75          1HB       PHE  75  -4.976   3.079  -8.886
  522    HD1  PHE  75           1HD      PHE  75  -2.694   2.940  -9.983
  523    HD2  PHE  75           2HD      PHE  75  -6.054   0.697 -11.318
  524    HE1  PHE  75           1HE      PHE  75  -1.603   2.612 -12.164
  525    HE2  PHE  75           2HE      PHE  75  -4.969   0.363 -13.501
  526    HZ   PHE  75           HZ       PHE  75  -2.741   1.321 -13.926
  527    H    GLU  76           H        GLU  76  -6.509   2.495  -7.166
  528    HA   GLU  76           HA       GLU  76  -5.192   3.840  -5.046
  529   1HB   GLU  76          2HB       GLU  76  -8.163   3.431  -5.120
  530   2HB   GLU  76          1HB       GLU  76  -7.255   4.824  -4.553
  531   1HG   GLU  76          2HG       GLU  76  -6.543   4.778  -7.164
  532   2HG   GLU  76          1HG       GLU  76  -8.184   4.138  -7.247
  533    H    GLU  77           H        GLU  77  -6.548   0.706  -5.320
  534    HA   GLU  77           HA       GLU  77  -7.459   0.153  -2.771
  535   1HB   GLU  77          2HB       GLU  77  -6.610  -1.359  -5.072
  536   2HB   GLU  77          1HB       GLU  77  -6.038  -2.139  -3.603
  537   1HG   GLU  77          2HG       GLU  77  -8.448  -1.855  -2.763
  538   2HG   GLU  77          1HG       GLU  77  -8.846  -1.569  -4.461
  539    H    PHE  78           H        PHE  78  -4.193   0.638  -3.872
  540    HA   PHE  78           HA       PHE  78  -2.921  -0.589  -1.632
  541   1HB   PHE  78          2HB       PHE  78  -1.861  -0.111  -3.899
  542   2HB   PHE  78          1HB       PHE  78  -1.711   1.565  -3.360
  543    HD1  PHE  78           1HD      PHE  78  -0.282   2.111  -1.425
  544    HD2  PHE  78           2HD      PHE  78  -0.407  -1.801  -3.087
  545    HE1  PHE  78           1HE      PHE  78   1.814   1.559  -0.265
  546    HE2  PHE  78           2HE      PHE  78   1.690  -2.363  -1.930
  547    HZ   PHE  78           HZ       PHE  78   2.802  -0.682  -0.515
  548    H    LEU  79           H        LEU  79  -4.683   2.261  -1.954
  549    HA   LEU  79           HA       LEU  79  -3.237   3.652   0.168
  550   1HB   LEU  79          2HB       LEU  79  -5.534   4.461  -1.608
  551   2HB   LEU  79          1HB       LEU  79  -4.978   5.443  -0.267
  552    HG   LEU  79           HG       LEU  79  -2.718   4.793  -1.878
  553   1HD1  LEU  79          1HD1      LEU  79  -3.724   4.533  -3.880
  554   2HD1  LEU  79          2HD1      LEU  79  -3.749   6.296  -3.842
  555   3HD1  LEU  79          3HD1      LEU  79  -5.186   5.383  -3.380
  556   1HD2  LEU  79          1HD2      LEU  79  -2.738   7.302  -2.194
  557   2HD2  LEU  79          2HD2      LEU  79  -2.726   6.730  -0.526
  558   3HD2  LEU  79          3HD2      LEU  79  -4.226   7.317  -1.247
  559    H    VAL  80           H        VAL  80  -6.297   2.043  -0.477
  560    HA   VAL  80           HA       VAL  80  -7.502   2.766   2.014
  561    HB   VAL  80           HB       VAL  80  -8.703   2.051  -0.136
  562   1HG1  VAL  80          1HG1      VAL  80  -9.223  -0.325  -0.341
  563   2HG1  VAL  80          2HG1      VAL  80  -8.125  -0.685   0.990
  564   3HG1  VAL  80          3HG1      VAL  80  -7.495  -0.031  -0.521
  565   1HG2  VAL  80          1HG2      VAL  80 -10.597   1.673   1.071
  566   2HG2  VAL  80          2HG2      VAL  80  -9.549   2.269   2.359
  567   3HG2  VAL  80          3HG2      VAL  80  -9.809   0.535   2.164
  568    H    MET  81           H        MET  81  -5.555   0.107   0.862
  569    HA   MET  81           HA       MET  81  -5.957  -1.842   2.769
  570   1HB   MET  81          2HB       MET  81  -3.425  -2.269   2.410
  571   2HB   MET  81          1HB       MET  81  -4.504  -2.414   1.032
  572   1HG   MET  81          2HG       MET  81  -3.695  -0.554   0.017
  573   2HG   MET  81          1HG       MET  81  -3.239   0.223   1.537
  574   1HE   MET  81          1HE       MET  81  -1.834  -1.046   3.094
  575   2HE   MET  81          2HE       MET  81  -0.206  -0.571   2.595
  576   3HE   MET  81          3HE       MET  81  -0.642  -2.281   2.688
  577    H    MET  82           H        MET  82  -3.973   1.023   2.879
  578    HA   MET  82           HA       MET  82  -2.821   0.528   5.436
  579   1HB   MET  82          2HB       MET  82  -2.884   2.728   3.438
  580   2HB   MET  82          1HB       MET  82  -2.405   3.129   5.088
  581   1HG   MET  82          2HG       MET  82  -0.612   1.515   4.987
  582   2HG   MET  82          1HG       MET  82  -1.132   1.008   3.381
  583   1HE   MET  82          1HE       MET  82   1.862   4.023   4.439
  584   2HE   MET  82          2HE       MET  82   2.057   2.302   4.106
  585   3HE   MET  82          3HE       MET  82   1.024   2.830   5.433
  586    H    VAL  83           H        VAL  83  -5.562   2.376   4.222
  587    HA   VAL  83           HA       VAL  83  -6.173   3.778   6.584
  588    HB   VAL  83           HB       VAL  83  -8.111   2.879   4.446
  589   1HG1  VAL  83          1HG1      VAL  83  -8.234   4.965   6.601
  590   2HG1  VAL  83          2HG1      VAL  83  -9.376   3.668   6.251
  591   3HG1  VAL  83          3HG1      VAL  83  -9.250   5.049   5.161
  592   1HG2  VAL  83          1HG2      VAL  83  -7.458   4.577   3.091
  593   2HG2  VAL  83          2HG2      VAL  83  -5.916   4.311   3.911
  594   3HG2  VAL  83          3HG2      VAL  83  -6.982   5.614   4.436
  595    H    ARG  84           H        ARG  84  -7.105   0.588   5.412
  596    HA   ARG  84           HA       ARG  84  -9.078   0.029   7.335
  597   1HB   ARG  84          2HB       ARG  84  -7.251  -1.874   5.859
  598   2HB   ARG  84          1HB       ARG  84  -8.698  -2.340   6.742
  599   1HG   ARG  84          2HG       ARG  84  -9.571  -0.360   5.009
  600   2HG   ARG  84          1HG       ARG  84  -8.417  -1.302   4.056
  601   1HD   ARG  84          2HD       ARG  84  -9.939  -2.895   3.783
  602   2HD   ARG  84          1HD       ARG  84 -10.031  -3.118   5.529
  603    HE   ARG  84           HE       ARG  84 -11.920  -1.753   3.855
  604   1HH1  ARG  84          1HH1      ARG  84 -10.639  -1.992   7.092
  605   2HH1  ARG  84          2HH1      ARG  84 -12.066  -1.354   7.838
  606   1HH2  ARG  84          1HH2      ARG  84 -13.797  -0.912   4.833
  607   2HH2  ARG  84          2HH2      ARG  84 -13.858  -0.741   6.556
  608    H    GLN  85           H        GLN  85  -5.658   0.196   7.591
  609    HA   GLN  85           HA       GLN  85  -5.737  -1.225  10.170
  610   1HB   GLN  85          2HB       GLN  85  -3.150  -0.489   8.876
  611   2HB   GLN  85          1HB       GLN  85  -3.544  -1.875   9.891
  612   1HG   GLN  85          2HG       GLN  85  -4.244  -1.477   6.994
  613   2HG   GLN  85          1HG       GLN  85  -3.106  -2.646   7.673
  614   1HE2  GLN  85          1HE2      GLN  85  -4.707  -3.883   6.179
  615   2HE2  GLN  85          2HE2      GLN  85  -6.030  -4.633   6.998
  616    H    MET  86           H        MET  86  -5.139   1.800   8.606
  617    HA   MET  86           HA       MET  86  -3.705   3.050  10.716
  618   1HB   MET  86          2HB       MET  86  -5.105   3.964   8.242
  619   2HB   MET  86          1HB       MET  86  -4.662   5.164   9.458
  620   1HG   MET  86          2HG       MET  86  -2.318   4.062   9.311
  621   2HG   MET  86          1HG       MET  86  -2.908   3.435   7.767
  622   1HE   MET  86          1HE       MET  86  -1.521   6.040   5.613
  623   2HE   MET  86          2HE       MET  86  -2.913   4.962   5.500
  624   3HE   MET  86          3HE       MET  86  -1.404   4.388   6.223
  625    H    LYS  87           H        LYS  87  -7.106   2.686   9.936
  626    HA   LYS  87           HA       LYS  87  -8.079   4.605  11.787
  627   1HB   LYS  87          2HB       LYS  87  -9.228   2.467  10.099
  628   2HB   LYS  87          1HB       LYS  87 -10.159   2.885  11.536
  629   1HG   LYS  87          2HG       LYS  87 -10.982   4.660  10.509
  630   2HG   LYS  87          1HG       LYS  87  -9.349   5.296  10.263
  631   1HD   LYS  87          2HD       LYS  87 -10.466   5.102   8.131
  632   2HD   LYS  87          1HD       LYS  87  -9.163   3.915   8.220
  633   1HE   LYS  87          2HE       LYS  87 -10.580   2.172   8.125
  634   2HE   LYS  87          1HE       LYS  87 -11.761   2.948   9.180
  635   1HZ   LYS  87          1HZ       LYS  87 -12.046   4.427   7.008
  636   2HZ   LYS  87          2HZ       LYS  87 -12.929   3.008   7.266
  637   3HZ   LYS  87          3HZ       LYS  87 -11.557   2.981   6.275
  638    H    GLU  88           H        GLU  88  -7.054   1.299  12.065
  639    HA   GLU  88           HA       GLU  88  -6.757  -0.071  13.863
  640   1HB   GLU  88          2HB       GLU  88  -6.137   2.395  14.801
  641   2HB   GLU  88          1HB       GLU  88  -7.460   1.972  15.880
  642   1HG   GLU  88          2HG       GLU  88  -6.302  -0.048  16.551
  643   2HG   GLU  88          1HG       GLU  88  -4.999   0.302  15.418
  644    H    ASP  89           H        ASP  89  -7.934  -1.313  15.389
  645    HA   ASP  89           HA       ASP  89 -10.775  -1.255  14.937
  646   1HB   ASP  89          2HB       ASP  89  -8.847  -3.112  16.247
  647   2HB   ASP  89          1HB       ASP  89 -10.542  -3.213  16.732
  648    H    ALA  90           H        ALA  90 -12.384  -1.193  16.599
  649    HA   ALA  90           HA       ALA  90 -13.418  -0.253  18.395
  650   1HB   ALA  90          1HB       ALA  90 -10.842  -1.224  19.471
  651   2HB   ALA  90          2HB       ALA  90 -12.493  -1.594  19.967
  652   3HB   ALA  90          3HB       ALA  90 -11.738  -0.083  20.474
  653   2H    ARG 115          HN2       ARG 115   2.354  -3.487   9.874
  654    H    ARG 115           H        ARG 115   1.872  -4.680   8.740
  655   3H    ARG 115          HN3       ARG 115   2.383  -3.139   8.194
  656    HA   ARG 115           HA       ARG 115   0.106  -3.112   8.029
  657   1HB   ARG 115          2HB       ARG 115  -0.289  -5.131   9.345
  658   2HB   ARG 115          1HB       ARG 115   0.126  -4.275  10.823
  659   1HG   ARG 115          2HG       ARG 115  -1.815  -2.805  10.496
  660   2HG   ARG 115          1HG       ARG 115  -2.238  -3.715   9.046
  661   1HD   ARG 115          2HD       ARG 115  -3.579  -4.723  10.621
  662   2HD   ARG 115          1HD       ARG 115  -2.159  -5.767  10.651
  663    HE   ARG 115           HE       ARG 115  -2.026  -3.636  12.562
  664   1HH1  ARG 115          1HH1      ARG 115  -3.259  -6.847  11.973
  665   2HH1  ARG 115          2HH1      ARG 115  -3.340  -7.259  13.653
  666   1HH2  ARG 115          1HH2      ARG 115  -2.131  -4.177  14.772
  667   2HH2  ARG 115          2HH2      ARG 115  -2.701  -5.743  15.242
  668    H    MET 116           H        MET 116  -0.619  -1.086   8.133
  669    HA   MET 116           HA       MET 116  -0.882   1.086   8.755
  670   1HB   MET 116          2HB       MET 116  -2.039  -0.030  10.678
  671   2HB   MET 116          1HB       MET 116  -0.531   0.071  11.578
  672   1HG   MET 116          2HG       MET 116  -1.526   2.590  10.406
  673   2HG   MET 116          1HG       MET 116  -2.473   1.904  11.726
  674   1HE   MET 116          1HE       MET 116  -1.735   2.808  14.363
  675   2HE   MET 116          2HE       MET 116  -2.292   3.814  13.026
  676   3HE   MET 116          3HE       MET 116  -0.912   4.325  13.997
  677    H    SER 117           H        SER 117   0.228   2.978   9.693
  678    HA   SER 117           HA       SER 117   2.127   4.242   9.764
  679   1HB   SER 117          2HB       SER 117   3.809   3.458  11.475
  680   2HB   SER 117          1HB       SER 117   2.151   3.568  12.063
  681    HG   SER 117           HG       SER 117   3.480   1.207  11.213
  682    H    ALA 118           H        ALA 118   1.952   2.272   7.645
  683    HA   ALA 118           HA       ALA 118   4.564   1.151   7.252
  684   1HB   ALA 118          1HB       ALA 118   1.985   1.138   5.848
  685   2HB   ALA 118          2HB       ALA 118   3.158  -0.158   6.086
  686   3HB   ALA 118          3HB       ALA 118   3.406   1.031   4.807
  687    H    ASP 119           H        ASP 119   3.560   4.267   7.168
  688    HA   ASP 119           HA       ASP 119   4.304   5.454   4.842
  689   1HB   ASP 119          2HB       ASP 119   3.482   6.559   6.978
  690   2HB   ASP 119          1HB       ASP 119   5.155   6.538   7.526
  691    H    ALA 120           H        ALA 120   6.401   3.916   7.163
  692    HA   ALA 120           HA       ALA 120   8.858   5.031   6.534
  693   1HB   ALA 120          1HB       ALA 120   8.638   2.088   7.004
  694   2HB   ALA 120          2HB       ALA 120   8.198   3.218   8.285
  695   3HB   ALA 120          3HB       ALA 120   9.830   3.236   7.616
  696    H    MET 121           H        MET 121   7.654   1.939   5.196
  697    HA   MET 121           HA       MET 121   9.558   1.730   3.168
  698   1HB   MET 121          2HB       MET 121   8.164  -0.159   3.784
  699   2HB   MET 121          1HB       MET 121   6.718   0.692   3.259
  700   1HG   MET 121          2HG       MET 121   8.145   0.753   0.978
  701   2HG   MET 121          1HG       MET 121   8.749  -0.745   1.688
  702   1HE   MET 121          1HE       MET 121   4.925   0.495   2.296
  703   2HE   MET 121          2HE       MET 121   4.367   0.158   0.657
  704   3HE   MET 121          3HE       MET 121   5.657   1.330   0.925
  705    H    LEU 122           H        LEU 122   6.504   3.434   3.303
  706    HA   LEU 122           HA       LEU 122   6.311   4.065   0.553
  707   1HB   LEU 122          2HB       LEU 122   5.126   5.235   3.054
  708   2HB   LEU 122          1HB       LEU 122   4.869   6.003   1.499
  709    HG   LEU 122           HG       LEU 122   3.937   3.775   0.697
  710   1HD1  LEU 122          1HD1      LEU 122   3.731   3.210   3.646
  711   2HD1  LEU 122          2HD1      LEU 122   4.928   2.467   2.588
  712   3HD1  LEU 122          3HD1      LEU 122   3.209   2.179   2.313
  713   1HD2  LEU 122          1HD2      LEU 122   2.546   5.728   1.259
  714   2HD2  LEU 122          2HD2      LEU 122   2.467   5.173   2.931
  715   3HD2  LEU 122          3HD2      LEU 122   1.748   4.202   1.645
  716    H    ARG 123           H        ARG 123   7.881   5.612   3.300
  717    HA   ARG 123           HA       ARG 123   8.724   7.870   1.666
  718   1HB   ARG 123          2HB       ARG 123   7.985   7.977   4.140
  719   2HB   ARG 123          1HB       ARG 123   9.589   7.353   4.498
  720   1HG   ARG 123          2HG       ARG 123  10.443   9.321   3.082
  721   2HG   ARG 123          1HG       ARG 123   8.820   9.982   3.292
  722   1HD   ARG 123          2HD       ARG 123   9.145  10.434   5.481
  723   2HD   ARG 123          1HD       ARG 123  10.129   8.995   5.741
  724    HE   ARG 123           HE       ARG 123  11.527  10.887   4.165
  725   1HH1  ARG 123          1HH1      ARG 123  10.511  10.263   7.445
  726   2HH1  ARG 123          2HH1      ARG 123  11.812  11.160   8.152
  727   1HH2  ARG 123          1HH2      ARG 123  13.241  12.068   5.093
  728   2HH2  ARG 123          2HH2      ARG 123  13.362  12.185   6.817
  729    H    ALA 124           H        ALA 124   9.716   4.883   1.606
  730    HA   ALA 124           HA       ALA 124  12.528   5.141   2.146
  731   1HB   ALA 124          1HB       ALA 124  11.771   2.890   0.469
  732   2HB   ALA 124          2HB       ALA 124  10.776   3.025   1.919
  733   3HB   ALA 124          3HB       ALA 124  12.529   2.913   2.063
  734    H    LEU 125           H        LEU 125  10.967   4.069  -0.857
  735    HA   LEU 125           HA       LEU 125  13.148   5.009  -2.445
  736   1HB   LEU 125          2HB       LEU 125  10.438   4.088  -3.389
  737   2HB   LEU 125          1HB       LEU 125  11.924   4.140  -4.321
  738    HG   LEU 125           HG       LEU 125  11.816   2.451  -1.860
  739   1HD1  LEU 125          1HD1      LEU 125  10.331   1.993  -4.380
  740   2HD1  LEU 125          2HD1      LEU 125   9.967   1.476  -2.733
  741   3HD1  LEU 125          3HD1      LEU 125  11.187   0.621  -3.676
  742   1HD2  LEU 125          1HD2      LEU 125  13.820   2.989  -3.520
  743   2HD2  LEU 125          2HD2      LEU 125  13.099   1.644  -4.405
  744   3HD2  LEU 125          3HD2      LEU 125  13.635   1.418  -2.739
  745    H    LEU 126           H        LEU 126  10.206   6.393  -1.330
  746    HA   LEU 126           HA       LEU 126   9.236   8.425  -1.637
  747   1HB   LEU 126          2HB       LEU 126  12.038   8.885  -2.533
  748   2HB   LEU 126          1HB       LEU 126  10.848  10.119  -2.901
  749    HG   LEU 126           HG       LEU 126  11.323   9.084  -0.111
  750   1HD1  LEU 126          1HD1      LEU 126  13.264  10.317  -1.431
  751   2HD1  LEU 126          2HD1      LEU 126  12.938  10.637   0.272
  752   3HD1  LEU 126          3HD1      LEU 126  12.330  11.738  -0.964
  753   1HD2  LEU 126          1HD2      LEU 126  10.100  11.003   0.592
  754   2HD2  LEU 126          2HD2      LEU 126   9.147  10.198  -0.655
  755   3HD2  LEU 126          3HD2      LEU 126  10.064  11.653  -1.048
  756    H    GLY 127           H        GLY 127   8.075   9.649  -3.176
  757   1HA   GLY 127          2HA       GLY 127   8.239   8.581  -5.928
  758   2HA   GLY 127          1HA       GLY 127   6.709   8.896  -5.124
  759    H    SER 128           H        SER 128   9.712  10.787  -5.424
  760    HA   SER 128           HA       SER 128   8.099  13.106  -6.177
  761   1HB   SER 128          2HB       SER 128  10.946  12.799  -5.227
  762   2HB   SER 128          1HB       SER 128  10.328  14.321  -5.869
  763    HG   SER 128           HG       SER 128   9.080  12.923  -3.746
  764    H    LYS 129           H        LYS 129   7.635  12.453  -8.326
  765    HA   LYS 129           HA       LYS 129   9.604  11.763 -10.223
  766   1HB   LYS 129          2HB       LYS 129   6.890  13.016 -10.682
  767   2HB   LYS 129          1HB       LYS 129   7.871  12.218 -11.903
  768   1HG   LYS 129          2HG       LYS 129   7.744  10.177 -10.309
  769   2HG   LYS 129          1HG       LYS 129   6.362  11.031  -9.617
  770   1HD   LYS 129          2HD       LYS 129   6.679  10.334 -12.536
  771   2HD   LYS 129          1HD       LYS 129   5.720   9.412 -11.375
  772   1HE   LYS 129          2HE       LYS 129   4.069  10.972 -11.295
  773   2HE   LYS 129          1HE       LYS 129   5.176  12.317 -11.567
  774   1HZ   LYS 129          1HZ       LYS 129   3.482  11.427 -13.403
  775   2HZ   LYS 129          2HZ       LYS 129   4.828  10.479 -13.790
  776   3HZ   LYS 129          3HZ       LYS 129   4.956  12.165 -13.789
  777    H    HIS 130           H        HIS 130  11.259  13.347  -9.779
  778    HA   HIS 130           HA       HIS 130  11.243  15.488 -11.626
  779   1HB   HIS 130          2HB       HIS 130  10.116  16.097  -9.088
  780   2HB   HIS 130          1HB       HIS 130  11.679  16.902  -9.176
  781    HD1  HIS 130           1HD      HIS 130   8.720  16.496 -11.550
  782    HD2  HIS 130           2HD      HIS 130  11.404  19.372 -10.211
  783    HE1  HIS 130           1HE      HIS 130   8.075  18.620 -12.733
  784    HE2  HIS 130           2HE      HIS 130   9.765  20.326 -11.970
  785    H    LYS 131           H        LYS 131  13.247  16.895 -11.337
  786    HA   LYS 131           HA       LYS 131  15.442  15.156 -10.459
  787   1HB   LYS 131          2HB       LYS 131  15.280  17.390 -12.469
  788   2HB   LYS 131          1HB       LYS 131  16.824  16.796 -11.875
  789   1HG   LYS 131          2HG       LYS 131  14.796  14.939 -13.061
  790   2HG   LYS 131          1HG       LYS 131  15.924  15.846 -14.071
  791   1HD   LYS 131          2HD       LYS 131  17.806  14.823 -13.002
  792   2HD   LYS 131          1HD       LYS 131  16.771  14.066 -11.790
  793   1HE   LYS 131          2HE       LYS 131  15.820  12.599 -13.388
  794   2HE   LYS 131          1HE       LYS 131  16.514  13.502 -14.734
  795   1HZ   LYS 131          1HZ       LYS 131  18.505  12.509 -14.491
  796   2HZ   LYS 131          2HZ       LYS 131  17.596  11.289 -13.753
  797   3HZ   LYS 131          3HZ       LYS 131  18.405  12.431 -12.803
  Start of MODEL   12
    1   2H    ALA   1          HN2       ALA   1 -16.591   2.801 -13.446
    2    H    ALA   1           H        ALA   1 -16.418   1.687 -14.741
    3   3H    ALA   1          HN3       ALA   1 -17.900   1.783 -13.885
    4    HA   ALA   1           HA       ALA   1 -16.810  -0.113 -13.150
    5   1HB   ALA   1          1HB       ALA   1 -14.582  -0.315 -12.812
    6   2HB   ALA   1          2HB       ALA   1 -14.418   1.318 -12.170
    7   3HB   ALA   1          3HB       ALA   1 -14.529   1.063 -13.911
    8    H    SER   2           H        SER   2 -18.461   0.052 -11.651
    9    HA   SER   2           HA       SER   2 -17.823   1.559  -9.199
   10   1HB   SER   2          2HB       SER   2 -20.569   0.726 -10.160
   11   2HB   SER   2          1HB       SER   2 -20.199   1.760  -8.780
   12    HG   SER   2           HG       SER   2 -19.704   2.332 -11.517
   13    H    MET   3           H        MET   3 -17.744   0.498  -7.297
   14    HA   MET   3           HA       MET   3 -18.980  -2.056  -6.893
   15   1HB   MET   3          2HB       MET   3 -16.081  -1.862  -7.536
   16   2HB   MET   3          1HB       MET   3 -16.552  -2.969  -6.254
   17   1HG   MET   3          2HG       MET   3 -16.901  -4.463  -7.852
   18   2HG   MET   3          1HG       MET   3 -18.344  -3.538  -8.262
   19   1HE   MET   3          1HE       MET   3 -14.264  -3.701  -9.925
   20   2HE   MET   3          2HE       MET   3 -14.704  -3.066  -8.340
   21   3HE   MET   3          3HE       MET   3 -14.512  -1.969  -9.707
   22    H    THR   4           H        THR   4 -16.482   0.201  -5.781
   23    HA   THR   4           HA       THR   4 -17.754   0.538  -3.252
   24    HB   THR   4           HB       THR   4 -16.683  -1.635  -2.841
   25    HG1  THR   4           1HG      THR   4 -16.755   0.084  -1.202
   26   1HG2  THR   4          1HG2      THR   4 -14.307  -1.915  -2.788
   27   2HG2  THR   4          2HG2      THR   4 -14.056  -0.244  -3.295
   28   3HG2  THR   4          3HG2      THR   4 -14.788  -1.402  -4.405
   29    H    ASP   5           H        ASP   5 -17.423   2.595  -2.760
   30    HA   ASP   5           HA       ASP   5 -15.365   4.114  -4.063
   31   1HB   ASP   5          2HB       ASP   5 -16.309   6.009  -2.676
   32   2HB   ASP   5          1HB       ASP   5 -17.447   5.222  -3.773
   33    H    GLN   6           H        GLN   6 -15.233   2.140  -1.424
   34    HA   GLN   6           HA       GLN   6 -13.945   3.545   0.573
   35   1HB   GLN   6          2HB       GLN   6 -12.991   1.436   1.282
   36   2HB   GLN   6          1HB       GLN   6 -14.641   1.172   0.732
   37   1HG   GLN   6          2HG       GLN   6 -13.791   0.350  -1.410
   38   2HG   GLN   6          1HG       GLN   6 -12.140   0.597  -0.841
   39   1HE2  GLN   6          1HE2      GLN   6 -14.933  -1.405  -0.731
   40   2HE2  GLN   6          2HE2      GLN   6 -14.253  -2.679   0.218
   41    H    GLN   7           H        GLN   7 -12.756   2.543  -2.533
   42    HA   GLN   7           HA       GLN   7  -9.980   2.910  -1.956
   43   1HB   GLN   7          2HB       GLN   7 -11.007   3.151  -4.741
   44   2HB   GLN   7          1HB       GLN   7  -9.572   2.330  -4.146
   45   1HG   GLN   7          2HG       GLN   7 -11.315   0.717  -3.048
   46   2HG   GLN   7          1HG       GLN   7 -12.382   1.361  -4.297
   47   1HE2  GLN   7          1HE2      GLN   7 -11.639  -1.314  -4.158
   48   2HE2  GLN   7          2HE2      GLN   7 -10.665  -1.693  -5.535
   49    H    ALA   8           H        ALA   8 -12.536   5.054  -2.464
   50    HA   ALA   8           HA       ALA   8 -10.883   7.150  -3.606
   51   1HB   ALA   8          1HB       ALA   8 -12.799   8.199  -4.189
   52   2HB   ALA   8          2HB       ALA   8 -13.613   7.788  -2.678
   53   3HB   ALA   8          3HB       ALA   8 -13.486   6.589  -3.965
   54    H    GLU   9           H        GLU   9 -12.785   6.601  -0.643
   55    HA   GLU   9           HA       GLU   9 -12.156   8.949   0.700
   56   1HB   GLU   9          2HB       GLU   9 -12.474   6.228   1.978
   57   2HB   GLU   9          1HB       GLU   9 -12.741   7.790   2.740
   58   1HG   GLU   9          2HG       GLU   9 -14.811   7.967   1.933
   59   2HG   GLU   9          1HG       GLU   9 -14.340   7.376   0.335
   60    H    ALA  10           H        ALA  10 -10.402   5.903   0.518
   61    HA   ALA  10           HA       ALA  10  -8.418   6.142   2.340
   62   1HB   ALA  10          1HB       ALA  10  -7.197   5.300  -0.085
   63   2HB   ALA  10          2HB       ALA  10  -8.855   4.700  -0.057
   64   3HB   ALA  10          3HB       ALA  10  -7.753   4.316   1.270
   65    H    ARG  11           H        ARG  11  -8.080   7.322  -1.015
   66    HA   ARG  11           HA       ARG  11  -5.679   8.654  -0.724
   67   1HB   ARG  11          2HB       ARG  11  -7.655   8.417  -2.710
   68   2HB   ARG  11          1HB       ARG  11  -7.434  10.146  -2.468
   69   1HG   ARG  11          2HG       ARG  11  -5.012   9.860  -2.818
   70   2HG   ARG  11          1HG       ARG  11  -5.283   8.146  -3.136
   71   1HD   ARG  11          2HD       ARG  11  -5.176   9.134  -5.257
   72   2HD   ARG  11          1HD       ARG  11  -6.899   8.913  -4.953
   73    HE   ARG  11           HE       ARG  11  -6.442  11.430  -4.082
   74   1HH1  ARG  11          1HH1      ARG  11  -5.725   9.777  -7.071
   75   2HH1  ARG  11          2HH1      ARG  11  -5.838  11.211  -8.037
   76   1HH2  ARG  11          1HH2      ARG  11  -6.590  13.317  -5.351
   77   2HH2  ARG  11          2HH2      ARG  11  -6.328  13.221  -7.060
   78    H    ALA  12           H        ALA  12  -8.834   9.568   0.372
   79    HA   ALA  12           HA       ALA  12  -8.005  12.304   0.939
   80   1HB   ALA  12          1HB       ALA  12 -10.271  11.772   0.009
   81   2HB   ALA  12          2HB       ALA  12 -10.281  12.743   1.480
   82   3HB   ALA  12          3HB       ALA  12 -10.658  11.022   1.557
   83    H    PHE  13           H        PHE  13  -8.268   9.247   2.515
   84    HA   PHE  13           HA       PHE  13  -8.633  10.160   5.172
   85   1HB   PHE  13          2HB       PHE  13  -9.050   7.833   4.546
   86   2HB   PHE  13          1HB       PHE  13  -7.343   7.618   4.151
   87    HD1  PHE  13           1HD      PHE  13  -5.684   7.392   5.885
   88    HD2  PHE  13           2HD      PHE  13  -9.791   7.959   6.848
   89    HE1  PHE  13           1HE      PHE  13  -5.229   6.713   8.206
   90    HE2  PHE  13           2HE      PHE  13  -9.343   7.281   9.171
   91    HZ   PHE  13           HZ       PHE  13  -7.060   6.657   9.852
   92    H    LEU  14           H        LEU  14  -5.825   9.767   3.125
   93    HA   LEU  14           HA       LEU  14  -4.090  10.589   5.352
   94   1HB   LEU  14          2HB       LEU  14  -3.136   9.562   2.693
   95   2HB   LEU  14          1HB       LEU  14  -2.263   9.624   4.219
   96    HG   LEU  14           HG       LEU  14  -4.695   7.894   3.962
   97   1HD1  LEU  14          1HD1      LEU  14  -3.382   7.246   2.063
   98   2HD1  LEU  14          2HD1      LEU  14  -3.186   6.030   3.326
   99   3HD1  LEU  14          3HD1      LEU  14  -1.911   7.214   3.036
  100   1HD2  LEU  14          1HD2      LEU  14  -2.175   7.391   5.507
  101   2HD2  LEU  14          2HD2      LEU  14  -3.790   6.734   5.774
  102   3HD2  LEU  14          3HD2      LEU  14  -3.454   8.427   6.140
  103    H    SER  15           H        SER  15  -2.262  12.042   4.738
  104    HA   SER  15           HA       SER  15  -3.310  14.342   3.346
  105   1HB   SER  15          2HB       SER  15  -1.667  14.094   5.490
  106   2HB   SER  15          1HB       SER  15  -0.472  14.343   4.209
  107    HG   SER  15           HG       SER  15  -2.735  16.016   4.549
  108    H    GLU  16           H        GLU  16  -2.045  15.484   1.681
  109    HA   GLU  16           HA       GLU  16  -1.525  13.963  -0.560
  110   1HB   GLU  16          2HB       GLU  16  -1.285  16.705   0.180
  111   2HB   GLU  16          1HB       GLU  16   0.197  16.243  -0.646
  112   1HG   GLU  16          2HG       GLU  16  -1.720  15.144  -2.251
  113   2HG   GLU  16          1HG       GLU  16  -2.500  16.623  -1.691
  114    H    GLU  17           H        GLU  17   0.505  14.648   2.156
  115    HA   GLU  17           HA       GLU  17   3.020  14.016   1.070
  116   1HB   GLU  17          2HB       GLU  17   1.832  14.260   3.777
  117   2HB   GLU  17          1HB       GLU  17   3.307  13.305   3.659
  118   1HG   GLU  17          2HG       GLU  17   3.179  16.022   2.429
  119   2HG   GLU  17          1HG       GLU  17   3.451  15.839   4.161
  120    H    MET  18           H        MET  18   0.990  12.017   3.220
  121    HA   MET  18           HA       MET  18   2.377   9.639   2.958
  122   1HB   MET  18          2HB       MET  18   0.260  10.381   4.402
  123   2HB   MET  18          1HB       MET  18  -0.591   9.496   3.137
  124   1HG   MET  18          2HG       MET  18  -0.267   7.828   4.644
  125   2HG   MET  18          1HG       MET  18   1.197   7.651   3.677
  126   1HE   MET  18          1HE       MET  18   0.254   6.954   6.939
  127   2HE   MET  18          2HE       MET  18   1.862   7.002   7.664
  128   3HE   MET  18          3HE       MET  18   1.609   6.163   6.133
  129    H    ILE  19           H        ILE  19   0.275  11.188   0.697
  130    HA   ILE  19           HA       ILE  19  -0.325   8.863  -0.863
  131    HB   ILE  19           HB       ILE  19  -0.601  11.820  -1.371
  132   1HG1  ILE  19          2HG1      ILE  19  -2.614   9.583  -1.036
  133   2HG1  ILE  19          1HG1      ILE  19  -2.195  10.792   0.182
  134   1HG2  ILE  19          1HG2      ILE  19  -1.950  11.043  -3.417
  135   2HG2  ILE  19          2HG2      ILE  19  -1.030   9.545  -3.276
  136   3HG2  ILE  19          3HG2      ILE  19  -0.190  11.075  -3.538
  137   1HD1  ILE  19          1HD1      ILE  19  -3.393  12.429  -0.840
  138   2HD1  ILE  19          2HD1      ILE  19  -4.330  11.024  -1.346
  139   3HD1  ILE  19          3HD1      ILE  19  -3.164  11.752  -2.452
  140    H    ALA  20           H        ALA  20   1.668  11.736  -1.530
  141    HA   ALA  20           HA       ALA  20   2.892  10.855  -3.842
  142   1HB   ALA  20          1HB       ALA  20   3.183  13.097  -3.346
  143   2HB   ALA  20          2HB       ALA  20   4.789  12.422  -3.067
  144   3HB   ALA  20          3HB       ALA  20   3.726  12.768  -1.701
  145    H    GLU  21           H        GLU  21   3.482   9.880  -0.571
  146    HA   GLU  21           HA       GLU  21   6.049   8.680  -1.186
  147   1HB   GLU  21          2HB       GLU  21   4.510   8.195   1.345
  148   2HB   GLU  21          1HB       GLU  21   6.249   8.195   1.096
  149   1HG   GLU  21          2HG       GLU  21   5.383  10.776   0.442
  150   2HG   GLU  21          1HG       GLU  21   4.522  10.329   1.914
  151    H    PHE  22           H        PHE  22   2.703   7.744  -0.739
  152    HA   PHE  22           HA       PHE  22   3.087   4.964  -0.575
  153   1HB   PHE  22          2HB       PHE  22   0.894   6.701  -0.577
  154   2HB   PHE  22          1HB       PHE  22   0.643   5.659  -1.973
  155    HD1  PHE  22           1HD      PHE  22   1.916   3.163  -0.934
  156    HD2  PHE  22           2HD      PHE  22  -0.749   5.929   0.897
  157    HE1  PHE  22           1HE      PHE  22   1.096   1.381   0.550
  158    HE2  PHE  22           2HE      PHE  22  -1.574   4.152   2.386
  159    HZ   PHE  22           HZ       PHE  22  -0.650   1.874   2.213
  160    H    LYS  23           H        LYS  23   2.899   7.181  -3.271
  161    HA   LYS  23           HA       LYS  23   2.719   5.185  -5.298
  162   1HB   LYS  23          2HB       LYS  23   2.126   7.682  -5.471
  163   2HB   LYS  23          1HB       LYS  23   3.857   7.948  -5.683
  164   1HG   LYS  23          2HG       LYS  23   2.948   7.869  -7.847
  165   2HG   LYS  23          1HG       LYS  23   3.737   6.309  -7.605
  166   1HD   LYS  23          2HD       LYS  23   1.768   5.530  -8.414
  167   2HD   LYS  23          1HD       LYS  23   1.279   5.700  -6.723
  168   1HE   LYS  23          2HE       LYS  23   0.992   8.147  -8.303
  169   2HE   LYS  23          1HE       LYS  23  -0.008   6.810  -8.869
  170   1HZ   LYS  23          1HZ       LYS  23  -0.785   8.455  -6.966
  171   2HZ   LYS  23          2HZ       LYS  23   0.014   7.321  -5.998
  172   3HZ   LYS  23          3HZ       LYS  23  -1.257   6.831  -7.000
  173    H    ALA  24           H        ALA  24   5.242   6.349  -3.320
  174    HA   ALA  24           HA       ALA  24   7.528   6.219  -4.819
  175   1HB   ALA  24          1HB       ALA  24   8.684   5.539  -2.756
  176   2HB   ALA  24          2HB       ALA  24   7.126   5.195  -2.013
  177   3HB   ALA  24          3HB       ALA  24   7.535   6.846  -2.479
  178    H    ALA  25           H        ALA  25   6.526   3.468  -2.804
  179    HA   ALA  25           HA       ALA  25   8.136   1.614  -4.195
  180   1HB   ALA  25          1HB       ALA  25   6.805  -0.086  -2.890
  181   2HB   ALA  25          2HB       ALA  25   5.892   1.270  -2.228
  182   3HB   ALA  25          3HB       ALA  25   7.628   1.153  -1.938
  183    H    PHE  26           H        PHE  26   5.187   2.991  -5.089
  184    HA   PHE  26           HA       PHE  26   3.710   0.971  -6.224
  185   1HB   PHE  26          2HB       PHE  26   3.451   3.627  -6.194
  186   2HB   PHE  26          1HB       PHE  26   4.048   3.445  -7.840
  187    HD1  PHE  26           1HD      PHE  26   2.703   2.440  -9.545
  188    HD2  PHE  26           2HD      PHE  26   1.311   2.655  -5.530
  189    HE1  PHE  26           1HE      PHE  26   0.437   1.852 -10.303
  190    HE2  PHE  26           2HE      PHE  26  -0.957   2.067  -6.280
  191    HZ   PHE  26           HZ       PHE  26  -1.396   1.664  -8.669
  192    H    ASP  27           H        ASP  27   6.748   2.287  -7.301
  193    HA   ASP  27           HA       ASP  27   6.628   1.147  -9.932
  194   1HB   ASP  27          2HB       ASP  27   8.982   2.221  -8.361
  195   2HB   ASP  27          1HB       ASP  27   9.008   1.802 -10.072
  196    H    MET  28           H        MET  28   8.715   0.446  -7.121
  197    HA   MET  28           HA       MET  28   9.726  -1.973  -8.131
  198   1HB   MET  28          2HB       MET  28   9.465  -0.955  -5.300
  199   2HB   MET  28          1HB       MET  28  10.317  -2.434  -5.721
  200   1HG   MET  28          2HG       MET  28  11.143  -0.083  -7.259
  201   2HG   MET  28          1HG       MET  28  11.451   0.024  -5.521
  202   1HE   MET  28          1HE       MET  28  14.430  -0.373  -7.586
  203   2HE   MET  28          2HE       MET  28  14.834  -0.746  -5.911
  204   3HE   MET  28          3HE       MET  28  13.637   0.497  -6.274
  205    H    PHE  29           H        PHE  29   6.785  -1.205  -6.434
  206    HA   PHE  29           HA       PHE  29   6.052  -3.690  -5.433
  207   1HB   PHE  29          2HB       PHE  29   4.588  -1.254  -6.311
  208   2HB   PHE  29          1HB       PHE  29   3.644  -2.733  -6.119
  209    HD1  PHE  29           1HD      PHE  29   4.862  -4.006  -3.815
  210    HD2  PHE  29           2HD      PHE  29   4.067   0.111  -4.533
  211    HE1  PHE  29           1HE      PHE  29   4.735  -3.609  -1.389
  212    HE2  PHE  29           2HE      PHE  29   3.940   0.515  -2.111
  213    HZ   PHE  29           HZ       PHE  29   4.274  -1.347  -0.535
  214    H    ASP  30           H        ASP  30   4.893  -2.286  -8.501
  215    HA   ASP  30           HA       ASP  30   3.886  -4.751  -9.470
  216   1HB   ASP  30          2HB       ASP  30   4.434  -2.085 -10.761
  217   2HB   ASP  30          1HB       ASP  30   3.852  -3.465 -11.697
  218    H    ALA  31           H        ALA  31   4.983  -6.407 -10.227
  219    HA   ALA  31           HA       ALA  31   7.770  -6.097 -10.994
  220   1HB   ALA  31          1HB       ALA  31   6.107  -8.603 -10.782
  221   2HB   ALA  31          2HB       ALA  31   7.104  -7.929  -9.492
  222   3HB   ALA  31          3HB       ALA  31   7.858  -8.519 -10.974
  223    H    ASP  32           H        ASP  32   4.790  -7.441 -12.401
  224    HA   ASP  32           HA       ASP  32   6.037  -7.587 -15.022
  225   1HB   ASP  32          2HB       ASP  32   3.877  -8.585 -15.725
  226   2HB   ASP  32          1HB       ASP  32   4.602  -9.433 -14.356
  227    H    GLY  33           H        GLY  33   3.839  -5.563 -13.243
  228   1HA   GLY  33          2HA       GLY  33   2.993  -3.482 -13.737
  229   2HA   GLY  33          1HA       GLY  33   4.043  -3.462 -15.147
  230    H    GLY  34           H        GLY  34   0.867  -4.197 -13.932
  231   1HA   GLY  34          2HA       GLY  34  -0.593  -3.549 -16.112
  232   2HA   GLY  34          1HA       GLY  34  -0.099  -5.203 -16.467
  233    H    GLY  35           H        GLY  35  -0.156  -5.880 -13.558
  234   1HA   GLY  35          2HA       GLY  35  -3.075  -6.242 -13.385
  235   2HA   GLY  35          1HA       GLY  35  -1.872  -7.302 -12.652
  236    H    ASP  36           H        ASP  36  -1.462  -7.041 -10.556
  237    HA   ASP  36           HA       ASP  36  -1.769  -4.435  -9.303
  238   1HB   ASP  36          2HB       ASP  36  -3.525  -6.795  -8.721
  239   2HB   ASP  36          1HB       ASP  36  -3.138  -5.647  -7.435
  240    H    ILE  37           H        ILE  37  -1.468  -4.943  -6.730
  241    HA   ILE  37           HA       ILE  37   1.164  -6.178  -6.603
  242    HB   ILE  37           HB       ILE  37  -0.368  -4.517  -4.604
  243   1HG1  ILE  37          2HG1      ILE  37   2.066  -3.927  -6.303
  244   2HG1  ILE  37          1HG1      ILE  37   0.446  -3.266  -6.538
  245   1HG2  ILE  37          1HG2      ILE  37   2.314  -4.585  -3.852
  246   2HG2  ILE  37          2HG2      ILE  37   1.892  -6.261  -4.208
  247   3HG2  ILE  37          3HG2      ILE  37   0.952  -5.346  -3.028
  248   1HD1  ILE  37          1HD1      ILE  37   2.015  -1.699  -5.461
  249   2HD1  ILE  37          2HD1      ILE  37   2.136  -2.808  -4.095
  250   3HD1  ILE  37          3HD1      ILE  37   0.592  -2.048  -4.480
  251    H    SER  38           H        SER  38   1.381  -8.224  -6.029
  252    HA   SER  38           HA       SER  38  -0.742  -9.538  -4.508
  253   1HB   SER  38          2HB       SER  38   0.498 -10.407  -6.710
  254   2HB   SER  38          1HB       SER  38   1.619 -11.059  -5.508
  255    HG   SER  38           HG       SER  38  -1.189 -11.495  -5.566
  256    H    THR  39           H        THR  39   0.736 -11.611  -3.366
  257    HA   THR  39           HA       THR  39   1.621 -10.380  -0.969
  258    HB   THR  39           HB       THR  39   2.503 -12.859  -0.611
  259    HG1  THR  39           1HG      THR  39   2.198 -13.458  -2.793
  260   1HG2  THR  39          1HG2      THR  39  -0.429 -12.214  -0.786
  261   2HG2  THR  39          2HG2      THR  39   0.617 -11.936   0.607
  262   3HG2  THR  39          3HG2      THR  39   0.282 -13.582   0.068
  263    H    LYS  40           H        LYS  40   3.337 -12.024  -3.605
  264    HA   LYS  40           HA       LYS  40   5.917 -11.753  -2.469
  265   1HB   LYS  40          2HB       LYS  40   5.403 -13.409  -4.204
  266   2HB   LYS  40          1HB       LYS  40   5.109 -12.112  -5.361
  267   1HG   LYS  40          2HG       LYS  40   7.606 -11.483  -4.562
  268   2HG   LYS  40          1HG       LYS  40   7.642 -13.243  -4.381
  269   1HD   LYS  40          2HD       LYS  40   6.577 -13.230  -6.760
  270   2HD   LYS  40          1HD       LYS  40   7.231 -11.593  -6.843
  271   1HE   LYS  40          2HE       LYS  40   8.973 -12.809  -7.718
  272   2HE   LYS  40          1HE       LYS  40   9.426 -12.746  -6.015
  273   1HZ   LYS  40          1HZ       LYS  40   9.699 -14.966  -6.676
  274   2HZ   LYS  40          2HZ       LYS  40   8.219 -15.009  -7.494
  275   3HZ   LYS  40          3HZ       LYS  40   8.248 -14.949  -5.804
  276    H    GLU  41           H        GLU  41   3.923  -9.651  -4.405
  277    HA   GLU  41           HA       GLU  41   5.986  -7.891  -5.255
  278   1HB   GLU  41          2HB       GLU  41   2.994  -7.646  -5.075
  279   2HB   GLU  41          1HB       GLU  41   3.995  -6.294  -5.586
  280   1HG   GLU  41          2HG       GLU  41   4.957  -7.896  -7.327
  281   2HG   GLU  41          1HG       GLU  41   3.590  -8.939  -6.936
  282    H    LEU  42           H        LEU  42   4.163  -8.204  -2.319
  283    HA   LEU  42           HA       LEU  42   4.796  -5.544  -1.391
  284   1HB   LEU  42          2HB       LEU  42   2.871  -7.432  -0.746
  285   2HB   LEU  42          1HB       LEU  42   3.937  -7.429   0.655
  286    HG   LEU  42           HG       LEU  42   2.164  -5.878   1.068
  287   1HD1  LEU  42          1HD1      LEU  42   4.767  -4.540   0.369
  288   2HD1  LEU  42          2HD1      LEU  42   4.222  -5.109   1.948
  289   3HD1  LEU  42          3HD1      LEU  42   3.449  -3.713   1.199
  290   1HD2  LEU  42          1HD2      LEU  42   2.776  -4.944  -1.701
  291   2HD2  LEU  42          2HD2      LEU  42   2.070  -3.823  -0.535
  292   3HD2  LEU  42          3HD2      LEU  42   1.220  -5.311  -0.956
  293    H    GLY  43           H        GLY  43   5.633  -8.836  -0.281
  294   1HA   GLY  43          2HA       GLY  43   7.488  -8.140   1.657
  295   2HA   GLY  43          1HA       GLY  43   7.534  -9.638   0.731
  296    H    THR  44           H        THR  44   7.829  -8.063  -1.799
  297    HA   THR  44           HA       THR  44  10.603  -8.186  -2.049
  298    HB   THR  44           HB       THR  44   8.393  -6.994  -3.672
  299    HG1  THR  44           1HG      THR  44   9.213  -8.506  -5.171
  300   1HG2  THR  44          1HG2      THR  44  11.283  -6.383  -4.058
  301   2HG2  THR  44          2HG2      THR  44   9.871  -5.354  -4.295
  302   3HG2  THR  44          3HG2      THR  44  10.241  -6.627  -5.461
  303    H    VAL  45           H        VAL  45   8.883  -5.140  -2.569
  304    HA   VAL  45           HA       VAL  45  11.032  -3.479  -2.029
  305    HB   VAL  45           HB       VAL  45   9.153  -2.600  -3.194
  306   1HG1  VAL  45          1HG1      VAL  45   7.320  -3.825  -2.458
  307   2HG1  VAL  45          2HG1      VAL  45   6.989  -2.196  -1.867
  308   3HG1  VAL  45          3HG1      VAL  45   7.607  -3.425  -0.763
  309   1HG2  VAL  45          1HG2      VAL  45   9.305  -1.274  -0.486
  310   2HG2  VAL  45          2HG2      VAL  45   8.675  -0.541  -1.961
  311   3HG2  VAL  45          3HG2      VAL  45  10.380  -0.971  -1.851
  312    H    MET  46           H        MET  46   8.853  -5.042   0.190
  313    HA   MET  46           HA       MET  46   9.498  -3.322   2.402
  314   1HB   MET  46          2HB       MET  46   7.834  -5.758   2.001
  315   2HB   MET  46          1HB       MET  46   8.394  -5.412   3.638
  316   1HG   MET  46          2HG       MET  46   6.772  -3.583   1.877
  317   2HG   MET  46          1HG       MET  46   6.188  -4.493   3.275
  318   1HE   MET  46          1HE       MET  46   5.218  -1.881   4.018
  319   2HE   MET  46          2HE       MET  46   6.065  -1.573   5.534
  320   3HE   MET  46          3HE       MET  46   5.530  -3.208   5.142
  321    H    ARG  47           H        ARG  47  10.721  -6.316   1.093
  322    HA   ARG  47           HA       ARG  47  12.309  -6.872   3.458
  323   1HB   ARG  47          2HB       ARG  47  11.979  -8.254   0.805
  324   2HB   ARG  47          1HB       ARG  47  13.220  -8.740   1.952
  325   1HG   ARG  47          2HG       ARG  47  11.614  -9.370   3.568
  326   2HG   ARG  47          1HG       ARG  47  10.306  -8.599   2.670
  327   1HD   ARG  47          2HD       ARG  47  10.505 -10.224   0.898
  328   2HD   ARG  47          1HD       ARG  47  11.921 -10.944   1.673
  329    HE   ARG  47           HE       ARG  47   9.573 -10.948   3.331
  330   1HH1  ARG  47          1HH1      ARG  47  11.311 -12.662   0.835
  331   2HH1  ARG  47          2HH1      ARG  47  10.605 -14.196   1.224
  332   1HH2  ARG  47          1HH2      ARG  47   8.645 -12.963   3.842
  333   2HH2  ARG  47          2HH2      ARG  47   9.091 -14.366   2.930
  334    H    MET  48           H        MET  48  12.705  -5.331   0.368
  335    HA   MET  48           HA       MET  48  15.607  -5.367   0.563
  336   1HB   MET  48          2HB       MET  48  15.552  -4.172  -1.590
  337   2HB   MET  48          1HB       MET  48  14.622  -5.670  -1.638
  338   1HG   MET  48          2HG       MET  48  12.682  -4.606  -1.999
  339   2HG   MET  48          1HG       MET  48  13.088  -3.276  -0.916
  340   1HE   MET  48          1HE       MET  48  12.946  -0.650  -3.313
  341   2HE   MET  48          2HE       MET  48  12.269  -1.517  -1.936
  342   3HE   MET  48          3HE       MET  48  11.697  -1.870  -3.565
  343    H    LEU  49           H        LEU  49  13.073  -3.431   1.674
  344    HA   LEU  49           HA       LEU  49  14.652  -0.978   1.649
  345   1HB   LEU  49          2HB       LEU  49  11.802  -1.629   2.310
  346   2HB   LEU  49          1HB       LEU  49  12.510  -0.111   2.829
  347    HG   LEU  49           HG       LEU  49  12.315  -1.051  -0.032
  348   1HD1  LEU  49          1HD1      LEU  49  10.795   1.172   1.308
  349   2HD1  LEU  49          2HD1      LEU  49  10.153  -0.458   1.107
  350   3HD1  LEU  49          3HD1      LEU  49  10.555   0.514  -0.309
  351   1HD2  LEU  49          1HD2      LEU  49  13.582   1.293   1.291
  352   2HD2  LEU  49          2HD2      LEU  49  12.802   1.528  -0.273
  353   3HD2  LEU  49          3HD2      LEU  49  14.113   0.359  -0.108
  354    H    GLY  50           H        GLY  50  12.999  -3.071   4.015
  355   1HA   GLY  50          2HA       GLY  50  15.010  -3.161   5.894
  356   2HA   GLY  50          1HA       GLY  50  14.102  -1.698   6.269
  357    H    GLN  51           H        GLN  51  11.562  -2.887   5.352
  358    HA   GLN  51           HA       GLN  51  10.735  -3.990   7.828
  359   1HB   GLN  51          2HB       GLN  51   9.443  -2.788   5.769
  360   2HB   GLN  51          1HB       GLN  51   9.026  -4.474   5.462
  361   1HG   GLN  51          2HG       GLN  51   7.297  -3.878   6.810
  362   2HG   GLN  51          1HG       GLN  51   8.441  -4.445   8.027
  363   1HE2  GLN  51          1HE2      GLN  51   6.355  -2.708   8.606
  364   2HE2  GLN  51          2HE2      GLN  51   7.011  -1.175   9.055
  365    H    ASN  52           H        ASN  52   9.642  -6.110   8.064
  366    HA   ASN  52           HA       ASN  52  10.607  -8.182   6.252
  367   1HB   ASN  52          2HB       ASN  52  11.505  -9.538   8.080
  368   2HB   ASN  52          1HB       ASN  52  12.351  -7.994   7.959
  369   1HD2  ASN  52          1HD2      ASN  52  11.025 -10.135  10.053
  370   2HD2  ASN  52          2HD2      ASN  52  10.737  -9.089  11.398
  371    HA   PRO  53           HA       PRO  53   6.281  -8.748   8.090
  372   1HB   PRO  53          2HB       PRO  53   4.918  -8.571   5.746
  373   2HB   PRO  53          1HB       PRO  53   5.259  -7.169   6.765
  374   1HG   PRO  53          2HG       PRO  53   6.702  -8.127   4.320
  375   2HG   PRO  53          1HG       PRO  53   6.226  -6.476   4.761
  376   1HD   PRO  53          2HD       PRO  53   8.744  -7.382   5.111
  377   2HD   PRO  53          1HD       PRO  53   7.991  -6.222   6.230
  378    H    THR  54           H        THR  54   6.453 -10.888   8.521
  379    HA   THR  54           HA       THR  54   7.375 -12.903   6.876
  380    HB   THR  54           HB       THR  54   6.065 -14.453   8.346
  381    HG1  THR  54           1HG      THR  54   5.199 -12.066   9.601
  382   1HG2  THR  54          1HG2      THR  54   8.175 -12.768   9.095
  383   2HG2  THR  54          2HG2      THR  54   7.706 -14.309   9.812
  384   3HG2  THR  54          3HG2      THR  54   7.052 -12.803  10.453
  385    H    LYS  55           H        LYS  55   5.975 -14.831   6.152
  386    HA   LYS  55           HA       LYS  55   4.441 -14.076   3.965
  387   1HB   LYS  55          2HB       LYS  55   5.273 -16.515   5.192
  388   2HB   LYS  55          1HB       LYS  55   3.554 -16.647   4.821
  389   1HG   LYS  55          2HG       LYS  55   4.759 -15.496   2.560
  390   2HG   LYS  55          1HG       LYS  55   5.812 -16.818   3.068
  391   1HD   LYS  55          2HD       LYS  55   4.305 -18.397   2.509
  392   2HD   LYS  55          1HD       LYS  55   2.943 -17.446   3.103
  393   1HE   LYS  55          2HE       LYS  55   2.523 -16.556   1.080
  394   2HE   LYS  55          1HE       LYS  55   4.234 -16.370   0.697
  395   1HZ   LYS  55          1HZ       LYS  55   2.766 -18.949   0.598
  396   2HZ   LYS  55          2HZ       LYS  55   4.356 -18.671   0.097
  397   3HZ   LYS  55          3HZ       LYS  55   3.071 -17.970  -0.749
  398    H    CYS  56           H        CYS  56   3.260 -15.442   7.046
  399    HA   CYS  56           HA       CYS  56   0.534 -15.122   6.515
  400   1HB   CYS  56          2HB       CYS  56   1.933 -16.253   8.528
  401   2HB   CYS  56          1HB       CYS  56   1.414 -14.766   9.325
  402    HG   CYS  56           HG       CYS  56  -0.276 -16.976   9.414
  403    H    GLU  57           H        GLU  57   2.941 -12.879   7.677
  404    HA   GLU  57           HA       GLU  57   1.300 -10.877   8.719
  405   1HB   GLU  57          2HB       GLU  57   4.029 -11.218   8.217
  406   2HB   GLU  57          1HB       GLU  57   3.579  -9.789   7.286
  407   1HG   GLU  57          2HG       GLU  57   2.962  -8.601   9.174
  408   2HG   GLU  57          1HG       GLU  57   2.747 -10.056  10.144
  409    H    LEU  58           H        LEU  58   2.839 -10.882   5.506
  410    HA   LEU  58           HA       LEU  58   1.330  -8.761   4.471
  411   1HB   LEU  58          2HB       LEU  58   2.507 -11.017   2.852
  412   2HB   LEU  58          1HB       LEU  58   2.199  -9.366   2.327
  413    HG   LEU  58           HG       LEU  58   4.114  -9.841   4.575
  414   1HD1  LEU  58          1HD1      LEU  58   4.562 -10.470   1.691
  415   2HD1  LEU  58          2HD1      LEU  58   5.098 -11.341   3.128
  416   3HD1  LEU  58          3HD1      LEU  58   5.881  -9.827   2.671
  417   1HD2  LEU  58          1HD2      LEU  58   5.173  -7.898   3.090
  418   2HD2  LEU  58          2HD2      LEU  58   3.935  -7.594   4.309
  419   3HD2  LEU  58          3HD2      LEU  58   3.486  -7.718   2.608
  420    H    ASP  59           H        ASP  59   0.669 -12.178   4.711
  421    HA   ASP  59           HA       ASP  59  -1.527 -12.203   2.882
  422   1HB   ASP  59          2HB       ASP  59  -0.067 -14.120   4.373
  423   2HB   ASP  59          1HB       ASP  59  -1.757 -14.274   4.861
  424    H    ALA  60           H        ALA  60  -1.120 -11.384   6.222
  425    HA   ALA  60           HA       ALA  60  -3.893 -11.591   6.893
  426   1HB   ALA  60          1HB       ALA  60  -1.425 -10.723   8.255
  427   2HB   ALA  60          2HB       ALA  60  -2.748 -11.732   8.838
  428   3HB   ALA  60          3HB       ALA  60  -2.922  -9.977   8.817
  429    H    ILE  61           H        ILE  61  -1.786  -9.138   5.597
  430    HA   ILE  61           HA       ILE  61  -3.647  -6.983   6.010
  431    HB   ILE  61           HB       ILE  61  -1.021  -7.225   4.561
  432   1HG1  ILE  61          2HG1      ILE  61  -0.637  -5.224   6.230
  433   2HG1  ILE  61          1HG1      ILE  61  -2.034  -5.919   7.058
  434   1HG2  ILE  61          1HG2      ILE  61  -1.223  -4.745   4.154
  435   2HG2  ILE  61          2HG2      ILE  61  -2.944  -4.918   4.494
  436   3HG2  ILE  61          3HG2      ILE  61  -2.224  -5.778   3.135
  437   1HD1  ILE  61          1HD1      ILE  61   0.337  -7.595   6.328
  438   2HD1  ILE  61          2HD1      ILE  61  -0.906  -7.895   7.543
  439   3HD1  ILE  61          3HD1      ILE  61   0.301  -6.635   7.807
  440    H    ILE  62           H        ILE  62  -2.281  -8.514   3.079
  441    HA   ILE  62           HA       ILE  62  -3.850  -7.405   1.144
  442    HB   ILE  62           HB       ILE  62  -2.942 -10.279   1.318
  443   1HG1  ILE  62          2HG1      ILE  62  -1.781  -7.820  -0.011
  444   2HG1  ILE  62          1HG1      ILE  62  -1.103  -8.701   1.360
  445   1HG2  ILE  62          1HG2      ILE  62  -3.185  -9.506  -1.369
  446   2HG2  ILE  62          2HG2      ILE  62  -4.685  -9.017  -0.584
  447   3HG2  ILE  62          3HG2      ILE  62  -4.152 -10.695  -0.498
  448   1HD1  ILE  62          1HD1      ILE  62  -0.079 -10.151   0.030
  449   2HD1  ILE  62          2HD1      ILE  62  -0.453  -9.042  -1.288
  450   3HD1  ILE  62          3HD1      ILE  62  -1.523 -10.402  -0.950
  451    H    CYS  63           H        CYS  63  -4.676 -10.243   3.126
  452    HA   CYS  63           HA       CYS  63  -7.126 -10.875   1.994
  453   1HB   CYS  63          2HB       CYS  63  -5.760 -12.032   3.904
  454   2HB   CYS  63          1HB       CYS  63  -6.737 -11.019   4.970
  455    HG   CYS  63           HG       CYS  63  -8.581 -12.510   3.172
  456    H    GLU  64           H        GLU  64  -6.291  -8.405   4.349
  457    HA   GLU  64           HA       GLU  64  -9.047  -7.595   4.714
  458   1HB   GLU  64          2HB       GLU  64  -6.428  -6.886   5.895
  459   2HB   GLU  64          1HB       GLU  64  -7.606  -5.583   5.823
  460   1HG   GLU  64          2HG       GLU  64  -9.223  -7.049   6.997
  461   2HG   GLU  64          1HG       GLU  64  -7.947  -8.253   7.165
  462    H    VAL  65           H        VAL  65  -6.221  -6.634   2.896
  463    HA   VAL  65           HA       VAL  65  -7.110  -4.096   2.035
  464    HB   VAL  65           HB       VAL  65  -5.246  -6.038   0.651
  465   1HG1  VAL  65          1HG1      VAL  65  -4.380  -3.940  -0.449
  466   2HG1  VAL  65          2HG1      VAL  65  -5.834  -3.133   0.137
  467   3HG1  VAL  65          3HG1      VAL  65  -5.969  -4.488  -0.984
  468   1HG2  VAL  65          1HG2      VAL  65  -4.848  -3.971   2.764
  469   2HG2  VAL  65          2HG2      VAL  65  -3.561  -4.261   1.593
  470   3HG2  VAL  65          3HG2      VAL  65  -4.141  -5.576   2.610
  471    H    ASP  66           H        ASP  66  -7.568  -7.358   0.817
  472    HA   ASP  66           HA       ASP  66  -9.069  -6.404  -1.487
  473   1HB   ASP  66          2HB       ASP  66  -8.086  -9.105  -0.595
  474   2HB   ASP  66          1HB       ASP  66  -9.261  -8.944  -1.898
  475    H    GLU  67           H        GLU  67 -11.135  -5.903  -1.206
  476    HA   GLU  67           HA       GLU  67 -12.695  -7.315   0.832
  477   1HB   GLU  67          2HB       GLU  67 -12.973  -4.685  -0.569
  478   2HB   GLU  67          1HB       GLU  67 -14.413  -5.461   0.089
  479   1HG   GLU  67          2HG       GLU  67 -11.935  -4.827   1.678
  480   2HG   GLU  67          1HG       GLU  67 -13.379  -3.810   1.611
  481    H    ASP  68           H        ASP  68 -11.932  -8.449  -1.802
  482    HA   ASP  68           HA       ASP  68 -14.594  -9.329  -2.578
  483   1HB   ASP  68          2HB       ASP  68 -14.196  -8.954  -4.963
  484   2HB   ASP  68          1HB       ASP  68 -14.135  -7.433  -4.078
  485    H    GLY  69           H        GLY  69 -12.027 -10.379  -1.325
  486   1HA   GLY  69          2HA       GLY  69 -10.763 -12.295  -1.378
  487   2HA   GLY  69          1HA       GLY  69 -12.133 -12.992  -2.229
  488    H    SER  70           H        SER  70  -9.706 -10.533  -3.106
  489    HA   SER  70           HA       SER  70  -9.153 -12.108  -5.532
  490   1HB   SER  70          2HB       SER  70  -8.210  -9.683  -6.209
  491   2HB   SER  70          1HB       SER  70  -9.892 -10.161  -6.468
  492    HG   SER  70           HG       SER  70  -9.168  -8.096  -5.178
  493    H    GLY  71           H        GLY  71  -7.775 -10.605  -2.724
  494   1HA   GLY  71          2HA       GLY  71  -5.658 -10.705  -1.835
  495   2HA   GLY  71          1HA       GLY  71  -5.347 -12.028  -2.958
  496    H    THR  72           H        THR  72  -6.368  -9.116  -4.424
  497    HA   THR  72           HA       THR  72  -3.580  -8.403  -5.044
  498    HB   THR  72           HB       THR  72  -4.295  -7.836  -7.323
  499    HG1  THR  72           1HG      THR  72  -6.501  -7.426  -6.842
  500   1HG2  THR  72          1HG2      THR  72  -4.714 -10.055  -8.210
  501   2HG2  THR  72          2HG2      THR  72  -5.093 -10.641  -6.591
  502   3HG2  THR  72          3HG2      THR  72  -3.459 -10.094  -6.971
  503    H    ILE  73           H        ILE  73  -3.076  -6.261  -5.084
  504    HA   ILE  73           HA       ILE  73  -5.100  -4.448  -4.009
  505    HB   ILE  73           HB       ILE  73  -2.152  -3.931  -4.374
  506   1HG1  ILE  73          2HG1      ILE  73  -3.645  -4.984  -1.956
  507   2HG1  ILE  73          1HG1      ILE  73  -2.460  -5.869  -2.920
  508   1HG2  ILE  73          1HG2      ILE  73  -2.446  -1.968  -3.284
  509   2HG2  ILE  73          2HG2      ILE  73  -3.747  -2.597  -2.273
  510   3HG2  ILE  73          3HG2      ILE  73  -4.077  -2.117  -3.938
  511   1HD1  ILE  73          1HD1      ILE  73  -0.683  -4.620  -2.095
  512   2HD1  ILE  73          2HD1      ILE  73  -1.715  -4.874  -0.688
  513   3HD1  ILE  73          3HD1      ILE  73  -1.734  -3.322  -1.526
  514    H    ASP  74           H        ASP  74  -6.222  -3.250  -5.386
  515    HA   ASP  74           HA       ASP  74  -5.490  -2.871  -8.100
  516   1HB   ASP  74          2HB       ASP  74  -7.830  -2.707  -6.725
  517   2HB   ASP  74          1HB       ASP  74  -7.459  -0.995  -6.949
  518    H    PHE  75           H        PHE  75  -6.098  -0.243  -8.669
  519    HA   PHE  75           HA       PHE  75  -3.634   1.026  -8.397
  520   1HB   PHE  75          2HB       PHE  75  -6.368   2.092  -9.101
  521   2HB   PHE  75          1HB       PHE  75  -4.923   3.107  -9.118
  522    HD1  PHE  75           1HD      PHE  75  -3.027   2.478 -10.646
  523    HD2  PHE  75           2HD      PHE  75  -6.878   0.683 -10.896
  524    HE1  PHE  75           1HE      PHE  75  -2.519   1.717 -12.930
  525    HE2  PHE  75           2HE      PHE  75  -6.377  -0.080 -13.181
  526    HZ   PHE  75           HZ       PHE  75  -4.196   0.436 -14.201
  527    H    GLU  76           H        GLU  76  -6.504   2.704  -7.185
  528    HA   GLU  76           HA       GLU  76  -5.033   3.990  -5.137
  529   1HB   GLU  76          2HB       GLU  76  -7.389   4.612  -4.296
  530   2HB   GLU  76          1HB       GLU  76  -6.883   5.205  -5.874
  531   1HG   GLU  76          2HG       GLU  76  -8.278   2.618  -5.890
  532   2HG   GLU  76          1HG       GLU  76  -9.242   4.003  -5.380
  533    H    GLU  77           H        GLU  77  -6.400   0.888  -5.302
  534    HA   GLU  77           HA       GLU  77  -7.271   0.452  -2.695
  535   1HB   GLU  77          2HB       GLU  77  -6.609  -1.157  -4.992
  536   2HB   GLU  77          1HB       GLU  77  -6.016  -1.927  -3.526
  537   1HG   GLU  77          2HG       GLU  77  -8.263  -1.740  -2.544
  538   2HG   GLU  77          1HG       GLU  77  -8.843  -1.039  -4.061
  539    H    PHE  78           H        PHE  78  -4.082   0.952  -3.891
  540    HA   PHE  78           HA       PHE  78  -2.665  -0.398  -1.832
  541   1HB   PHE  78          2HB       PHE  78  -0.707   0.605  -2.688
  542   2HB   PHE  78          1HB       PHE  78  -1.744   0.338  -4.088
  543    HD1  PHE  78           1HD      PHE  78   0.636   2.380  -3.261
  544    HD2  PHE  78           2HD      PHE  78  -3.558   2.665  -3.929
  545    HE1  PHE  78           1HE      PHE  78   0.897   4.742  -3.896
  546    HE2  PHE  78           2HE      PHE  78  -3.299   5.023  -4.569
  547    HZ   PHE  78           HZ       PHE  78  -1.070   6.066  -4.550
  548    H    LEU  79           H        LEU  79  -4.596   2.332  -1.706
  549    HA   LEU  79           HA       LEU  79  -3.095   3.544   0.497
  550   1HB   LEU  79          2HB       LEU  79  -5.657   4.435  -0.835
  551   2HB   LEU  79          1HB       LEU  79  -4.777   5.331   0.388
  552    HG   LEU  79           HG       LEU  79  -3.068   4.700  -1.862
  553   1HD1  LEU  79          1HD1      LEU  79  -4.850   4.759  -3.340
  554   2HD1  LEU  79          2HD1      LEU  79  -4.291   6.432  -3.336
  555   3HD1  LEU  79          3HD1      LEU  79  -5.718   5.977  -2.405
  556   1HD2  LEU  79          1HD2      LEU  79  -2.303   6.815  -1.512
  557   2HD2  LEU  79          2HD2      LEU  79  -3.058   6.530   0.056
  558   3HD2  LEU  79          3HD2      LEU  79  -3.909   7.462  -1.176
  559    H    VAL  80           H        VAL  80  -6.270   2.152  -0.242
  560    HA   VAL  80           HA       VAL  80  -7.394   2.307   2.310
  561    HB   VAL  80           HB       VAL  80  -7.887   0.089   0.325
  562   1HG1  VAL  80          1HG1      VAL  80 -10.232   0.348   1.372
  563   2HG1  VAL  80          2HG1      VAL  80  -9.386   1.179   2.678
  564   3HG1  VAL  80          3HG1      VAL  80  -8.983  -0.495   2.290
  565   1HG2  VAL  80          1HG2      VAL  80  -9.729   2.363   0.347
  566   2HG2  VAL  80          2HG2      VAL  80  -9.060   1.456  -1.009
  567   3HG2  VAL  80          3HG2      VAL  80  -8.116   2.740  -0.256
  568    H    MET  81           H        MET  81  -5.236  -0.049   0.867
  569    HA   MET  81           HA       MET  81  -5.395  -2.156   2.612
  570   1HB   MET  81          2HB       MET  81  -2.813  -2.281   2.186
  571   2HB   MET  81          1HB       MET  81  -3.935  -2.535   0.862
  572   1HG   MET  81          2HG       MET  81  -3.384  -0.613  -0.171
  573   2HG   MET  81          1HG       MET  81  -2.982   0.220   1.334
  574   1HE   MET  81          1HE       MET  81  -1.071  -0.372   2.774
  575   2HE   MET  81          2HE       MET  81   0.488  -0.998   2.229
  576   3HE   MET  81          3HE       MET  81  -0.837  -2.111   2.592
  577    H    MET  82           H        MET  82  -3.684   0.878   2.997
  578    HA   MET  82           HA       MET  82  -2.771   0.124   5.653
  579   1HB   MET  82          2HB       MET  82  -1.960   2.048   3.624
  580   2HB   MET  82          1HB       MET  82  -2.014   2.747   5.245
  581   1HG   MET  82          2HG       MET  82  -0.754   0.413   5.757
  582   2HG   MET  82          1HG       MET  82  -0.200   0.730   4.114
  583   1HE   MET  82          1HE       MET  82  -0.533   3.740   4.093
  584   2HE   MET  82          2HE       MET  82   1.077   3.303   3.521
  585   3HE   MET  82          3HE       MET  82   0.888   4.544   4.761
  586    H    VAL  83           H        VAL  83  -5.174   2.128   4.100
  587    HA   VAL  83           HA       VAL  83  -5.805   3.837   6.237
  588    HB   VAL  83           HB       VAL  83  -7.666   2.726   4.127
  589   1HG1  VAL  83          1HG1      VAL  83  -8.682   5.140   4.723
  590   2HG1  VAL  83          2HG1      VAL  83  -8.040   4.682   6.303
  591   3HG1  VAL  83          3HG1      VAL  83  -9.212   3.643   5.489
  592   1HG2  VAL  83          1HG2      VAL  83  -7.067   5.388   3.562
  593   2HG2  VAL  83          2HG2      VAL  83  -6.483   3.964   2.703
  594   3HG2  VAL  83          3HG2      VAL  83  -5.523   4.660   4.009
  595    H    ARG  84           H        ARG  84  -6.895   0.578   5.429
  596    HA   ARG  84           HA       ARG  84  -8.821   0.383   7.512
  597   1HB   ARG  84          2HB       ARG  84  -7.370  -1.828   6.044
  598   2HB   ARG  84          1HB       ARG  84  -8.832  -2.012   7.004
  599   1HG   ARG  84          2HG       ARG  84  -9.671  -0.135   5.288
  600   2HG   ARG  84          1HG       ARG  84  -8.471  -0.950   4.276
  601   1HD   ARG  84          2HD       ARG  84  -9.684  -2.854   4.143
  602   2HD   ARG  84          1HD       ARG  84 -10.297  -2.706   5.788
  603    HE   ARG  84           HE       ARG  84 -11.557  -1.787   3.387
  604   1HH1  ARG  84          1HH1      ARG  84 -11.260  -1.227   6.819
  605   2HH1  ARG  84          2HH1      ARG  84 -12.806  -0.459   6.953
  606   1HH2  ARG  84          1HH2      ARG  84 -13.591  -0.778   3.563
  607   2HH2  ARG  84          2HH2      ARG  84 -14.129  -0.205   5.106
  608    H    GLN  85           H        GLN  85  -5.391   0.068   7.395
  609    HA   GLN  85           HA       GLN  85  -5.353  -1.198  10.047
  610   1HB   GLN  85          2HB       GLN  85  -2.912  -0.739   8.355
  611   2HB   GLN  85          1HB       GLN  85  -3.172  -1.941   9.618
  612   1HG   GLN  85          2HG       GLN  85  -4.537  -1.944   6.933
  613   2HG   GLN  85          1HG       GLN  85  -3.104  -2.895   7.344
  614   1HE2  GLN  85          1HE2      GLN  85  -4.353  -4.757   6.798
  615   2HE2  GLN  85          2HE2      GLN  85  -5.476  -5.418   7.932
  616    H    MET  86           H        MET  86  -5.730   1.747   9.066
  617    HA   MET  86           HA       MET  86  -3.685   2.931  10.821
  618   1HB   MET  86          2HB       MET  86  -4.920   3.800   8.268
  619   2HB   MET  86          1HB       MET  86  -4.615   5.062   9.463
  620   1HG   MET  86          2HG       MET  86  -2.241   4.055   9.581
  621   2HG   MET  86          1HG       MET  86  -2.667   3.288   8.046
  622   1HE   MET  86          1HE       MET  86  -1.243   4.081   6.504
  623   2HE   MET  86          2HE       MET  86  -1.108   5.717   5.859
  624   3HE   MET  86          3HE       MET  86  -2.589   4.791   5.610
  625    H    LYS  87           H        LYS  87  -7.095   3.085   9.859
  626    HA   LYS  87           HA       LYS  87  -7.973   5.017  11.655
  627   1HB   LYS  87          2HB       LYS  87  -9.393   2.594  10.543
  628   2HB   LYS  87          1HB       LYS  87 -10.203   3.851  11.479
  629   1HG   LYS  87          2HG       LYS  87 -10.347   5.201   9.720
  630   2HG   LYS  87          1HG       LYS  87  -8.648   4.955   9.295
  631   1HD   LYS  87          2HD       LYS  87  -9.272   3.695   7.576
  632   2HD   LYS  87          1HD       LYS  87 -10.031   2.556   8.690
  633   1HE   LYS  87          2HE       LYS  87 -11.599   3.367   6.981
  634   2HE   LYS  87          1HE       LYS  87 -12.101   3.813   8.612
  635   1HZ   LYS  87          1HZ       LYS  87 -10.566   5.656   6.878
  636   2HZ   LYS  87          2HZ       LYS  87 -11.450   6.024   8.272
  637   3HZ   LYS  87          3HZ       LYS  87 -12.258   5.593   6.849
  638    H    GLU  88           H        GLU  88  -8.445   1.507  12.092
  639    HA   GLU  88           HA       GLU  88  -7.377   1.375  14.681
  640   1HB   GLU  88          2HB       GLU  88  -9.499   1.140  15.973
  641   2HB   GLU  88          1HB       GLU  88  -9.196   2.772  15.394
  642   1HG   GLU  88          2HG       GLU  88 -10.684   1.596  13.373
  643   2HG   GLU  88          1HG       GLU  88 -11.415   0.999  14.863
  644    H    ASP  89           H        ASP  89  -8.230  -0.665  15.861
  645    HA   ASP  89           HA       ASP  89  -8.590  -2.750  13.819
  646   1HB   ASP  89          2HB       ASP  89  -6.597  -2.570  15.623
  647   2HB   ASP  89          1HB       ASP  89  -7.764  -3.498  16.569
  648    H    ALA  90           H        ALA  90 -10.764  -1.182  14.978
  649    HA   ALA  90           HA       ALA  90 -12.402  -3.417  15.871
  650   1HB   ALA  90          1HB       ALA  90 -11.341  -1.902  17.814
  651   2HB   ALA  90          2HB       ALA  90 -12.928  -2.660  17.935
  652   3HB   ALA  90          3HB       ALA  90 -12.794  -0.965  17.468
  653   2H    ARG 115          HN2       ARG 115   2.383  -3.969   8.667
  654    H    ARG 115           H        ARG 115   2.844  -2.317   8.710
  655   3H    ARG 115          HN3       ARG 115   2.196  -3.061  10.111
  656    HA   ARG 115           HA       ARG 115   0.663  -2.965   7.628
  657   1HB   ARG 115          2HB       ARG 115  -0.138  -2.912  10.544
  658   2HB   ARG 115          1HB       ARG 115  -1.193  -3.171   9.161
  659   1HG   ARG 115          2HG       ARG 115  -0.896  -5.349   9.395
  660   2HG   ARG 115          1HG       ARG 115   0.805  -5.131   8.984
  661   1HD   ARG 115          2HD       ARG 115   1.253  -5.923  11.021
  662   2HD   ARG 115          1HD       ARG 115   0.691  -4.366  11.629
  663    HE   ARG 115           HE       ARG 115  -1.591  -5.793  11.426
  664   1HH1  ARG 115          1HH1      ARG 115   1.490  -6.450  12.930
  665   2HH1  ARG 115          2HH1      ARG 115   0.812  -7.455  14.167
  666   1HH2  ARG 115          1HH2      ARG 115  -2.484  -7.114  13.052
  667   2HH2  ARG 115          2HH2      ARG 115  -1.444  -7.832  14.236
  668    H    MET 116           H        MET 116   0.823  -1.165  10.707
  669    HA   MET 116           HA       MET 116  -0.049   1.240   9.298
  670   1HB   MET 116          2HB       MET 116  -1.203   0.607  11.382
  671   2HB   MET 116          1HB       MET 116   0.316   0.745  12.258
  672   1HG   MET 116          2HG       MET 116   0.406   3.094  11.886
  673   2HG   MET 116          1HG       MET 116  -0.956   3.025  10.769
  674   1HE   MET 116          1HE       MET 116  -1.029   3.309  15.288
  675   2HE   MET 116          2HE       MET 116  -0.166   4.350  14.155
  676   3HE   MET 116          3HE       MET 116   0.311   2.662  14.342
  677    H    SER 117           H        SER 117   1.007   3.315   9.832
  678    HA   SER 117           HA       SER 117   2.837   4.664   9.758
  679   1HB   SER 117          2HB       SER 117   4.389   4.458  11.503
  680   2HB   SER 117          1HB       SER 117   2.947   3.670  12.143
  681    HG   SER 117           HG       SER 117   4.878   2.443  12.460
  682    H    ALA 118           H        ALA 118   2.582   2.704   7.714
  683    HA   ALA 118           HA       ALA 118   5.179   1.579   7.198
  684   1HB   ALA 118          1HB       ALA 118   2.773   0.811   6.409
  685   2HB   ALA 118          2HB       ALA 118   4.214   0.487   5.444
  686   3HB   ALA 118          3HB       ALA 118   3.164   1.844   5.033
  687    H    ASP 119           H        ASP 119   4.100   4.675   7.097
  688    HA   ASP 119           HA       ASP 119   4.683   5.845   4.729
  689   1HB   ASP 119          2HB       ASP 119   3.961   7.058   6.760
  690   2HB   ASP 119          1HB       ASP 119   5.582   6.879   7.427
  691    H    ALA 120           H        ALA 120   6.973   4.383   6.920
  692    HA   ALA 120           HA       ALA 120   9.354   5.524   6.100
  693   1HB   ALA 120          1HB       ALA 120   9.408   4.043   7.941
  694   2HB   ALA 120          2HB       ALA 120  10.377   3.280   6.681
  695   3HB   ALA 120          3HB       ALA 120   8.734   2.718   6.992
  696    H    MET 121           H        MET 121   8.250   2.341   4.905
  697    HA   MET 121           HA       MET 121   9.971   2.210   2.731
  698   1HB   MET 121          2HB       MET 121   8.886   0.203   3.202
  699   2HB   MET 121          1HB       MET 121   7.309   0.969   3.327
  700   1HG   MET 121          2HG       MET 121   8.523   1.127   0.664
  701   2HG   MET 121          1HG       MET 121   8.170  -0.509   1.215
  702   1HE   MET 121          1HE       MET 121   6.151  -0.567   2.871
  703   2HE   MET 121          2HE       MET 121   4.823  -0.971   1.783
  704   3HE   MET 121          3HE       MET 121   4.739   0.487   2.774
  705    H    LEU 122           H        LEU 122   6.797   3.681   3.033
  706    HA   LEU 122           HA       LEU 122   6.379   4.306   0.329
  707   1HB   LEU 122          2HB       LEU 122   5.377   5.468   2.912
  708   2HB   LEU 122          1HB       LEU 122   4.951   6.202   1.380
  709    HG   LEU 122           HG       LEU 122   4.044   3.926   0.689
  710   1HD1  LEU 122          1HD1      LEU 122   4.085   3.386   3.647
  711   2HD1  LEU 122          2HD1      LEU 122   5.242   2.688   2.515
  712   3HD1  LEU 122          3HD1      LEU 122   3.526   2.320   2.360
  713   1HD2  LEU 122          1HD2      LEU 122   2.549   5.719   1.232
  714   2HD2  LEU 122          2HD2      LEU 122   2.785   5.456   2.960
  715   3HD2  LEU 122          3HD2      LEU 122   1.946   4.245   1.990
  716    H    ARG 123           H        ARG 123   8.126   5.950   2.905
  717    HA   ARG 123           HA       ARG 123   8.794   8.179   1.145
  718   1HB   ARG 123          2HB       ARG 123   8.230   8.417   3.630
  719   2HB   ARG 123          1HB       ARG 123   9.818   7.729   3.944
  720   1HG   ARG 123          2HG       ARG 123  10.929   9.568   3.046
  721   2HG   ARG 123          1HG       ARG 123   9.495  10.129   2.184
  722   1HD   ARG 123          2HD       ARG 123   9.583  11.602   3.956
  723   2HD   ARG 123          1HD       ARG 123   8.487  10.366   4.571
  724    HE   ARG 123           HE       ARG 123  11.216   9.852   5.253
  725   1HH1  ARG 123          1HH1      ARG 123   8.375  11.668   6.155
  726   2HH1  ARG 123          2HH1      ARG 123   8.842  11.812   7.817
  727   1HH2  ARG 123          1HH2      ARG 123  11.830  10.038   7.439
  728   2HH2  ARG 123          2HH2      ARG 123  10.802  10.887   8.546
  729    H    ALA 124           H        ALA 124   9.815   5.191   1.133
  730    HA   ALA 124           HA       ALA 124  12.669   5.558   1.395
  731   1HB   ALA 124          1HB       ALA 124  12.824   3.200   0.818
  732   2HB   ALA 124          2HB       ALA 124  11.108   3.169   0.412
  733   3HB   ALA 124          3HB       ALA 124  11.616   3.454   2.077
  734    H    LEU 125           H        LEU 125  10.895   4.028  -1.264
  735    HA   LEU 125           HA       LEU 125  12.862   4.792  -3.170
  736   1HB   LEU 125          2HB       LEU 125  10.106   3.714  -3.719
  737   2HB   LEU 125          1HB       LEU 125  11.511   3.631  -4.767
  738    HG   LEU 125           HG       LEU 125  11.615   2.343  -2.070
  739   1HD1  LEU 125          1HD1      LEU 125  10.903   0.230  -3.404
  740   2HD1  LEU 125          2HD1      LEU 125  10.091   1.393  -4.451
  741   3HD1  LEU 125          3HD1      LEU 125   9.676   1.307  -2.738
  742   1HD2  LEU 125          1HD2      LEU 125  12.764   1.083  -4.462
  743   2HD2  LEU 125          2HD2      LEU 125  13.455   1.327  -2.858
  744   3HD2  LEU 125          3HD2      LEU 125  13.456   2.645  -4.028
  745    H    LEU 126           H        LEU 126  10.342   6.536  -1.814
  746    HA   LEU 126           HA       LEU 126   9.143   7.898  -3.887
  747   1HB   LEU 126          2HB       LEU 126   8.882   8.081  -1.285
  748   2HB   LEU 126          1HB       LEU 126  10.025   9.400  -1.456
  749    HG   LEU 126           HG       LEU 126   7.274   9.204  -2.674
  750   1HD1  LEU 126          1HD1      LEU 126   8.469  11.194  -0.754
  751   2HD1  LEU 126          2HD1      LEU 126   7.402   9.864  -0.304
  752   3HD1  LEU 126          3HD1      LEU 126   6.807  11.161  -1.340
  753   1HD2  LEU 126          1HD2      LEU 126   9.471  11.204  -3.164
  754   2HD2  LEU 126          2HD2      LEU 126   7.776  11.496  -3.553
  755   3HD2  LEU 126          3HD2      LEU 126   8.651  10.188  -4.350
  756    H    GLY 127           H        GLY 127   9.944   9.025  -5.522
  757   1HA   GLY 127          2HA       GLY 127  11.174  10.654  -6.620
  758   2HA   GLY 127          1HA       GLY 127  11.990  11.012  -5.106
  759    H    SER 128           H        SER 128  12.088   9.237  -8.064
  760    HA   SER 128           HA       SER 128  14.763   8.229  -7.343
  761   1HB   SER 128          2HB       SER 128  12.515   6.947  -8.830
  762   2HB   SER 128          1HB       SER 128  14.164   6.574  -9.335
  763    HG   SER 128           HG       SER 128  13.322   6.397  -6.640
  764    H    LYS 129           H        LYS 129  16.244   9.464  -8.288
  765    HA   LYS 129           HA       LYS 129  16.441   9.688 -11.095
  766   1HB   LYS 129          2HB       LYS 129  16.308  12.251 -11.114
  767   2HB   LYS 129          1HB       LYS 129  14.795  11.357 -11.100
  768   1HG   LYS 129          2HG       LYS 129  14.571  11.741  -8.708
  769   2HG   LYS 129          1HG       LYS 129  16.110  12.605  -8.695
  770   1HD   LYS 129          2HD       LYS 129  15.142  14.493  -9.381
  771   2HD   LYS 129          1HD       LYS 129  14.327  13.666 -10.709
  772   1HE   LYS 129          2HE       LYS 129  12.735  12.802  -8.848
  773   2HE   LYS 129          1HE       LYS 129  13.380  14.150  -7.913
  774   1HZ   LYS 129          1HZ       LYS 129  11.458  14.945  -8.977
  775   2HZ   LYS 129          2HZ       LYS 129  11.881  14.259 -10.464
  776   3HZ   LYS 129          3HZ       LYS 129  12.748  15.583  -9.867
  777    H    HIS 130           H        HIS 130  17.326  11.116  -7.983
  778    HA   HIS 130           HA       HIS 130  20.094  11.374  -8.957
  779   1HB   HIS 130          2HB       HIS 130  18.464  12.978  -7.040
  780   2HB   HIS 130          1HB       HIS 130  20.197  12.854  -6.756
  781    HD1  HIS 130           1HD      HIS 130  21.380  13.150  -9.484
  782    HD2  HIS 130           2HD      HIS 130  18.102  15.374  -8.229
  783    HE1  HIS 130           1HE      HIS 130  21.353  15.193 -10.950
  784    HE2  HIS 130           2HE      HIS 130  19.311  16.481 -10.229
  785    H    LYS 131           H        LYS 131  21.633  11.360  -6.878
  786    HA   LYS 131           HA       LYS 131  20.900   9.379  -4.915
  787   1HB   LYS 131          2HB       LYS 131  22.713   7.813  -5.501
  788   2HB   LYS 131          1HB       LYS 131  21.494   7.920  -6.763
  789   1HG   LYS 131          2HG       LYS 131  22.916   9.279  -8.118
  790   2HG   LYS 131          1HG       LYS 131  24.097   9.428  -6.815
  791   1HD   LYS 131          2HD       LYS 131  23.919   6.733  -7.041
  792   2HD   LYS 131          1HD       LYS 131  23.633   7.226  -8.711
  793   1HE   LYS 131          2HE       LYS 131  25.747   7.965  -8.992
  794   2HE   LYS 131          1HE       LYS 131  25.857   8.591  -7.348
  795   1HZ   LYS 131          1HZ       LYS 131  26.695   6.663  -6.577
  796   2HZ   LYS 131          2HZ       LYS 131  27.174   6.446  -8.184
  797   3HZ   LYS 131          3HZ       LYS 131  25.769   5.697  -7.613
  Start of MODEL   13
    1   2H    ALA   1          HN2       ALA   1 -26.835   1.991  -5.609
    2    H    ALA   1           H        ALA   1 -26.042   2.003  -7.131
    3   3H    ALA   1          HN3       ALA   1 -27.554   1.215  -6.959
    4    HA   ALA   1           HA       ALA   1 -26.436  -0.211  -5.258
    5   1HB   ALA   1          1HB       ALA   1 -25.641  -0.409  -8.160
    6   2HB   ALA   1          2HB       ALA   1 -27.142  -1.004  -7.450
    7   3HB   ALA   1          3HB       ALA   1 -25.600  -1.725  -6.987
    8    H    SER   2           H        SER   2 -24.781  -0.016  -3.908
    9    HA   SER   2           HA       SER   2 -22.204   0.944  -4.959
   10   1HB   SER   2          2HB       SER   2 -23.608   1.312  -2.364
   11   2HB   SER   2          1HB       SER   2 -21.852   1.151  -2.305
   12    HG   SER   2           HG       SER   2 -22.531   3.331  -2.553
   13    H    MET   3           H        MET   3 -20.279   0.055  -3.701
   14    HA   MET   3           HA       MET   3 -20.646  -2.682  -2.774
   15   1HB   MET   3          2HB       MET   3 -18.634  -3.315  -4.295
   16   2HB   MET   3          1HB       MET   3 -20.252  -3.275  -4.980
   17   1HG   MET   3          2HG       MET   3 -19.079  -0.689  -5.234
   18   2HG   MET   3          1HG       MET   3 -17.948  -1.897  -5.839
   19   1HE   MET   3          1HE       MET   3 -19.630   0.546  -6.985
   20   2HE   MET   3          2HE       MET   3 -21.334   0.097  -6.889
   21   3HE   MET   3          3HE       MET   3 -20.509   0.101  -8.448
   22    H    THR   4           H        THR   4 -18.283  -0.141  -3.535
   23    HA   THR   4           HA       THR   4 -17.291   0.080  -0.938
   24    HB   THR   4           HB       THR   4 -16.381  -2.143  -1.206
   25    HG1  THR   4           1HG      THR   4 -14.208  -0.394  -1.620
   26   1HG2  THR   4          1HG2      THR   4 -16.266  -1.966  -3.768
   27   2HG2  THR   4          2HG2      THR   4 -15.026  -2.890  -2.920
   28   3HG2  THR   4          3HG2      THR   4 -14.674  -1.258  -3.490
   29    H    ASP   5           H        ASP   5 -16.660   2.118  -0.933
   30    HA   ASP   5           HA       ASP   5 -15.346   3.201  -3.336
   31   1HB   ASP   5          2HB       ASP   5 -17.053   4.563  -1.247
   32   2HB   ASP   5          1HB       ASP   5 -16.138   5.435  -2.481
   33    H    GLN   6           H        GLN   6 -14.546   2.070  -0.390
   34    HA   GLN   6           HA       GLN   6 -13.090   3.923   0.980
   35   1HB   GLN   6          2HB       GLN   6 -11.540   2.024   1.585
   36   2HB   GLN   6          1HB       GLN   6 -13.251   1.723   1.856
   37   1HG   GLN   6          2HG       GLN   6 -13.149   0.665  -0.524
   38   2HG   GLN   6          1HG       GLN   6 -11.422   0.560  -0.188
   39   1HE2  GLN   6          1HE2      GLN   6 -14.595  -0.288   1.105
   40   2HE2  GLN   6          2HE2      GLN   6 -14.079  -1.722   1.921
   41    H    GLN   7           H        GLN   7 -12.230   2.392  -2.054
   42    HA   GLN   7           HA       GLN   7  -9.519   3.033  -2.194
   43   1HB   GLN   7          2HB       GLN   7 -10.092   3.276  -4.756
   44   2HB   GLN   7          1HB       GLN   7 -10.106   1.700  -3.971
   45   1HG   GLN   7          2HG       GLN   7 -12.384   1.519  -4.091
   46   2HG   GLN   7          1HG       GLN   7 -12.635   3.265  -4.060
   47   1HE2  GLN   7          1HE2      GLN   7 -10.708   1.136  -6.141
   48   2HE2  GLN   7          2HE2      GLN   7 -11.420   1.657  -7.626
   49    H    ALA   8           H        ALA   8 -12.352   4.959  -2.682
   50    HA   ALA   8           HA       ALA   8 -10.896   7.188  -3.773
   51   1HB   ALA   8          1HB       ALA   8 -13.637   6.352  -3.571
   52   2HB   ALA   8          2HB       ALA   8 -12.913   7.560  -4.636
   53   3HB   ALA   8          3HB       ALA   8 -13.469   8.022  -3.027
   54    H    GLU   9           H        GLU   9 -12.738   6.518  -0.795
   55    HA   GLU   9           HA       GLU   9 -12.209   8.938   0.507
   56   1HB   GLU   9          2HB       GLU   9 -12.514   6.287   1.912
   57   2HB   GLU   9          1HB       GLU   9 -12.962   7.881   2.502
   58   1HG   GLU   9          2HG       GLU   9 -14.346   7.343   0.057
   59   2HG   GLU   9          1HG       GLU   9 -14.576   6.000   1.184
   60    H    ALA  10           H        ALA  10 -10.428   5.900   0.414
   61    HA   ALA  10           HA       ALA  10  -8.529   6.182   2.331
   62   1HB   ALA  10          1HB       ALA  10  -8.144   4.245   1.265
   63   2HB   ALA  10          2HB       ALA  10  -7.022   5.202   0.298
   64   3HB   ALA  10          3HB       ALA  10  -8.654   4.886  -0.298
   65    H    ARG  11           H        ARG  11  -8.175   7.407  -1.004
   66    HA   ARG  11           HA       ARG  11  -5.756   8.718  -0.686
   67   1HB   ARG  11          2HB       ARG  11  -7.846   8.624  -2.643
   68   2HB   ARG  11          1HB       ARG  11  -7.345  10.297  -2.430
   69   1HG   ARG  11          2HG       ARG  11  -5.000   9.593  -2.806
   70   2HG   ARG  11          1HG       ARG  11  -5.584   7.963  -3.147
   71   1HD   ARG  11          2HD       ARG  11  -5.160   9.376  -5.171
   72   2HD   ARG  11          1HD       ARG  11  -6.789   8.709  -5.058
   73    HE   ARG  11           HE       ARG  11  -7.622  10.837  -4.840
   74   1HH1  ARG  11          1HH1      ARG  11  -4.154  10.915  -4.455
   75   2HH1  ARG  11          2HH1      ARG  11  -4.063  12.644  -4.502
   76   1HH2  ARG  11          1HH2      ARG  11  -7.503  13.110  -4.903
   77   2HH2  ARG  11          2HH2      ARG  11  -5.964  13.890  -4.755
   78    H    ALA  12           H        ALA  12  -8.913   9.614   0.415
   79    HA   ALA  12           HA       ALA  12  -8.058  12.330   1.060
   80   1HB   ALA  12          1HB       ALA  12 -10.737  10.968   1.277
   81   2HB   ALA  12          2HB       ALA  12 -10.241  12.169   0.084
   82   3HB   ALA  12          3HB       ALA  12 -10.424  12.630   1.776
   83    H    PHE  13           H        PHE  13  -8.445   9.237   2.528
   84    HA   PHE  13           HA       PHE  13  -8.862  10.078   5.204
   85   1HB   PHE  13          2HB       PHE  13  -8.191   7.561   3.817
   86   2HB   PHE  13          1HB       PHE  13  -7.615   7.672   5.482
   87    HD1  PHE  13           1HD      PHE  13 -10.229   6.576   3.517
   88    HD2  PHE  13           2HD      PHE  13  -9.491   8.706   7.127
   89    HE1  PHE  13           1HE      PHE  13 -12.474   5.975   4.325
   90    HE2  PHE  13           2HE      PHE  13 -11.734   8.108   7.943
   91    HZ   PHE  13           HZ       PHE  13 -13.229   6.742   6.541
   92    H    LEU  14           H        LEU  14  -6.043   9.785   3.191
   93    HA   LEU  14           HA       LEU  14  -4.332  10.433   5.499
   94   1HB   LEU  14          2HB       LEU  14  -3.317   9.447   2.849
   95   2HB   LEU  14          1HB       LEU  14  -2.513   9.418   4.415
   96    HG   LEU  14           HG       LEU  14  -4.994   7.796   3.971
   97   1HD1  LEU  14          1HD1      LEU  14  -2.191   6.941   3.269
   98   2HD1  LEU  14          2HD1      LEU  14  -3.492   7.249   2.119
   99   3HD1  LEU  14          3HD1      LEU  14  -3.626   5.915   3.265
  100   1HD2  LEU  14          1HD2      LEU  14  -2.561   7.371   5.699
  101   2HD2  LEU  14          2HD2      LEU  14  -4.045   6.419   5.709
  102   3HD2  LEU  14          3HD2      LEU  14  -4.072   8.099   6.244
  103    H    SER  15           H        SER  15  -2.361  11.763   4.849
  104    HA   SER  15           HA       SER  15  -3.319  14.159   3.534
  105   1HB   SER  15          2HB       SER  15  -1.715  13.804   5.685
  106   2HB   SER  15          1HB       SER  15  -0.490  14.003   4.423
  107    HG   SER  15           HG       SER  15  -1.082  16.032   4.153
  108    H    GLU  16           H        GLU  16  -1.954  15.287   1.924
  109    HA   GLU  16           HA       GLU  16  -1.507  13.799  -0.359
  110   1HB   GLU  16          2HB       GLU  16  -1.474  16.437   0.181
  111   2HB   GLU  16          1HB       GLU  16   0.256  16.155   0.035
  112   1HG   GLU  16          2HG       GLU  16  -1.561  15.123  -2.084
  113   2HG   GLU  16          1HG       GLU  16  -1.176  16.842  -2.039
  114    H    GLU  17           H        GLU  17   0.539  14.289   2.390
  115    HA   GLU  17           HA       GLU  17   3.035  13.614   1.324
  116   1HB   GLU  17          2HB       GLU  17   1.793  13.701   4.009
  117   2HB   GLU  17          1HB       GLU  17   3.209  12.668   3.856
  118   1HG   GLU  17          2HG       GLU  17   4.517  14.437   4.039
  119   2HG   GLU  17          1HG       GLU  17   3.809  15.113   2.573
  120    H    MET  18           H        MET  18   0.805  11.525   3.169
  121    HA   MET  18           HA       MET  18   2.121   9.123   2.828
  122   1HB   MET  18          2HB       MET  18  -0.221   9.913   4.006
  123   2HB   MET  18          1HB       MET  18  -0.809   8.908   2.681
  124   1HG   MET  18          2HG       MET  18  -0.598   7.479   4.525
  125   2HG   MET  18          1HG       MET  18   0.790   7.132   3.495
  126   1HE   MET  18          1HE       MET  18   1.662   6.852   7.486
  127   2HE   MET  18          2HE       MET  18   1.091   5.907   6.109
  128   3HE   MET  18          3HE       MET  18  -0.020   6.977   6.966
  129    H    ILE  19           H        ILE  19   0.298  10.934   0.515
  130    HA   ILE  19           HA       ILE  19  -0.160   8.744  -1.292
  131    HB   ILE  19           HB       ILE  19  -0.434  11.734  -1.577
  132   1HG1  ILE  19          2HG1      ILE  19  -2.510   9.535  -1.626
  133   2HG1  ILE  19          1HG1      ILE  19  -2.092  10.477  -0.191
  134   1HG2  ILE  19          1HG2      ILE  19  -0.635   9.598  -3.651
  135   2HG2  ILE  19          2HG2      ILE  19   0.054  11.220  -3.765
  136   3HG2  ILE  19          3HG2      ILE  19  -1.698  11.003  -3.741
  137   1HD1  ILE  19          1HD1      ILE  19  -2.635  12.406  -2.071
  138   2HD1  ILE  19          2HD1      ILE  19  -3.730  11.841  -0.809
  139   3HD1  ILE  19          3HD1      ILE  19  -3.816  11.145  -2.426
  140    H    ALA  20           H        ALA  20   1.803  11.704  -1.530
  141    HA   ALA  20           HA       ALA  20   3.244  11.045  -3.793
  142   1HB   ALA  20          1HB       ALA  20   4.929  12.669  -2.949
  143   2HB   ALA  20          2HB       ALA  20   4.041  12.720  -1.424
  144   3HB   ALA  20          3HB       ALA  20   3.268  13.264  -2.914
  145    H    GLU  21           H        GLU  21   3.574   9.827  -0.573
  146    HA   GLU  21           HA       GLU  21   6.209   8.713  -1.070
  147   1HB   GLU  21          2HB       GLU  21   4.423   8.286   1.331
  148   2HB   GLU  21          1HB       GLU  21   6.145   7.948   1.216
  149   1HG   GLU  21          2HG       GLU  21   5.882  10.652   0.579
  150   2HG   GLU  21          1HG       GLU  21   4.797  10.380   1.940
  151    H    PHE  22           H        PHE  22   2.849   7.770  -0.911
  152    HA   PHE  22           HA       PHE  22   3.168   4.976  -0.875
  153   1HB   PHE  22          2HB       PHE  22   1.013   6.878  -1.341
  154   2HB   PHE  22          1HB       PHE  22   0.877   5.475  -2.395
  155    HD1  PHE  22           1HD      PHE  22  -0.501   6.670   0.368
  156    HD2  PHE  22           2HD      PHE  22   1.770   3.268  -0.804
  157    HE1  PHE  22           1HE      PHE  22  -1.483   5.382   2.219
  158    HE2  PHE  22           2HE      PHE  22   0.792   1.973   1.046
  159    HZ   PHE  22           HZ       PHE  22  -0.837   3.031   2.559
  160    H    LYS  23           H        LYS  23   3.311   7.366  -3.412
  161    HA   LYS  23           HA       LYS  23   3.265   5.554  -5.602
  162   1HB   LYS  23          2HB       LYS  23   2.809   8.089  -5.604
  163   2HB   LYS  23          1HB       LYS  23   4.564   8.271  -5.642
  164   1HG   LYS  23          2HG       LYS  23   3.989   8.393  -7.873
  165   2HG   LYS  23          1HG       LYS  23   4.445   6.697  -7.689
  166   1HD   LYS  23          2HD       LYS  23   2.342   5.958  -8.054
  167   2HD   LYS  23          1HD       LYS  23   1.609   7.307  -7.175
  168   1HE   LYS  23          2HE       LYS  23   1.840   8.754  -9.053
  169   2HE   LYS  23          1HE       LYS  23   2.841   7.582  -9.910
  170   1HZ   LYS  23          1HZ       LYS  23  -0.060   7.606  -9.505
  171   2HZ   LYS  23          2HZ       LYS  23   0.716   6.108  -9.617
  172   3HZ   LYS  23          3HZ       LYS  23   0.833   7.216 -10.889
  173    H    ALA  24           H        ALA  24   5.609   6.376  -3.276
  174    HA   ALA  24           HA       ALA  24   8.026   6.240  -4.592
  175   1HB   ALA  24          1HB       ALA  24   7.709   6.713  -2.179
  176   2HB   ALA  24          2HB       ALA  24   8.999   5.555  -2.503
  177   3HB   ALA  24          3HB       ALA  24   7.436   4.991  -1.913
  178    H    ALA  25           H        ALA  25   6.644   3.444  -2.869
  179    HA   ALA  25           HA       ALA  25   8.259   1.615  -4.386
  180   1HB   ALA  25          1HB       ALA  25   6.116   1.121  -2.327
  181   2HB   ALA  25          2HB       ALA  25   7.858   1.178  -2.049
  182   3HB   ALA  25          3HB       ALA  25   7.161  -0.119  -3.021
  183    H    PHE  26           H        PHE  26   5.487   3.182  -5.199
  184    HA   PHE  26           HA       PHE  26   3.642   1.407  -6.122
  185   1HB   PHE  26          2HB       PHE  26   4.061   4.075  -6.456
  186   2HB   PHE  26          1HB       PHE  26   4.321   3.490  -8.093
  187    HD1  PHE  26           1HD      PHE  26   1.901   4.137  -5.487
  188    HD2  PHE  26           2HD      PHE  26   2.507   2.307  -9.280
  189    HE1  PHE  26           1HE      PHE  26  -0.533   4.068  -5.838
  190    HE2  PHE  26           2HE      PHE  26   0.074   2.234  -9.639
  191    HZ   PHE  26           HZ       PHE  26  -1.450   3.117  -7.916
  192    H    ASP  27           H        ASP  27   6.420   2.543  -8.061
  193    HA   ASP  27           HA       ASP  27   5.968   0.708 -10.170
  194   1HB   ASP  27          2HB       ASP  27   8.344   1.333 -10.825
  195   2HB   ASP  27          1HB       ASP  27   7.197   2.664 -10.701
  196    H    MET  28           H        MET  28   8.395   0.730  -7.558
  197    HA   MET  28           HA       MET  28   9.649  -1.669  -8.202
  198   1HB   MET  28          2HB       MET  28   9.876   0.232  -6.193
  199   2HB   MET  28          1HB       MET  28   9.456  -1.239  -5.327
  200   1HG   MET  28          2HG       MET  28  11.867  -0.938  -5.485
  201   2HG   MET  28          1HG       MET  28  11.335  -2.398  -6.328
  202   1HE   MET  28          1HE       MET  28  13.736   1.012  -7.992
  203   2HE   MET  28          2HE       MET  28  13.918   0.088  -6.500
  204   3HE   MET  28          3HE       MET  28  12.612   1.264  -6.656
  205    H    PHE  29           H        PHE  29   6.603  -1.083  -6.642
  206    HA   PHE  29           HA       PHE  29   6.244  -3.525  -5.321
  207   1HB   PHE  29          2HB       PHE  29   4.490  -1.348  -6.295
  208   2HB   PHE  29          1HB       PHE  29   3.708  -2.909  -6.036
  209    HD1  PHE  29           1HD      PHE  29   4.773  -4.029  -3.709
  210    HD2  PHE  29           2HD      PHE  29   4.144   0.093  -4.560
  211    HE1  PHE  29           1HE      PHE  29   4.625  -3.557  -1.298
  212    HE2  PHE  29           2HE      PHE  29   3.997   0.572  -2.151
  213    HZ   PHE  29           HZ       PHE  29   4.237  -1.255  -0.516
  214    H    ASP  30           H        ASP  30   4.472  -2.665  -8.278
  215    HA   ASP  30           HA       ASP  30   3.894  -5.297  -9.004
  216   1HB   ASP  30          2HB       ASP  30   4.008  -2.753 -10.628
  217   2HB   ASP  30          1HB       ASP  30   3.472  -4.295 -11.303
  218    H    ALA  31           H        ALA  31   5.183  -6.853  -9.669
  219    HA   ALA  31           HA       ALA  31   7.879  -6.335 -10.509
  220   1HB   ALA  31          1HB       ALA  31   8.021  -8.800 -10.728
  221   2HB   ALA  31          2HB       ALA  31   6.302  -8.899 -10.345
  222   3HB   ALA  31          3HB       ALA  31   7.436  -8.272  -9.149
  223    H    ASP  32           H        ASP  32   5.076  -7.893 -12.068
  224    HA   ASP  32           HA       ASP  32   6.361  -7.833 -14.650
  225   1HB   ASP  32          2HB       ASP  32   4.223  -8.806 -15.459
  226   2HB   ASP  32          1HB       ASP  32   4.917  -9.710 -14.110
  227    H    GLY  33           H        GLY  33   4.013  -5.938 -12.893
  228   1HA   GLY  33          2HA       GLY  33   3.183  -3.834 -13.325
  229   2HA   GLY  33          1HA       GLY  33   4.298  -3.736 -14.679
  230    H    GLY  34           H        GLY  34   1.062  -4.211 -13.703
  231   1HA   GLY  34          2HA       GLY  34  -0.230  -3.617 -15.967
  232   2HA   GLY  34          1HA       GLY  34   0.205  -5.299 -16.262
  233    H    GLY  35           H        GLY  35  -0.060  -5.912 -13.349
  234   1HA   GLY  35          2HA       GLY  35  -3.009  -6.058 -13.320
  235   2HA   GLY  35          1HA       GLY  35  -1.938  -7.257 -12.598
  236    H    ASP  36           H        ASP  36  -1.572  -7.121 -10.481
  237    HA   ASP  36           HA       ASP  36  -1.772  -4.536  -9.136
  238   1HB   ASP  36          2HB       ASP  36  -3.509  -6.924  -8.568
  239   2HB   ASP  36          1HB       ASP  36  -3.151  -5.736  -7.311
  240    H    ILE  37           H        ILE  37  -1.390  -5.056  -6.619
  241    HA   ILE  37           HA       ILE  37   1.212  -6.342  -6.548
  242    HB   ILE  37           HB       ILE  37  -0.293  -4.774  -4.453
  243   1HG1  ILE  37          2HG1      ILE  37   2.085  -4.087  -6.194
  244   2HG1  ILE  37          1HG1      ILE  37   0.459  -3.408  -6.324
  245   1HG2  ILE  37          1HG2      ILE  37   1.946  -6.539  -4.166
  246   2HG2  ILE  37          2HG2      ILE  37   1.080  -5.620  -2.936
  247   3HG2  ILE  37          3HG2      ILE  37   2.430  -4.884  -3.799
  248   1HD1  ILE  37          1HD1      ILE  37   2.143  -1.942  -5.210
  249   2HD1  ILE  37          2HD1      ILE  37   2.196  -3.110  -3.890
  250   3HD1  ILE  37          3HD1      ILE  37   0.695  -2.263  -4.257
  251    H    SER  38           H        SER  38   1.274  -8.469  -6.238
  252    HA   SER  38           HA       SER  38  -0.819  -9.879  -4.857
  253   1HB   SER  38          2HB       SER  38   0.771 -10.632  -6.862
  254   2HB   SER  38          1HB       SER  38   1.765 -11.214  -5.522
  255    HG   SER  38           HG       SER  38  -0.990 -11.819  -5.743
  256    H    THR  39           H        THR  39   0.641 -11.873  -3.534
  257    HA   THR  39           HA       THR  39   1.150 -10.554  -1.045
  258    HB   THR  39           HB       THR  39   1.992 -13.123  -0.647
  259    HG1  THR  39           1HG      THR  39  -0.113 -13.361  -2.510
  260   1HG2  THR  39          1HG2      THR  39  -0.872 -12.201  -0.671
  261   2HG2  THR  39          2HG2      THR  39   0.265 -12.044   0.669
  262   3HG2  THR  39          3HG2      THR  39  -0.254 -13.642   0.136
  263    H    LYS  40           H        LYS  40   3.120 -12.037  -3.551
  264    HA   LYS  40           HA       LYS  40   5.558 -11.824  -2.035
  265   1HB   LYS  40          2HB       LYS  40   4.714 -12.980  -4.573
  266   2HB   LYS  40          1HB       LYS  40   6.274 -12.166  -4.699
  267   1HG   LYS  40          2HG       LYS  40   6.735 -13.536  -2.474
  268   2HG   LYS  40          1HG       LYS  40   5.505 -14.592  -3.180
  269   1HD   LYS  40          2HD       LYS  40   7.319 -15.505  -4.192
  270   2HD   LYS  40          1HD       LYS  40   7.034 -14.198  -5.343
  271   1HE   LYS  40          2HE       LYS  40   8.858 -13.026  -4.672
  272   2HE   LYS  40          1HE       LYS  40   8.720 -13.561  -2.998
  273   1HZ   LYS  40          1HZ       LYS  40  10.671 -14.417  -4.377
  274   2HZ   LYS  40          2HZ       LYS  40   9.545 -15.429  -5.130
  275   3HZ   LYS  40          3HZ       LYS  40   9.803 -15.546  -3.463
  276    H    GLU  41           H        GLU  41   3.895  -9.954  -4.492
  277    HA   GLU  41           HA       GLU  41   5.955  -8.257  -5.290
  278   1HB   GLU  41          2HB       GLU  41   3.079  -8.345  -5.509
  279   2HB   GLU  41          1HB       GLU  41   3.618  -6.694  -5.231
  280   1HG   GLU  41          2HG       GLU  41   4.212  -6.511  -7.345
  281   2HG   GLU  41          1HG       GLU  41   5.324  -7.867  -7.170
  282    H    LEU  42           H        LEU  42   3.828  -8.100  -2.489
  283    HA   LEU  42           HA       LEU  42   4.633  -5.515  -1.638
  284   1HB   LEU  42          2HB       LEU  42   2.656  -7.252  -0.921
  285   2HB   LEU  42          1HB       LEU  42   3.755  -7.399   0.445
  286    HG   LEU  42           HG       LEU  42   2.113  -5.739   0.975
  287   1HD1  LEU  42          1HD1      LEU  42   4.842  -4.675   0.341
  288   2HD1  LEU  42          2HD1      LEU  42   4.162  -5.129   1.903
  289   3HD1  LEU  42          3HD1      LEU  42   3.610  -3.662   1.094
  290   1HD2  LEU  42          1HD2      LEU  42   1.199  -5.015  -1.024
  291   2HD2  LEU  42          2HD2      LEU  42   2.774  -4.676  -1.741
  292   3HD2  LEU  42          3HD2      LEU  42   2.123  -3.607  -0.498
  293    H    GLY  43           H        GLY  43   5.437  -8.741  -0.326
  294   1HA   GLY  43          2HA       GLY  43   7.306  -7.982   1.556
  295   2HA   GLY  43          1HA       GLY  43   7.348  -9.516   0.690
  296    H    THR  44           H        THR  44   7.676  -8.089  -1.906
  297    HA   THR  44           HA       THR  44  10.449  -8.218  -2.127
  298    HB   THR  44           HB       THR  44   8.237  -7.161  -3.817
  299    HG1  THR  44           1HG      THR  44   8.896  -9.338  -3.919
  300   1HG2  THR  44          1HG2      THR  44  10.095  -6.724  -5.590
  301   2HG2  THR  44          2HG2      THR  44  11.080  -6.357  -4.173
  302   3HG2  THR  44          3HG2      THR  44   9.600  -5.446  -4.479
  303    H    VAL  45           H        VAL  45   8.690  -5.199  -2.712
  304    HA   VAL  45           HA       VAL  45  10.878  -3.534  -2.193
  305    HB   VAL  45           HB       VAL  45   9.005  -2.767  -3.514
  306   1HG1  VAL  45          1HG1      VAL  45   7.086  -3.721  -2.700
  307   2HG1  VAL  45          2HG1      VAL  45   6.911  -2.065  -2.116
  308   3HG1  VAL  45          3HG1      VAL  45   7.472  -3.330  -1.022
  309   1HG2  VAL  45          1HG2      VAL  45   8.669  -0.902  -1.277
  310   2HG2  VAL  45          2HG2      VAL  45   9.254  -0.617  -2.916
  311   3HG2  VAL  45          3HG2      VAL  45  10.346  -1.258  -1.690
  312    H    MET  46           H        MET  46   8.557  -4.980  -0.045
  313    HA   MET  46           HA       MET  46   9.013  -3.173   2.130
  314   1HB   MET  46          2HB       MET  46   7.486  -5.685   1.711
  315   2HB   MET  46          1HB       MET  46   7.988  -5.337   3.366
  316   1HG   MET  46          2HG       MET  46   6.355  -3.536   1.587
  317   2HG   MET  46          1HG       MET  46   5.751  -4.507   2.934
  318   1HE   MET  46          1HE       MET  46   4.609  -2.917   3.955
  319   2HE   MET  46          2HE       MET  46   5.143  -1.396   4.671
  320   3HE   MET  46          3HE       MET  46   5.451  -2.921   5.506
  321    H    ARG  47           H        ARG  47  10.401  -6.205   1.060
  322    HA   ARG  47           HA       ARG  47  11.921  -6.555   3.497
  323   1HB   ARG  47          2HB       ARG  47  11.812  -8.071   0.897
  324   2HB   ARG  47          1HB       ARG  47  12.951  -8.469   2.175
  325   1HG   ARG  47          2HG       ARG  47  11.229  -9.086   3.659
  326   2HG   ARG  47          1HG       ARG  47   9.988  -8.353   2.642
  327   1HD   ARG  47          2HD       ARG  47   9.672 -10.445   1.896
  328   2HD   ARG  47          1HD       ARG  47  11.108 -10.128   0.916
  329    HE   ARG  47           HE       ARG  47  10.909 -11.862   3.223
  330   1HH1  ARG  47          1HH1      ARG  47  13.042 -10.117   1.077
  331   2HH1  ARG  47          2HH1      ARG  47  14.416 -11.105   1.442
  332   1HH2  ARG  47          1HH2      ARG  47  12.718 -13.158   3.700
  333   2HH2  ARG  47          2HH2      ARG  47  14.233 -12.830   2.929
  334    H    MET  48           H        MET  48  12.405  -5.165   0.345
  335    HA   MET  48           HA       MET  48  15.292  -5.029   0.746
  336   1HB   MET  48          2HB       MET  48  15.390  -4.156  -1.530
  337   2HB   MET  48          1HB       MET  48  14.473  -5.660  -1.472
  338   1HG   MET  48          2HG       MET  48  12.659  -4.687  -2.292
  339   2HG   MET  48          1HG       MET  48  12.758  -3.359  -1.138
  340   1HE   MET  48          1HE       MET  48  11.620  -2.057  -3.631
  341   2HE   MET  48          2HE       MET  48  12.797  -0.747  -3.727
  342   3HE   MET  48          3HE       MET  48  12.278  -1.354  -2.154
  343    H    LEU  49           H        LEU  49  12.944  -3.343   2.053
  344    HA   LEU  49           HA       LEU  49  14.316  -0.762   1.691
  345   1HB   LEU  49          2HB       LEU  49  11.404  -1.398   2.004
  346   2HB   LEU  49          1HB       LEU  49  12.024   0.168   2.493
  347    HG   LEU  49           HG       LEU  49  12.033  -1.018  -0.277
  348   1HD1  LEU  49          1HD1      LEU  49  10.881   1.310  -0.610
  349   2HD1  LEU  49          2HD1      LEU  49  10.543   1.154   1.113
  350   3HD1  LEU  49          3HD1      LEU  49   9.963  -0.071  -0.013
  351   1HD2  LEU  49          1HD2      LEU  49  14.066   0.054  -0.322
  352   2HD2  LEU  49          2HD2      LEU  49  13.584   1.253   0.876
  353   3HD2  LEU  49          3HD2      LEU  49  12.984   1.369  -0.777
  354    H    GLY  50           H        GLY  50  12.574  -2.842   3.974
  355   1HA   GLY  50          2HA       GLY  50  14.309  -2.484   6.098
  356   2HA   GLY  50          1HA       GLY  50  13.111  -1.201   6.247
  357    H    GLN  51           H        GLN  51  10.857  -2.624   5.311
  358    HA   GLN  51           HA       GLN  51  10.085  -3.942   7.699
  359   1HB   GLN  51          2HB       GLN  51   8.738  -2.768   5.647
  360   2HB   GLN  51          1HB       GLN  51   8.484  -4.473   5.273
  361   1HG   GLN  51          2HG       GLN  51   6.725  -4.256   6.638
  362   2HG   GLN  51          1HG       GLN  51   7.924  -4.454   7.915
  363   1HE2  GLN  51          1HE2      GLN  51   7.492  -3.111   9.505
  364   2HE2  GLN  51          2HE2      GLN  51   7.026  -1.456   9.345
  365    H    ASN  52           H        ASN  52   9.210  -6.176   7.785
  366    HA   ASN  52           HA       ASN  52  10.438  -8.029   5.894
  367   1HB   ASN  52          2HB       ASN  52  11.674  -7.464   8.307
  368   2HB   ASN  52          1HB       ASN  52  10.789  -8.954   8.640
  369   1HD2  ASN  52          1HD2      ASN  52  11.414 -10.838   7.675
  370   2HD2  ASN  52          2HD2      ASN  52  12.863 -10.995   6.746
  371    HA   PRO  53           HA       PRO  53   6.241  -9.286   7.691
  372   1HB   PRO  53          2HB       PRO  53   4.611  -8.621   5.659
  373   2HB   PRO  53          1HB       PRO  53   5.058  -7.459   6.912
  374   1HG   PRO  53          2HG       PRO  53   6.170  -7.785   4.151
  375   2HG   PRO  53          1HG       PRO  53   5.734  -6.298   5.011
  376   1HD   PRO  53          2HD       PRO  53   8.294  -7.222   4.808
  377   2HD   PRO  53          1HD       PRO  53   7.712  -6.245   6.174
  378    H    THR  54           H        THR  54   6.599 -11.443   7.517
  379    HA   THR  54           HA       THR  54   7.385 -12.816   5.210
  380    HB   THR  54           HB       THR  54   5.720 -14.292   7.166
  381    HG1  THR  54           1HG      THR  54   6.637 -13.384   8.806
  382   1HG2  THR  54          1HG2      THR  54   6.901 -15.881   6.147
  383   2HG2  THR  54          2HG2      THR  54   8.208 -15.379   7.220
  384   3HG2  THR  54          3HG2      THR  54   8.124 -14.745   5.576
  385    H    LYS  55           H        LYS  55   5.822 -14.868   4.632
  386    HA   LYS  55           HA       LYS  55   3.893 -13.830   2.893
  387   1HB   LYS  55          2HB       LYS  55   5.060 -16.319   3.364
  388   2HB   LYS  55          1HB       LYS  55   3.340 -16.581   3.654
  389   1HG   LYS  55          2HG       LYS  55   3.960 -15.052   1.227
  390   2HG   LYS  55          1HG       LYS  55   4.544 -16.718   1.231
  391   1HD   LYS  55          2HD       LYS  55   2.489 -17.358   0.660
  392   2HD   LYS  55          1HD       LYS  55   1.945 -16.844   2.257
  393   1HE   LYS  55          2HE       LYS  55   1.460 -14.626   1.409
  394   2HE   LYS  55          1HE       LYS  55   2.090 -15.069  -0.177
  395   1HZ   LYS  55          1HZ       LYS  55   0.253 -16.964   0.186
  396   2HZ   LYS  55          2HZ       LYS  55  -0.062 -15.495  -0.590
  397   3HZ   LYS  55          3HZ       LYS  55  -0.467 -15.692   1.039
  398    H    CYS  56           H        CYS  56   3.641 -15.009   6.185
  399    HA   CYS  56           HA       CYS  56   0.767 -15.004   6.211
  400   1HB   CYS  56          2HB       CYS  56   2.866 -15.305   8.354
  401   2HB   CYS  56          1HB       CYS  56   1.144 -15.237   8.733
  402    HG   CYS  56           HG       CYS  56   1.417 -17.690   8.475
  403    H    GLU  57           H        GLU  57   3.336 -12.830   7.251
  404    HA   GLU  57           HA       GLU  57   1.824 -11.004   8.720
  405   1HB   GLU  57          2HB       GLU  57   4.226 -10.436   6.970
  406   2HB   GLU  57          1HB       GLU  57   3.617  -9.395   8.258
  407   1HG   GLU  57          2HG       GLU  57   4.770 -12.158   8.585
  408   2HG   GLU  57          1HG       GLU  57   5.547 -10.634   9.014
  409    H    LEU  58           H        LEU  58   2.646 -10.986   5.266
  410    HA   LEU  58           HA       LEU  58   1.120  -8.647   4.701
  411   1HB   LEU  58          2HB       LEU  58   1.924 -10.729   2.682
  412   2HB   LEU  58          1HB       LEU  58   1.680  -9.004   2.433
  413    HG   LEU  58           HG       LEU  58   3.840  -9.806   4.315
  414   1HD1  LEU  58          1HD1      LEU  58   5.417 -10.148   2.474
  415   2HD1  LEU  58          2HD1      LEU  58   4.084 -10.078   1.322
  416   3HD1  LEU  58          3HD1      LEU  58   4.164 -11.389   2.499
  417   1HD2  LEU  58          1HD2      LEU  58   3.137  -7.556   2.538
  418   2HD2  LEU  58          2HD2      LEU  58   4.857  -7.921   2.688
  419   3HD2  LEU  58          3HD2      LEU  58   3.904  -7.556   4.126
  420    H    ASP  59           H        ASP  59   0.383 -12.016   4.957
  421    HA   ASP  59           HA       ASP  59  -1.971 -12.047   3.368
  422   1HB   ASP  59          2HB       ASP  59  -0.473 -13.936   4.771
  423   2HB   ASP  59          1HB       ASP  59  -2.035 -13.919   5.592
  424    H    ALA  60           H        ALA  60  -1.280 -11.075   6.632
  425    HA   ALA  60           HA       ALA  60  -4.005 -11.059   7.487
  426   1HB   ALA  60          1HB       ALA  60  -1.406 -10.248   8.624
  427   2HB   ALA  60          2HB       ALA  60  -2.734 -11.149   9.355
  428   3HB   ALA  60          3HB       ALA  60  -2.820  -9.391   9.235
  429    H    ILE  61           H        ILE  61  -1.944  -8.882   5.763
  430    HA   ILE  61           HA       ILE  61  -3.672  -6.596   6.189
  431    HB   ILE  61           HB       ILE  61  -1.114  -7.005   4.651
  432   1HG1  ILE  61          2HG1      ILE  61  -0.606  -4.970   6.285
  433   2HG1  ILE  61          1HG1      ILE  61  -1.936  -5.687   7.198
  434   1HG2  ILE  61          1HG2      ILE  61  -1.399  -4.367   4.481
  435   2HG2  ILE  61          2HG2      ILE  61  -3.101  -4.826   4.425
  436   3HG2  ILE  61          3HG2      ILE  61  -1.976  -5.468   3.231
  437   1HD1  ILE  61          1HD1      ILE  61  -0.746  -7.566   7.711
  438   2HD1  ILE  61          2HD1      ILE  61   0.550  -6.372   7.647
  439   3HD1  ILE  61          3HD1      ILE  61   0.275  -7.447   6.277
  440    H    ILE  62           H        ILE  62  -2.502  -8.462   3.365
  441    HA   ILE  62           HA       ILE  62  -4.072  -7.342   1.407
  442    HB   ILE  62           HB       ILE  62  -3.266 -10.239   1.670
  443   1HG1  ILE  62          2HG1      ILE  62  -2.038  -7.867   0.246
  444   2HG1  ILE  62          1HG1      ILE  62  -1.352  -8.768   1.599
  445   1HG2  ILE  62          1HG2      ILE  62  -3.562  -9.525  -1.040
  446   2HG2  ILE  62          2HG2      ILE  62  -5.025  -8.986  -0.215
  447   3HG2  ILE  62          3HG2      ILE  62  -4.524 -10.674  -0.110
  448   1HD1  ILE  62          1HD1      ILE  62  -0.883  -9.173  -1.107
  449   2HD1  ILE  62          2HD1      ILE  62  -1.922 -10.514  -0.621
  450   3HD1  ILE  62          3HD1      ILE  62  -0.402 -10.221   0.228
  451    H    CYS  63           H        CYS  63  -4.940  -9.908   3.683
  452    HA   CYS  63           HA       CYS  63  -7.389 -10.676   2.670
  453   1HB   CYS  63          2HB       CYS  63  -6.092 -11.549   4.728
  454   2HB   CYS  63          1HB       CYS  63  -6.959 -10.301   5.627
  455    HG   CYS  63           HG       CYS  63  -8.117 -12.939   4.675
  456    H    GLU  64           H        GLU  64  -6.507  -7.748   4.330
  457    HA   GLU  64           HA       GLU  64  -9.301  -6.890   4.495
  458   1HB   GLU  64          2HB       GLU  64  -6.740  -5.717   5.585
  459   2HB   GLU  64          1HB       GLU  64  -8.289  -4.889   5.674
  460   1HG   GLU  64          2HG       GLU  64  -8.993  -7.233   6.746
  461   2HG   GLU  64          1HG       GLU  64  -7.286  -7.215   7.187
  462    H    VAL  65           H        VAL  65  -6.285  -6.230   2.852
  463    HA   VAL  65           HA       VAL  65  -7.005  -3.799   1.603
  464    HB   VAL  65           HB       VAL  65  -5.094  -5.918   0.600
  465   1HG1  VAL  65          1HG1      VAL  65  -4.006  -3.874  -0.463
  466   2HG1  VAL  65          2HG1      VAL  65  -5.532  -3.048  -0.150
  467   3HG1  VAL  65          3HG1      VAL  65  -5.496  -4.470  -1.192
  468   1HG2  VAL  65          1HG2      VAL  65  -4.843  -3.834   2.694
  469   2HG2  VAL  65          2HG2      VAL  65  -3.461  -4.081   1.628
  470   3HG2  VAL  65          3HG2      VAL  65  -4.091  -5.423   2.579
  471    H    ASP  66           H        ASP  66  -7.140  -7.167   0.531
  472    HA   ASP  66           HA       ASP  66  -8.000  -6.888  -2.049
  473   1HB   ASP  66          2HB       ASP  66  -8.384  -8.966   0.048
  474   2HB   ASP  66          1HB       ASP  66  -9.342  -9.096  -1.425
  475    H    GLU  67           H        GLU  67 -10.042  -6.947   0.861
  476    HA   GLU  67           HA       GLU  67 -12.266  -6.518   1.163
  477   1HB   GLU  67          2HB       GLU  67 -13.021  -4.366   0.248
  478   2HB   GLU  67          1HB       GLU  67 -11.398  -4.250   0.929
  479   1HG   GLU  67          2HG       GLU  67 -10.407  -4.182  -1.217
  480   2HG   GLU  67          1HG       GLU  67 -11.920  -4.647  -2.005
  481    H    ASP  68           H        ASP  68 -11.631  -8.437  -0.973
  482    HA   ASP  68           HA       ASP  68 -14.247  -8.659  -2.076
  483   1HB   ASP  68          2HB       ASP  68 -13.794  -8.382  -4.397
  484   2HB   ASP  68          1HB       ASP  68 -13.154  -6.954  -3.593
  485    H    GLY  69           H        GLY  69 -10.862  -9.675  -2.456
  486   1HA   GLY  69          2HA       GLY  69 -10.293 -11.954  -1.775
  487   2HA   GLY  69          1HA       GLY  69 -11.822 -12.469  -2.471
  488    H    SER  70           H        SER  70  -9.023 -10.556  -3.580
  489    HA   SER  70           HA       SER  70  -9.008 -12.198  -6.028
  490   1HB   SER  70          2HB       SER  70  -7.650 -10.039  -6.830
  491   2HB   SER  70          1HB       SER  70  -9.415 -10.118  -6.903
  492    HG   SER  70           HG       SER  70  -7.920  -9.023  -4.750
  493    H    GLY  71           H        GLY  71  -7.158 -11.052  -3.341
  494   1HA   GLY  71          2HA       GLY  71  -5.162 -12.005  -2.566
  495   2HA   GLY  71          1HA       GLY  71  -4.944 -12.767  -4.141
  496    H    THR  72           H        THR  72  -5.629  -9.850  -5.150
  497    HA   THR  72           HA       THR  72  -2.863  -8.873  -4.885
  498    HB   THR  72           HB       THR  72  -2.944  -8.058  -7.104
  499    HG1  THR  72           1HG      THR  72  -4.996  -7.187  -7.167
  500   1HG2  THR  72          1HG2      THR  72  -2.592 -10.410  -7.186
  501   2HG2  THR  72          2HG2      THR  72  -3.681  -9.972  -8.502
  502   3HG2  THR  72          3HG2      THR  72  -4.320 -10.728  -7.041
  503    H    ILE  73           H        ILE  73  -2.789  -6.422  -5.505
  504    HA   ILE  73           HA       ILE  73  -4.940  -5.066  -4.011
  505    HB   ILE  73           HB       ILE  73  -2.055  -4.209  -4.183
  506   1HG1  ILE  73          2HG1      ILE  73  -3.500  -5.508  -1.864
  507   2HG1  ILE  73          1HG1      ILE  73  -2.367  -6.341  -2.931
  508   1HG2  ILE  73          1HG2      ILE  73  -3.528  -2.346  -3.823
  509   2HG2  ILE  73          2HG2      ILE  73  -2.700  -2.713  -2.310
  510   3HG2  ILE  73          3HG2      ILE  73  -4.374  -3.211  -2.541
  511   1HD1  ILE  73          1HD1      ILE  73  -1.274  -3.904  -1.773
  512   2HD1  ILE  73          2HD1      ILE  73  -0.600  -5.532  -1.848
  513   3HD1  ILE  73          3HD1      ILE  73  -1.742  -5.108  -0.572
  514    H    ASP  74           H        ASP  74  -6.149  -3.819  -5.268
  515    HA   ASP  74           HA       ASP  74  -5.542  -3.112  -7.909
  516   1HB   ASP  74          2HB       ASP  74  -7.792  -3.053  -6.387
  517   2HB   ASP  74          1HB       ASP  74  -7.411  -1.331  -6.470
  518    H    PHE  75           H        PHE  75  -6.081  -0.480  -8.291
  519    HA   PHE  75           HA       PHE  75  -3.564   0.728  -7.784
  520   1HB   PHE  75          2HB       PHE  75  -5.920   1.303  -9.361
  521   2HB   PHE  75          1HB       PHE  75  -5.341   2.763  -8.555
  522    HD1  PHE  75           1HD      PHE  75  -3.694  -0.170 -10.185
  523    HD2  PHE  75           2HD      PHE  75  -4.067   4.062  -9.936
  524    HE1  PHE  75           1HE      PHE  75  -1.949   0.081 -11.901
  525    HE2  PHE  75           2HE      PHE  75  -2.323   4.320 -11.652
  526    HZ   PHE  75           HZ       PHE  75  -1.262   2.328 -12.637
  527    H    GLU  76           H        GLU  76  -6.605   2.409  -7.076
  528    HA   GLU  76           HA       GLU  76  -5.592   3.970  -5.027
  529   1HB   GLU  76          2HB       GLU  76  -8.368   3.076  -5.722
  530   2HB   GLU  76          1HB       GLU  76  -8.085   4.023  -4.266
  531   1HG   GLU  76          2HG       GLU  76  -7.702   5.917  -5.412
  532   2HG   GLU  76          1HG       GLU  76  -6.866   5.085  -6.722
  533    H    GLU  77           H        GLU  77  -6.572   0.657  -4.967
  534    HA   GLU  77           HA       GLU  77  -7.225   0.278  -2.305
  535   1HB   GLU  77          2HB       GLU  77  -6.249  -1.407  -4.506
  536   2HB   GLU  77          1HB       GLU  77  -5.863  -2.019  -2.903
  537   1HG   GLU  77          2HG       GLU  77  -8.307  -1.718  -2.339
  538   2HG   GLU  77          1HG       GLU  77  -8.572  -1.446  -4.065
  539    H    PHE  78           H        PHE  78  -4.082   0.758  -3.776
  540    HA   PHE  78           HA       PHE  78  -2.419  -0.188  -1.739
  541   1HB   PHE  78          2HB       PHE  78  -1.900   2.256  -3.454
  542   2HB   PHE  78          1HB       PHE  78  -0.694   1.251  -2.647
  543    HD1  PHE  78           1HD      PHE  78  -1.568  -1.451  -3.315
  544    HD2  PHE  78           2HD      PHE  78  -1.491   2.065  -5.708
  545    HE1  PHE  78           1HE      PHE  78  -1.373  -2.836  -5.342
  546    HE2  PHE  78           2HE      PHE  78  -1.297   0.689  -7.736
  547    HZ   PHE  78           HZ       PHE  78  -1.238  -1.766  -7.555
  548    H    LEU  79           H        LEU  79  -4.540   2.507  -1.738
  549    HA   LEU  79           HA       LEU  79  -3.148   3.774   0.497
  550   1HB   LEU  79          2HB       LEU  79  -5.649   4.612  -0.978
  551   2HB   LEU  79          1HB       LEU  79  -4.842   5.543   0.270
  552    HG   LEU  79           HG       LEU  79  -2.909   4.960  -1.728
  553   1HD1  LEU  79          1HD1      LEU  79  -5.607   5.593  -2.782
  554   2HD1  LEU  79          2HD1      LEU  79  -4.298   4.656  -3.501
  555   3HD1  LEU  79          3HD1      LEU  79  -4.227   6.418  -3.507
  556   1HD2  LEU  79          1HD2      LEU  79  -2.565   7.254  -1.709
  557   2HD2  LEU  79          2HD2      LEU  79  -3.249   6.947  -0.112
  558   3HD2  LEU  79          3HD2      LEU  79  -4.264   7.608  -1.394
  559    H    VAL  80           H        VAL  80  -6.213   2.197  -0.304
  560    HA   VAL  80           HA       VAL  80  -7.399   2.461   2.245
  561    HB   VAL  80           HB       VAL  80  -7.903   0.343   0.150
  562   1HG1  VAL  80          1HG1      VAL  80  -9.479   1.191   2.574
  563   2HG1  VAL  80          2HG1      VAL  80  -8.809  -0.403   2.225
  564   3HG1  VAL  80          3HG1      VAL  80 -10.149   0.221   1.264
  565   1HG2  VAL  80          1HG2      VAL  80  -9.441   2.878   0.651
  566   2HG2  VAL  80          2HG2      VAL  80  -9.641   1.739  -0.680
  567   3HG2  VAL  80          3HG2      VAL  80  -8.184   2.728  -0.576
  568    H    MET  81           H        MET  81  -5.243   0.082   0.835
  569    HA   MET  81           HA       MET  81  -5.437  -2.042   2.553
  570   1HB   MET  81          2HB       MET  81  -2.860  -2.175   2.212
  571   2HB   MET  81          1HB       MET  81  -3.912  -2.339   0.819
  572   1HG   MET  81          2HG       MET  81  -3.273  -0.381  -0.080
  573   2HG   MET  81          1HG       MET  81  -2.961   0.377   1.483
  574   1HE   MET  81          1HE       MET  81   0.062  -0.238   2.688
  575   2HE   MET  81          2HE       MET  81  -0.113  -1.990   2.532
  576   3HE   MET  81          3HE       MET  81  -1.494  -1.007   3.020
  577    H    MET  82           H        MET  82  -3.790   0.994   3.005
  578    HA   MET  82           HA       MET  82  -2.893   0.270   5.670
  579   1HB   MET  82          2HB       MET  82  -2.303   2.443   3.726
  580   2HB   MET  82          1HB       MET  82  -1.963   2.708   5.441
  581   1HG   MET  82          2HG       MET  82  -1.013   0.128   4.560
  582   2HG   MET  82          1HG       MET  82  -0.338   1.434   3.587
  583   1HE   MET  82          1HE       MET  82   1.353   3.704   6.095
  584   2HE   MET  82          2HE       MET  82   0.132   3.672   4.820
  585   3HE   MET  82          3HE       MET  82   1.730   2.985   4.528
  586    H    VAL  83           H        VAL  83  -5.391   2.107   4.117
  587    HA   VAL  83           HA       VAL  83  -6.023   3.823   6.297
  588    HB   VAL  83           HB       VAL  83  -7.808   2.868   4.049
  589   1HG1  VAL  83          1HG1      VAL  83  -9.162   4.845   4.537
  590   2HG1  VAL  83          2HG1      VAL  83  -8.122   5.217   5.914
  591   3HG1  VAL  83          3HG1      VAL  83  -9.097   3.748   5.917
  592   1HG2  VAL  83          1HG2      VAL  83  -5.539   4.509   3.947
  593   2HG2  VAL  83          2HG2      VAL  83  -6.925   5.597   3.843
  594   3HG2  VAL  83          3HG2      VAL  83  -6.755   4.276   2.688
  595    H    ARG  84           H        ARG  84  -6.811   0.535   5.470
  596    HA   ARG  84           HA       ARG  84  -8.982   0.295   7.336
  597   1HB   ARG  84          2HB       ARG  84  -7.395  -1.818   5.869
  598   2HB   ARG  84          1HB       ARG  84  -8.856  -2.118   6.801
  599   1HG   ARG  84          2HG       ARG  84  -9.746  -0.200   5.133
  600   2HG   ARG  84          1HG       ARG  84  -8.522  -0.970   4.113
  601   1HD   ARG  84          2HD       ARG  84  -9.750  -2.826   3.850
  602   2HD   ARG  84          1HD       ARG  84 -10.221  -2.866   5.547
  603    HE   ARG  84           HE       ARG  84 -11.707  -1.740   3.360
  604   1HH1  ARG  84          1HH1      ARG  84 -11.196  -1.664   6.812
  605   2HH1  ARG  84          2HH1      ARG  84 -12.769  -1.027   7.156
  606   1HH2  ARG  84          1HH2      ARG  84 -13.775  -0.901   3.812
  607   2HH2  ARG  84          2HH2      ARG  84 -14.233  -0.594   5.454
  608    H    GLN  85           H        GLN  85  -5.577   0.198   7.559
  609    HA   GLN  85           HA       GLN  85  -5.705  -1.251  10.116
  610   1HB   GLN  85          2HB       GLN  85  -3.165  -0.547   8.663
  611   2HB   GLN  85          1HB       GLN  85  -3.429  -1.803   9.872
  612   1HG   GLN  85          2HG       GLN  85  -4.476  -1.799   7.046
  613   2HG   GLN  85          1HG       GLN  85  -3.133  -2.766   7.668
  614   1HE2  GLN  85          1HE2      GLN  85  -4.739  -4.346   6.593
  615   2HE2  GLN  85          2HE2      GLN  85  -5.860  -5.102   7.667
  616    H    MET  86           H        MET  86  -4.842   1.752   8.579
  617    HA   MET  86           HA       MET  86  -3.476   2.933  10.759
  618   1HB   MET  86          2HB       MET  86  -4.737   3.912   8.236
  619   2HB   MET  86          1HB       MET  86  -4.321   5.093   9.479
  620   1HG   MET  86          2HG       MET  86  -1.999   3.976   9.444
  621   2HG   MET  86          1HG       MET  86  -2.522   3.303   7.896
  622   1HE   MET  86          1HE       MET  86  -1.048   4.236   6.259
  623   2HE   MET  86          2HE       MET  86  -1.270   5.854   5.594
  624   3HE   MET  86          3HE       MET  86  -2.623   4.722   5.626
  625    H    LYS  87           H        LYS  87  -6.746   3.642   9.507
  626    HA   LYS  87           HA       LYS  87  -7.599   5.183  11.660
  627   1HB   LYS  87          2HB       LYS  87  -8.998   3.600   9.542
  628   2HB   LYS  87          1HB       LYS  87  -9.943   4.268  10.872
  629   1HG   LYS  87          2HG       LYS  87 -10.100   5.917   9.272
  630   2HG   LYS  87          1HG       LYS  87  -8.759   6.491  10.272
  631   1HD   LYS  87          2HD       LYS  87  -7.992   4.725   8.050
  632   2HD   LYS  87          1HD       LYS  87  -8.681   6.276   7.566
  633   1HE   LYS  87          2HE       LYS  87  -7.007   7.153   9.436
  634   2HE   LYS  87          1HE       LYS  87  -6.153   5.674   8.998
  635   1HZ   LYS  87          1HZ       LYS  87  -6.394   6.486   6.621
  636   2HZ   LYS  87          2HZ       LYS  87  -5.289   7.312   7.601
  637   3HZ   LYS  87          3HZ       LYS  87  -6.806   7.989   7.280
  638    H    GLU  88           H        GLU  88  -7.373   1.732  11.313
  639    HA   GLU  88           HA       GLU  88  -7.723   0.006  12.759
  640   1HB   GLU  88          2HB       GLU  88  -7.569   2.279  14.741
  641   2HB   GLU  88          1HB       GLU  88  -7.693   0.592  15.221
  642   1HG   GLU  88          2HG       GLU  88  -5.517   1.514  13.387
  643   2HG   GLU  88          1HG       GLU  88  -5.375   1.690  15.136
  644    H    ASP  89           H        ASP  89  -9.305  -0.959  14.286
  645    HA   ASP  89           HA       ASP  89 -11.973   0.126  13.740
  646   1HB   ASP  89          2HB       ASP  89 -11.048  -2.378  13.323
  647   2HB   ASP  89          1HB       ASP  89 -11.696  -2.562  14.957
  648    H    ALA  90           H        ALA  90  -9.820  -0.803  16.335
  649    HA   ALA  90           HA       ALA  90  -9.881  -0.461  18.584
  650   1HB   ALA  90          1HB       ALA  90 -10.797   1.526  19.366
  651   2HB   ALA  90          2HB       ALA  90 -12.129   1.482  18.211
  652   3HB   ALA  90          3HB       ALA  90 -10.499   1.869  17.661
  653   2H    ARG 115          HN2       ARG 115   2.975  -3.172   9.628
  654    H    ARG 115           H        ARG 115   2.995  -1.459   9.528
  655   3H    ARG 115          HN3       ARG 115   2.259  -2.229  10.871
  656    HA   ARG 115           HA       ARG 115   1.350  -2.660   8.117
  657   1HB   ARG 115          2HB       ARG 115   0.078  -2.970  10.846
  658   2HB   ARG 115          1HB       ARG 115  -0.710  -3.320   9.314
  659   1HG   ARG 115          2HG       ARG 115   0.107  -5.374   9.329
  660   2HG   ARG 115          1HG       ARG 115   1.753  -4.746   9.416
  661   1HD   ARG 115          2HD       ARG 115   1.936  -5.240  11.588
  662   2HD   ARG 115          1HD       ARG 115   0.343  -4.582  11.958
  663    HE   ARG 115           HE       ARG 115   1.015  -7.334  11.465
  664   1HH1  ARG 115          1HH1      ARG 115  -1.543  -4.959  11.424
  665   2HH1  ARG 115          2HH1      ARG 115  -2.805  -6.132  11.594
  666   1HH2  ARG 115          1HH2      ARG 115  -0.645  -8.878  11.689
  667   2HH2  ARG 115          2HH2      ARG 115  -2.296  -8.357  11.745
  668    H    MET 116           H        MET 116   1.113  -0.575  10.961
  669    HA   MET 116           HA       MET 116  -0.803   1.167   9.648
  670   1HB   MET 116          2HB       MET 116  -1.069   0.738  12.032
  671   2HB   MET 116          1HB       MET 116   0.546   1.356  12.346
  672   1HG   MET 116          2HG       MET 116  -0.698   3.426  11.006
  673   2HG   MET 116          1HG       MET 116  -1.964   2.771  12.044
  674   1HE   MET 116          1HE       MET 116  -0.514   2.564  15.368
  675   2HE   MET 116          2HE       MET 116  -1.859   2.314  14.256
  676   3HE   MET 116          3HE       MET 116  -1.710   3.838  15.132
  677    H    SER 117           H        SER 117   2.297   1.795  11.301
  678    HA   SER 117           HA       SER 117   2.705   4.175   9.719
  679   1HB   SER 117          2HB       SER 117   5.023   3.936  11.062
  680   2HB   SER 117          1HB       SER 117   3.563   4.614  11.785
  681    HG   SER 117           HG       SER 117   4.269   3.071  13.182
  682    H    ALA 118           H        ALA 118   2.585   2.474   7.815
  683    HA   ALA 118           HA       ALA 118   5.109   1.199   7.229
  684   1HB   ALA 118          1HB       ALA 118   2.711   0.459   6.529
  685   2HB   ALA 118          2HB       ALA 118   4.063   0.224   5.421
  686   3HB   ALA 118          3HB       ALA 118   2.960   1.581   5.192
  687    H    ASP 119           H        ASP 119   4.145   4.337   7.172
  688    HA   ASP 119           HA       ASP 119   4.758   5.453   4.763
  689   1HB   ASP 119          2HB       ASP 119   4.059   6.625   6.914
  690   2HB   ASP 119          1HB       ASP 119   5.763   6.614   7.361
  691    H    ALA 120           H        ALA 120   6.951   3.971   7.026
  692    HA   ALA 120           HA       ALA 120   9.388   5.031   6.263
  693   1HB   ALA 120          1HB       ALA 120   9.700   3.617   8.006
  694   2HB   ALA 120          2HB       ALA 120  10.117   2.491   6.715
  695   3HB   ALA 120          3HB       ALA 120   8.503   2.460   7.423
  696    H    MET 121           H        MET 121   7.906   2.060   4.939
  697    HA   MET 121           HA       MET 121   9.759   1.728   2.855
  698   1HB   MET 121          2HB       MET 121   8.305  -0.094   3.526
  699   2HB   MET 121          1HB       MET 121   6.879   0.830   3.077
  700   1HG   MET 121          2HG       MET 121   8.189   0.831   0.728
  701   2HG   MET 121          1HG       MET 121   8.759  -0.694   1.402
  702   1HE   MET 121          1HE       MET 121   5.067   0.713   2.243
  703   2HE   MET 121          2HE       MET 121   4.349   0.379   0.666
  704   3HE   MET 121          3HE       MET 121   5.696   1.510   0.801
  705    H    LEU 122           H        LEU 122   6.845   3.627   3.148
  706    HA   LEU 122           HA       LEU 122   6.557   4.262   0.397
  707   1HB   LEU 122          2HB       LEU 122   5.524   5.499   2.937
  708   2HB   LEU 122          1HB       LEU 122   5.201   6.219   1.373
  709    HG   LEU 122           HG       LEU 122   4.175   3.999   0.693
  710   1HD1  LEU 122          1HD1      LEU 122   4.177   3.514   3.666
  711   2HD1  LEU 122          2HD1      LEU 122   5.227   2.683   2.518
  712   3HD1  LEU 122          3HD1      LEU 122   3.478   2.484   2.418
  713   1HD2  LEU 122          1HD2      LEU 122   2.655   5.715   1.062
  714   2HD2  LEU 122          2HD2      LEU 122   3.034   5.815   2.782
  715   3HD2  LEU 122          3HD2      LEU 122   2.103   4.452   2.161
  716    H    ARG 123           H        ARG 123   8.300   5.715   3.086
  717    HA   ARG 123           HA       ARG 123   9.176   7.949   1.433
  718   1HB   ARG 123          2HB       ARG 123   8.548   8.289   3.819
  719   2HB   ARG 123          1HB       ARG 123   9.907   7.278   4.288
  720   1HG   ARG 123          2HG       ARG 123  10.733   9.399   2.507
  721   2HG   ARG 123          1HG       ARG 123   9.914  10.028   3.937
  722   1HD   ARG 123          2HD       ARG 123  12.033   7.933   4.205
  723   2HD   ARG 123          1HD       ARG 123  12.480   9.626   3.997
  724    HE   ARG 123           HE       ARG 123  10.699   9.712   6.025
  725   1HH1  ARG 123          1HH1      ARG 123  13.577   7.817   5.470
  726   2HH1  ARG 123          2HH1      ARG 123  13.959   7.676   7.153
  727   1HH2  ARG 123          1HH2      ARG 123  11.199   9.526   8.238
  728   2HH2  ARG 123          2HH2      ARG 123  12.609   8.645   8.725
  729    H    ALA 124           H        ALA 124  10.015   4.925   1.300
  730    HA   ALA 124           HA       ALA 124  12.867   5.077   1.714
  731   1HB   ALA 124          1HB       ALA 124  12.765   2.851   1.752
  732   2HB   ALA 124          2HB       ALA 124  11.957   2.785   0.185
  733   3HB   ALA 124          3HB       ALA 124  11.012   3.022   1.655
  734    H    LEU 125           H        LEU 125  11.129   3.905  -1.149
  735    HA   LEU 125           HA       LEU 125  13.244   4.668  -2.892
  736   1HB   LEU 125          2HB       LEU 125  10.437   3.872  -3.641
  737   2HB   LEU 125          1HB       LEU 125  11.867   3.795  -4.655
  738    HG   LEU 125           HG       LEU 125  11.820   2.235  -2.111
  739   1HD1  LEU 125          1HD1      LEU 125  10.941   0.331  -3.641
  740   2HD1  LEU 125          2HD1      LEU 125  10.238   1.654  -4.572
  741   3HD1  LEU 125          3HD1      LEU 125   9.802   1.439  -2.875
  742   1HD2  LEU 125          1HD2      LEU 125  13.521   1.063  -3.044
  743   2HD2  LEU 125          2HD2      LEU 125  13.730   2.573  -3.932
  744   3HD2  LEU 125          3HD2      LEU 125  12.881   1.219  -4.681
  745    H    LEU 126           H        LEU 126  10.645   6.404  -1.570
  746    HA   LEU 126           HA       LEU 126   9.837   8.089  -3.613
  747   1HB   LEU 126          2HB       LEU 126   9.113   7.913  -1.104
  748   2HB   LEU 126          1HB       LEU 126  10.306   9.174  -0.865
  749    HG   LEU 126           HG       LEU 126   7.807   9.315  -2.545
  750   1HD1  LEU 126          1HD1      LEU 126   8.710  11.050  -0.259
  751   2HD1  LEU 126          2HD1      LEU 126   7.662   9.645  -0.064
  752   3HD1  LEU 126          3HD1      LEU 126   7.127  11.017  -1.034
  753   1HD2  LEU 126          1HD2      LEU 126  10.051  11.320  -2.333
  754   2HD2  LEU 126          2HD2      LEU 126   8.495  11.602  -3.113
  755   3HD2  LEU 126          3HD2      LEU 126   9.604  10.399  -3.768
  756    H    GLY 127           H        GLY 127  12.264   8.976  -1.145
  757   1HA   GLY 127          2HA       GLY 127  14.349   9.975  -1.491
  758   2HA   GLY 127          1HA       GLY 127  13.976  10.109  -3.203
  759    H    SER 128           H        SER 128  14.227  11.757  -0.279
  760    HA   SER 128           HA       SER 128  13.898  13.923   0.330
  761   1HB   SER 128          2HB       SER 128  15.063  14.396  -1.793
  762   2HB   SER 128          1HB       SER 128  13.517  14.368  -2.641
  763    HG   SER 128           HG       SER 128  14.658  16.406  -1.393
  764    H    LYS 129           H        LYS 129  12.240  15.887  -0.190
  765    HA   LYS 129           HA       LYS 129   9.579  14.654   0.018
  766   1HB   LYS 129          2HB       LYS 129  10.607  17.308   1.038
  767   2HB   LYS 129          1HB       LYS 129   8.933  16.781   1.159
  768   1HG   LYS 129          2HG       LYS 129  10.955  14.926   2.236
  769   2HG   LYS 129          1HG       LYS 129  10.742  16.446   3.106
  770   1HD   LYS 129          2HD       LYS 129   8.537  15.981   3.642
  771   2HD   LYS 129          1HD       LYS 129   8.354  14.830   2.315
  772   1HE   LYS 129          2HE       LYS 129  10.259  13.578   3.715
  773   2HE   LYS 129          1HE       LYS 129   9.471  14.448   5.030
  774   1HZ   LYS 129          1HZ       LYS 129   8.216  12.574   4.999
  775   2HZ   LYS 129          2HZ       LYS 129   8.440  12.294   3.346
  776   3HZ   LYS 129          3HZ       LYS 129   7.341  13.472   3.861
  777    H    HIS 130           H        HIS 130  11.071  17.677  -1.160
  778    HA   HIS 130           HA       HIS 130   9.222  17.589  -3.445
  779   1HB   HIS 130          2HB       HIS 130   8.644  19.286  -1.563
  780   2HB   HIS 130          1HB       HIS 130  10.011  20.200  -2.189
  781    HD1  HIS 130           1HD      HIS 130   9.200  21.999  -3.665
  782    HD2  HIS 130           2HD      HIS 130   6.913  18.550  -4.049
  783    HE1  HIS 130           1HE      HIS 130   7.479  22.526  -5.421
  784    HE2  HIS 130           2HE      HIS 130   6.058  20.451  -5.582
  785    H    LYS 131           H        LYS 131  12.136  19.181  -2.157
  786    HA   LYS 131           HA       LYS 131  13.640  18.533  -4.503
  787   1HB   LYS 131          2HB       LYS 131  12.136  20.756  -4.838
  788   2HB   LYS 131          1HB       LYS 131  13.579  21.467  -4.128
  789   1HG   LYS 131          2HG       LYS 131  14.944  20.449  -5.882
  790   2HG   LYS 131          1HG       LYS 131  13.493  19.741  -6.595
  791   1HD   LYS 131          2HD       LYS 131  12.775  22.356  -6.418
  792   2HD   LYS 131          1HD       LYS 131  14.509  22.497  -6.711
  793   1HE   LYS 131          2HE       LYS 131  14.365  21.330  -8.749
  794   2HE   LYS 131          1HE       LYS 131  12.748  20.730  -8.384
  795   1HZ   LYS 131          1HZ       LYS 131  11.788  22.664  -9.010
  796   2HZ   LYS 131          2HZ       LYS 131  13.169  22.780  -9.978
  797   3HZ   LYS 131          3HZ       LYS 131  13.090  23.623  -8.515
  Start of MODEL   14
    1   2H    ALA   1          HN2       ALA   1 -20.221  -0.616 -14.130
    2    H    ALA   1           H        ALA   1 -18.918  -1.458 -13.398
    3   3H    ALA   1          HN3       ALA   1 -20.107  -0.706 -12.420
    4    HA   ALA   1           HA       ALA   1 -17.988   0.497 -14.035
    5   1HB   ALA   1          1HB       ALA   1 -19.305   2.660 -13.172
    6   2HB   ALA   1          2HB       ALA   1 -20.671   1.575 -13.428
    7   3HB   ALA   1          3HB       ALA   1 -19.573   1.939 -14.759
    8    H    SER   2           H        SER   2 -19.943   0.737 -11.058
    9    HA   SER   2           HA       SER   2 -17.481   1.403  -9.594
   10   1HB   SER   2          2HB       SER   2 -19.796   2.793  -9.606
   11   2HB   SER   2          1HB       SER   2 -20.107   1.706  -8.252
   12    HG   SER   2           HG       SER   2 -17.844   3.396  -8.547
   13    H    MET   3           H        MET   3 -18.190   0.795  -7.042
   14    HA   MET   3           HA       MET   3 -19.371  -1.715  -6.632
   15   1HB   MET   3          2HB       MET   3 -16.637  -1.777  -7.611
   16   2HB   MET   3          1HB       MET   3 -16.773  -2.542  -6.033
   17   1HG   MET   3          2HG       MET   3 -18.712  -3.243  -8.186
   18   2HG   MET   3          1HG       MET   3 -17.091  -3.936  -8.201
   19   1HE   MET   3          1HE       MET   3 -19.582  -3.074  -5.187
   20   2HE   MET   3          2HE       MET   3 -20.338  -4.658  -5.022
   21   3HE   MET   3          3HE       MET   3 -20.532  -3.739  -6.516
   22    H    THR   4           H        THR   4 -16.395  -0.113  -5.488
   23    HA   THR   4           HA       THR   4 -17.697   0.429  -2.933
   24    HB   THR   4           HB       THR   4 -16.623  -1.731  -2.584
   25    HG1  THR   4           1HG      THR   4 -16.479  -0.530  -0.781
   26   1HG2  THR   4          1HG2      THR   4 -14.240  -2.046  -2.732
   27   2HG2  THR   4          2HG2      THR   4 -14.033  -0.402  -3.337
   28   3HG2  THR   4          3HG2      THR   4 -14.888  -1.600  -4.310
   29    H    ASP   5           H        ASP   5 -17.335   2.472  -2.404
   30    HA   ASP   5           HA       ASP   5 -15.343   4.015  -3.791
   31   1HB   ASP   5          2HB       ASP   5 -17.377   4.725  -1.676
   32   2HB   ASP   5          1HB       ASP   5 -16.249   5.897  -2.362
   33    H    GLN   6           H        GLN   6 -15.068   1.995  -1.222
   34    HA   GLN   6           HA       GLN   6 -13.748   3.365   0.778
   35   1HB   GLN   6          2HB       GLN   6 -12.678   1.250   1.345
   36   2HB   GLN   6          1HB       GLN   6 -14.362   0.986   0.915
   37   1HG   GLN   6          2HG       GLN   6 -13.454   0.459  -1.433
   38   2HG   GLN   6          1HG       GLN   6 -11.895   0.298  -0.627
   39   1HE2  GLN   6          1HE2      GLN   6 -12.248  -1.912  -1.591
   40   2HE2  GLN   6          2HE2      GLN   6 -13.033  -3.081  -0.591
   41    H    GLN   7           H        GLN   7 -12.557   2.306  -2.344
   42    HA   GLN   7           HA       GLN   7  -9.808   2.857  -1.830
   43   1HB   GLN   7          2HB       GLN   7 -10.886   2.965  -4.607
   44   2HB   GLN   7          1HB       GLN   7  -9.397   2.243  -4.013
   45   1HG   GLN   7          2HG       GLN   7 -11.033   0.566  -2.843
   46   2HG   GLN   7          1HG       GLN   7 -12.150   1.115  -4.093
   47   1HE2  GLN   7          1HE2      GLN   7 -11.654  -1.421  -4.236
   48   2HE2  GLN   7          2HE2      GLN   7 -10.525  -1.819  -5.482
   49    H    ALA   8           H        ALA   8 -12.478   4.850  -2.369
   50    HA   ALA   8           HA       ALA   8 -10.950   6.996  -3.589
   51   1HB   ALA   8          1HB       ALA   8 -13.700   7.518  -2.658
   52   2HB   ALA   8          2HB       ALA   8 -13.520   6.283  -3.905
   53   3HB   ALA   8          3HB       ALA   8 -12.922   7.918  -4.189
   54    H    GLU   9           H        GLU   9 -12.836   6.483  -0.608
   55    HA   GLU   9           HA       GLU   9 -12.252   8.912   0.628
   56   1HB   GLU   9          2HB       GLU   9 -12.563   6.314   2.124
   57   2HB   GLU   9          1HB       GLU   9 -13.008   7.930   2.653
   58   1HG   GLU   9          2HG       GLU   9 -14.452   7.492   0.302
   59   2HG   GLU   9          1HG       GLU   9 -14.553   5.982   1.215
   60    H    ALA  10           H        ALA  10 -10.531   5.829   0.726
   61    HA   ALA  10           HA       ALA  10  -8.617   6.195   2.594
   62   1HB   ALA  10          1HB       ALA  10  -8.922   4.626   0.215
   63   2HB   ALA  10          2HB       ALA  10  -8.043   4.247   1.701
   64   3HB   ALA  10          3HB       ALA  10  -7.238   5.124   0.399
   65    H    ARG  11           H        ARG  11  -8.162   7.156  -0.818
   66    HA   ARG  11           HA       ARG  11  -5.739   8.452  -0.546
   67   1HB   ARG  11          2HB       ARG  11  -7.840   8.322  -2.516
   68   2HB   ARG  11          1HB       ARG  11  -7.204   9.958  -2.424
   69   1HG   ARG  11          2HG       ARG  11  -4.910   8.987  -2.681
   70   2HG   ARG  11          1HG       ARG  11  -5.679   7.431  -3.001
   71   1HD   ARG  11          2HD       ARG  11  -5.149   8.510  -5.092
   72   2HD   ARG  11          1HD       ARG  11  -6.899   8.458  -4.885
   73    HE   ARG  11           HE       ARG  11  -6.228  10.888  -3.901
   74   1HH1  ARG  11          1HH1      ARG  11  -5.552   9.258  -6.912
   75   2HH1  ARG  11          2HH1      ARG  11  -5.475  10.723  -7.832
   76   1HH2  ARG  11          1HH2      ARG  11  -6.127  12.816  -5.109
   77   2HH2  ARG  11          2HH2      ARG  11  -5.800  12.743  -6.809
   78    H    ALA  12           H        ALA  12  -8.898   9.496   0.419
   79    HA   ALA  12           HA       ALA  12  -8.007  12.232   0.889
   80   1HB   ALA  12          1HB       ALA  12 -10.218  11.891  -0.092
   81   2HB   ALA  12          2HB       ALA  12 -10.333  12.679   1.482
   82   3HB   ALA  12          3HB       ALA  12 -10.709  10.963   1.325
   83    H    PHE  13           H        PHE  13  -8.480   9.260   2.587
   84    HA   PHE  13           HA       PHE  13  -8.862  10.303   5.190
   85   1HB   PHE  13          2HB       PHE  13  -8.377   7.695   3.972
   86   2HB   PHE  13          1HB       PHE  13  -7.581   7.867   5.538
   87    HD1  PHE  13           1HD      PHE  13 -10.292   6.462   4.204
   88    HD2  PHE  13           2HD      PHE  13  -9.360   9.388   7.150
   89    HE1  PHE  13           1HE      PHE  13 -12.428   5.999   5.333
   90    HE2  PHE  13           2HE      PHE  13 -11.494   8.929   8.286
   91    HZ   PHE  13           HZ       PHE  13 -13.032   7.232   7.378
   92    H    LEU  14           H        LEU  14  -6.068   9.927   3.184
   93    HA   LEU  14           HA       LEU  14  -4.331  10.618   5.459
   94   1HB   LEU  14          2HB       LEU  14  -3.307   9.580   2.840
   95   2HB   LEU  14          1HB       LEU  14  -2.545   9.527   4.425
   96    HG   LEU  14           HG       LEU  14  -5.036   7.951   3.832
   97   1HD1  LEU  14          1HD1      LEU  14  -2.934   7.549   2.289
   98   2HD1  LEU  14          2HD1      LEU  14  -3.882   6.206   2.927
   99   3HD1  LEU  14          3HD1      LEU  14  -2.365   6.661   3.702
  100   1HD2  LEU  14          1HD2      LEU  14  -2.807   7.613   5.835
  101   2HD2  LEU  14          2HD2      LEU  14  -4.224   6.575   5.676
  102   3HD2  LEU  14          3HD2      LEU  14  -4.414   8.256   6.174
  103    H    SER  15           H        SER  15  -2.298  11.844   4.660
  104    HA   SER  15           HA       SER  15  -3.260  14.227   3.289
  105   1HB   SER  15          2HB       SER  15  -1.720  13.980   5.488
  106   2HB   SER  15          1HB       SER  15  -0.451  14.078   4.258
  107    HG   SER  15           HG       SER  15  -1.004  16.147   4.986
  108    H    GLU  16           H        GLU  16  -1.808  15.297   1.686
  109    HA   GLU  16           HA       GLU  16  -1.344  13.737  -0.542
  110   1HB   GLU  16          2HB       GLU  16  -1.121  16.420   0.059
  111   2HB   GLU  16          1HB       GLU  16   0.538  15.973  -0.314
  112   1HG   GLU  16          2HG       GLU  16  -1.718  15.239  -2.140
  113   2HG   GLU  16          1HG       GLU  16  -0.951  16.826  -2.211
  114    H    GLU  17           H        GLU  17   0.642  14.248   2.247
  115    HA   GLU  17           HA       GLU  17   3.140  13.445   1.271
  116   1HB   GLU  17          2HB       GLU  17   1.834  13.684   3.919
  117   2HB   GLU  17          1HB       GLU  17   3.222  12.604   3.842
  118   1HG   GLU  17          2HG       GLU  17   3.947  14.788   4.514
  119   2HG   GLU  17          1HG       GLU  17   4.564  14.441   2.900
  120    H    MET  18           H        MET  18   0.715  11.537   3.061
  121    HA   MET  18           HA       MET  18   1.996   9.065   2.803
  122   1HB   MET  18          2HB       MET  18  -0.234   9.958   4.095
  123   2HB   MET  18          1HB       MET  18  -0.951   8.986   2.810
  124   1HG   MET  18          2HG       MET  18  -0.729   7.455   4.505
  125   2HG   MET  18          1HG       MET  18   0.745   7.182   3.577
  126   1HE   MET  18          1HE       MET  18  -0.251   7.004   7.143
  127   2HE   MET  18          2HE       MET  18   1.445   6.690   7.512
  128   3HE   MET  18          3HE       MET  18   0.686   5.915   6.121
  129    H    ILE  19           H        ILE  19   0.245  10.914   0.489
  130    HA   ILE  19           HA       ILE  19  -0.388   8.665  -1.217
  131    HB   ILE  19           HB       ILE  19  -0.677  11.646  -1.554
  132   1HG1  ILE  19          2HG1      ILE  19  -2.741   9.434  -1.563
  133   2HG1  ILE  19          1HG1      ILE  19  -2.295  10.361  -0.128
  134   1HG2  ILE  19          1HG2      ILE  19  -2.016  10.771  -3.677
  135   2HG2  ILE  19          2HG2      ILE  19  -0.784   9.508  -3.610
  136   3HG2  ILE  19          3HG2      ILE  19  -0.306  11.200  -3.755
  137   1HD1  ILE  19          1HD1      ILE  19  -4.247  10.974  -2.035
  138   2HD1  ILE  19          2HD1      ILE  19  -2.949  12.145  -2.267
  139   3HD1  ILE  19          3HD1      ILE  19  -3.705  11.967  -0.683
  140    H    ALA  20           H        ALA  20   1.547  11.621  -1.741
  141    HA   ALA  20           HA       ALA  20   2.880  10.869  -4.015
  142   1HB   ALA  20          1HB       ALA  20   3.937  12.509  -1.718
  143   2HB   ALA  20          2HB       ALA  20   3.029  13.100  -3.109
  144   3HB   ALA  20          3HB       ALA  20   4.652  12.442  -3.329
  145    H    GLU  21           H        GLU  21   3.346   9.701  -0.795
  146    HA   GLU  21           HA       GLU  21   5.891   8.450  -1.410
  147   1HB   GLU  21          2HB       GLU  21   4.188   8.434   1.090
  148   2HB   GLU  21          1HB       GLU  21   5.756   7.655   0.948
  149   1HG   GLU  21          2HG       GLU  21   6.901   9.636   0.943
  150   2HG   GLU  21          1HG       GLU  21   5.534  10.548   0.306
  151    H    PHE  22           H        PHE  22   2.505   7.666  -1.083
  152    HA   PHE  22           HA       PHE  22   2.695   4.870  -0.888
  153   1HB   PHE  22          2HB       PHE  22   0.479   5.138  -0.681
  154   2HB   PHE  22          1HB       PHE  22   0.631   6.816  -1.180
  155    HD1  PHE  22           1HD      PHE  22  -0.893   3.757  -1.892
  156    HD2  PHE  22           2HD      PHE  22   0.808   7.154  -3.808
  157    HE1  PHE  22           1HE      PHE  22  -2.194   3.263  -3.921
  158    HE2  PHE  22           2HE      PHE  22  -0.488   6.665  -5.838
  159    HZ   PHE  22           HZ       PHE  22  -1.992   4.716  -5.897
  160    H    LYS  23           H        LYS  23   2.880   7.074  -3.581
  161    HA   LYS  23           HA       LYS  23   2.749   5.043  -5.602
  162   1HB   LYS  23          2HB       LYS  23   2.130   7.537  -5.816
  163   2HB   LYS  23          1HB       LYS  23   3.865   7.812  -5.984
  164   1HG   LYS  23          2HG       LYS  23   3.028   7.692  -8.171
  165   2HG   LYS  23          1HG       LYS  23   3.804   6.134  -7.882
  166   1HD   LYS  23          2HD       LYS  23   1.592   5.173  -7.336
  167   2HD   LYS  23          1HD       LYS  23   0.849   6.728  -7.736
  168   1HE   LYS  23          2HE       LYS  23   2.604   5.319  -9.711
  169   2HE   LYS  23          1HE       LYS  23   0.914   4.853  -9.525
  170   1HZ   LYS  23          1HZ       LYS  23   0.198   6.735 -10.494
  171   2HZ   LYS  23          2HZ       LYS  23   1.744   6.762 -11.182
  172   3HZ   LYS  23          3HZ       LYS  23   1.411   7.699  -9.813
  173    H    ALA  24           H        ALA  24   5.134   6.097  -3.459
  174    HA   ALA  24           HA       ALA  24   7.512   6.141  -4.770
  175   1HB   ALA  24          1HB       ALA  24   6.883   4.802  -2.146
  176   2HB   ALA  24          2HB       ALA  24   7.417   6.464  -2.405
  177   3HB   ALA  24          3HB       ALA  24   8.516   5.122  -2.730
  178    H    ALA  25           H        ALA  25   6.679   3.113  -3.130
  179    HA   ALA  25           HA       ALA  25   8.315   1.573  -4.862
  180   1HB   ALA  25          1HB       ALA  25   6.212   0.510  -2.994
  181   2HB   ALA  25          2HB       ALA  25   7.798   1.064  -2.457
  182   3HB   ALA  25          3HB       ALA  25   7.669  -0.302  -3.565
  183    H    PHE  26           H        PHE  26   5.243   2.809  -5.370
  184    HA   PHE  26           HA       PHE  26   3.710   0.856  -6.486
  185   1HB   PHE  26          2HB       PHE  26   3.163   3.309  -6.298
  186   2HB   PHE  26          1HB       PHE  26   4.089   3.559  -7.774
  187    HD1  PHE  26           1HD      PHE  26   3.319   2.516  -9.895
  188    HD2  PHE  26           2HD      PHE  26   0.960   2.466  -6.353
  189    HE1  PHE  26           1HE      PHE  26   1.325   1.986 -11.235
  190    HE2  PHE  26           2HE      PHE  26  -1.037   1.935  -7.687
  191    HZ   PHE  26           HZ       PHE  26  -0.856   1.694 -10.131
  192    H    ASP  27           H        ASP  27   6.660   2.183  -7.783
  193    HA   ASP  27           HA       ASP  27   6.283   1.006 -10.395
  194   1HB   ASP  27          2HB       ASP  27   7.741   3.124  -9.544
  195   2HB   ASP  27          1HB       ASP  27   8.989   1.882  -9.582
  196    H    MET  28           H        MET  28   8.719   0.554  -7.822
  197    HA   MET  28           HA       MET  28   9.845  -1.777  -8.874
  198   1HB   MET  28          2HB       MET  28   9.775  -0.532  -6.157
  199   2HB   MET  28          1HB       MET  28  10.418  -2.159  -6.332
  200   1HG   MET  28          2HG       MET  28  11.735  -0.894  -8.318
  201   2HG   MET  28          1HG       MET  28  11.545   0.424  -7.156
  202   1HE   MET  28          1HE       MET  28  13.521   1.006  -6.422
  203   2HE   MET  28          2HE       MET  28  14.728  -0.001  -7.221
  204   3HE   MET  28          3HE       MET  28  14.683   0.092  -5.461
  205    H    PHE  29           H        PHE  29   6.967  -1.281  -6.982
  206    HA   PHE  29           HA       PHE  29   6.545  -3.822  -5.938
  207   1HB   PHE  29          2HB       PHE  29   4.937  -1.448  -6.482
  208   2HB   PHE  29          1HB       PHE  29   4.007  -2.938  -6.657
  209    HD1  PHE  29           1HD      PHE  29   4.968  -0.469  -4.416
  210    HD2  PHE  29           2HD      PHE  29   4.448  -4.680  -4.686
  211    HE1  PHE  29           1HE      PHE  29   4.706  -0.586  -1.975
  212    HE2  PHE  29           2HE      PHE  29   4.179  -4.805  -2.248
  213    HZ   PHE  29           HZ       PHE  29   4.310  -2.759  -0.884
  214    H    ASP  30           H        ASP  30   4.794  -2.594  -8.783
  215    HA   ASP  30           HA       ASP  30   3.977  -5.081  -9.719
  216   1HB   ASP  30          2HB       ASP  30   4.369  -2.441 -11.121
  217   2HB   ASP  30          1HB       ASP  30   3.726  -3.864 -11.950
  218    H    ALA  31           H        ALA  31   5.094  -6.712 -10.492
  219    HA   ALA  31           HA       ALA  31   7.785  -6.272 -11.544
  220   1HB   ALA  31          1HB       ALA  31   7.335  -8.000  -9.783
  221   2HB   ALA  31          2HB       ALA  31   8.156  -8.602 -11.223
  222   3HB   ALA  31          3HB       ALA  31   6.433  -8.905 -10.998
  223    H    ASP  32           H        ASP  32   4.744  -7.863 -12.449
  224    HA   ASP  32           HA       ASP  32   5.637  -8.529 -15.082
  225   1HB   ASP  32          2HB       ASP  32   3.227  -9.082 -15.471
  226   2HB   ASP  32          1HB       ASP  32   3.928  -9.888 -14.064
  227    H    GLY  33           H        GLY  33   4.360  -5.704 -13.617
  228   1HA   GLY  33          2HA       GLY  33   4.801  -3.746 -15.206
  229   2HA   GLY  33          1HA       GLY  33   3.664  -4.581 -16.253
  230    H    GLY  34           H        GLY  34   1.460  -4.888 -15.439
  231   1HA   GLY  34          2HA       GLY  34   0.708  -2.958 -13.347
  232   2HA   GLY  34          1HA       GLY  34  -0.071  -2.877 -14.925
  233    H    GLY  35           H        GLY  35   0.783  -5.575 -12.750
  234   1HA   GLY  35          2HA       GLY  35  -2.002  -6.512 -13.028
  235   2HA   GLY  35          1HA       GLY  35  -0.617  -7.554 -12.709
  236    H    ASP  36           H        ASP  36  -1.326  -4.480 -11.133
  237    HA   ASP  36           HA       ASP  36  -1.673  -3.928  -8.956
  238   1HB   ASP  36          2HB       ASP  36  -3.139  -6.552  -9.126
  239   2HB   ASP  36          1HB       ASP  36  -3.067  -5.636  -7.617
  240    H    ILE  37           H        ILE  37  -1.507  -5.040  -6.584
  241    HA   ILE  37           HA       ILE  37   1.130  -6.344  -6.576
  242    HB   ILE  37           HB       ILE  37  -0.173  -4.495  -4.586
  243   1HG1  ILE  37          2HG1      ILE  37   2.523  -4.294  -5.929
  244   2HG1  ILE  37          1HG1      ILE  37   1.052  -3.605  -6.624
  245   1HG2  ILE  37          1HG2      ILE  37   0.865  -5.627  -2.971
  246   2HG2  ILE  37          2HG2      ILE  37   2.360  -4.965  -3.630
  247   3HG2  ILE  37          3HG2      ILE  37   1.815  -6.567  -4.119
  248   1HD1  ILE  37          1HD1      ILE  37   2.181  -2.904  -3.925
  249   2HD1  ILE  37          2HD1      ILE  37   0.789  -2.161  -4.714
  250   3HD1  ILE  37          3HD1      ILE  37   2.402  -1.963  -5.400
  251    H    SER  38           H        SER  38   1.330  -8.312  -5.739
  252    HA   SER  38           HA       SER  38  -0.982  -9.496  -4.377
  253   1HB   SER  38          2HB       SER  38  -0.065 -10.606  -6.443
  254   2HB   SER  38          1HB       SER  38   1.423 -10.922  -5.541
  255    HG   SER  38           HG       SER  38   0.433 -12.638  -4.863
  256    H    THR  39           H        THR  39   0.365 -11.634  -3.136
  257    HA   THR  39           HA       THR  39   1.239 -10.347  -0.742
  258    HB   THR  39           HB       THR  39   1.720 -12.750  -0.024
  259    HG1  THR  39           1HG      THR  39   0.781 -14.325  -1.408
  260   1HG2  THR  39          1HG2      THR  39  -1.009 -11.916  -0.943
  261   2HG2  THR  39          2HG2      THR  39  -0.340 -11.890   0.688
  262   3HG2  THR  39          3HG2      THR  39  -0.714 -13.430  -0.087
  263    H    LYS  40           H        LYS  40   2.839 -12.101  -3.350
  264    HA   LYS  40           HA       LYS  40   5.407 -12.132  -2.107
  265   1HB   LYS  40          2HB       LYS  40   4.315 -12.798  -4.797
  266   2HB   LYS  40          1HB       LYS  40   6.047 -12.489  -4.672
  267   1HG   LYS  40          2HG       LYS  40   6.394 -14.310  -3.262
  268   2HG   LYS  40          1HG       LYS  40   4.681 -14.427  -2.840
  269   1HD   LYS  40          2HD       LYS  40   5.098 -16.218  -4.319
  270   2HD   LYS  40          1HD       LYS  40   4.269 -14.991  -5.279
  271   1HE   LYS  40          2HE       LYS  40   6.259 -14.340  -6.355
  272   2HE   LYS  40          1HE       LYS  40   7.265 -15.183  -5.178
  273   1HZ   LYS  40          1HZ       LYS  40   6.339 -17.289  -6.021
  274   2HZ   LYS  40          2HZ       LYS  40   7.192 -16.434  -7.204
  275   3HZ   LYS  40          3HZ       LYS  40   5.501 -16.431  -7.215
  276    H    GLU  41           H        GLU  41   3.697  -9.905  -4.179
  277    HA   GLU  41           HA       GLU  41   5.887  -8.372  -5.061
  278   1HB   GLU  41          2HB       GLU  41   2.951  -7.865  -4.783
  279   2HB   GLU  41          1HB       GLU  41   4.026  -6.542  -5.215
  280   1HG   GLU  41          2HG       GLU  41   4.718  -8.680  -6.890
  281   2HG   GLU  41          1HG       GLU  41   2.957  -8.638  -6.852
  282    H    LEU  42           H        LEU  42   4.162  -8.446  -2.044
  283    HA   LEU  42           HA       LEU  42   5.093  -5.888  -1.137
  284   1HB   LEU  42          2HB       LEU  42   3.330  -7.976  -0.175
  285   2HB   LEU  42          1HB       LEU  42   4.382  -7.388   1.106
  286    HG   LEU  42           HG       LEU  42   2.293  -6.168   1.128
  287   1HD1  LEU  42          1HD1      LEU  42   4.288  -4.945   1.766
  288   2HD1  LEU  42          2HD1      LEU  42   3.150  -3.880   0.942
  289   3HD1  LEU  42          3HD1      LEU  42   4.569  -4.484   0.086
  290   1HD2  LEU  42          1HD2      LEU  42   2.434  -4.591  -1.205
  291   2HD2  LEU  42          2HD2      LEU  42   1.196  -5.764  -0.755
  292   3HD2  LEU  42          3HD2      LEU  42   2.587  -6.274  -1.711
  293    H    GLY  43           H        GLY  43   5.946  -9.263  -0.421
  294   1HA   GLY  43          2HA       GLY  43   7.943  -8.775   1.461
  295   2HA   GLY  43          1HA       GLY  43   7.877 -10.185   0.407
  296    H    THR  44           H        THR  44   7.973  -8.071  -1.890
  297    HA   THR  44           HA       THR  44  10.788  -8.290  -2.299
  298    HB   THR  44           HB       THR  44   8.460  -7.216  -3.827
  299    HG1  THR  44           1HG      THR  44   9.297  -8.632  -5.369
  300   1HG2  THR  44          1HG2      THR  44   9.764  -5.437  -4.449
  301   2HG2  THR  44          2HG2      THR  44  10.213  -6.641  -5.659
  302   3HG2  THR  44          3HG2      THR  44  11.272  -6.339  -4.281
  303    H    VAL  45           H        VAL  45   8.893  -5.331  -2.666
  304    HA   VAL  45           HA       VAL  45  11.012  -3.585  -2.199
  305    HB   VAL  45           HB       VAL  45   9.018  -2.891  -3.376
  306   1HG1  VAL  45          1HG1      VAL  45   6.903  -2.500  -2.222
  307   2HG1  VAL  45          2HG1      VAL  45   7.592  -3.133  -0.728
  308   3HG1  VAL  45          3HG1      VAL  45   7.384  -4.193  -2.123
  309   1HG2  VAL  45          1HG2      VAL  45   9.437  -0.785  -2.803
  310   2HG2  VAL  45          2HG2      VAL  45  10.333  -1.386  -1.408
  311   3HG2  VAL  45          3HG2      VAL  45   8.619  -0.995  -1.254
  312    H    MET  46           H        MET  46   8.494  -4.713   0.048
  313    HA   MET  46           HA       MET  46   9.192  -3.060   2.193
  314   1HB   MET  46          2HB       MET  46   7.777  -5.703   2.019
  315   2HB   MET  46          1HB       MET  46   8.099  -4.949   3.580
  316   1HG   MET  46          2HG       MET  46   7.013  -2.883   2.172
  317   2HG   MET  46          1HG       MET  46   6.135  -4.272   1.523
  318   1HE   MET  46          1HE       MET  46   5.727  -1.533   3.795
  319   2HE   MET  46          2HE       MET  46   7.049  -2.222   4.741
  320   3HE   MET  46          3HE       MET  46   5.421  -2.158   5.416
  321    H    ARG  47           H        ARG  47  10.675  -5.988   1.034
  322    HA   ARG  47           HA       ARG  47  12.131  -6.495   3.469
  323   1HB   ARG  47          2HB       ARG  47  12.063  -7.698   0.739
  324   2HB   ARG  47          1HB       ARG  47  13.460  -8.009   1.758
  325   1HG   ARG  47          2HG       ARG  47  11.947  -8.869   3.511
  326   2HG   ARG  47          1HG       ARG  47  10.590  -8.646   2.404
  327   1HD   ARG  47          2HD       ARG  47  11.741 -10.155   0.791
  328   2HD   ARG  47          1HD       ARG  47  12.971 -10.459   2.024
  329    HE   ARG  47           HE       ARG  47  10.283 -10.980   2.908
  330   1HH1  ARG  47          1HH1      ARG  47  13.076 -12.310   1.290
  331   2HH1  ARG  47          2HH1      ARG  47  12.659 -13.951   1.650
  332   1HH2  ARG  47          1HH2      ARG  47   9.734 -13.140   3.382
  333   2HH2  ARG  47          2HH2      ARG  47  10.762 -14.423   2.837
  334    H    MET  48           H        MET  48  12.876  -5.115   0.296
  335    HA   MET  48           HA       MET  48  15.626  -4.615   1.015
  336   1HB   MET  48          2HB       MET  48  15.752  -3.524  -1.211
  337   2HB   MET  48          1HB       MET  48  15.151  -5.180  -1.276
  338   1HG   MET  48          2HG       MET  48  13.204  -4.553  -2.147
  339   2HG   MET  48          1HG       MET  48  13.023  -3.219  -1.009
  340   1HE   MET  48          1HE       MET  48  12.419  -1.146  -2.036
  341   2HE   MET  48          2HE       MET  48  11.766  -2.128  -3.349
  342   3HE   MET  48          3HE       MET  48  12.732  -0.698  -3.714
  343    H    LEU  49           H        LEU  49  12.955  -3.148   2.076
  344    HA   LEU  49           HA       LEU  49  14.133  -0.457   1.925
  345   1HB   LEU  49          2HB       LEU  49  11.289  -1.379   2.180
  346   2HB   LEU  49          1HB       LEU  49  11.761   0.243   2.654
  347    HG   LEU  49           HG       LEU  49  11.913  -0.972  -0.102
  348   1HD1  LEU  49          1HD1      LEU  49  10.243   1.131   1.212
  349   2HD1  LEU  49          2HD1      LEU  49   9.746  -0.222   0.199
  350   3HD1  LEU  49          3HD1      LEU  49  10.535   1.177  -0.526
  351   1HD2  LEU  49          1HD2      LEU  49  12.623   1.534  -0.570
  352   2HD2  LEU  49          2HD2      LEU  49  13.812   0.285  -0.204
  353   3HD2  LEU  49          3HD2      LEU  49  13.281   1.393   1.060
  354    H    GLY  50           H        GLY  50  13.087  -3.002   4.044
  355   1HA   GLY  50          2HA       GLY  50  14.506  -2.623   6.213
  356   2HA   GLY  50          1HA       GLY  50  13.390  -1.271   6.393
  357    H    GLN  51           H        GLN  51  11.069  -2.589   5.384
  358    HA   GLN  51           HA       GLN  51  10.190  -3.859   7.761
  359   1HB   GLN  51          2HB       GLN  51   8.985  -2.728   5.510
  360   2HB   GLN  51          1HB       GLN  51   8.516  -4.427   5.455
  361   1HG   GLN  51          2HG       GLN  51   6.833  -3.671   6.750
  362   2HG   GLN  51          1HG       GLN  51   8.017  -3.951   8.026
  363   1HE2  GLN  51          1HE2      GLN  51   8.530  -2.312   9.307
  364   2HE2  GLN  51          2HE2      GLN  51   8.126  -0.655   9.030
  365    H    ASN  52           H        ASN  52   9.306  -6.035   7.934
  366    HA   ASN  52           HA       ASN  52  10.368  -7.983   6.038
  367   1HB   ASN  52          2HB       ASN  52  10.984  -8.014   8.996
  368   2HB   ASN  52          1HB       ASN  52  11.301  -9.356   7.894
  369   1HD2  ASN  52          1HD2      ASN  52  12.983  -9.223   6.450
  370   2HD2  ASN  52          2HD2      ASN  52  14.191  -7.991   6.529
  371    HA   PRO  53           HA       PRO  53   6.145  -8.912   7.973
  372   1HB   PRO  53          2HB       PRO  53   4.626  -8.536   5.766
  373   2HB   PRO  53          1HB       PRO  53   5.009  -7.226   6.889
  374   1HG   PRO  53          2HG       PRO  53   6.284  -7.904   4.265
  375   2HG   PRO  53          1HG       PRO  53   5.810  -6.319   4.901
  376   1HD   PRO  53          2HD       PRO  53   8.368  -7.217   4.973
  377   2HD   PRO  53          1HD       PRO  53   7.694  -6.141   6.220
  378    H    THR  54           H        THR  54   6.372 -11.079   8.148
  379    HA   THR  54           HA       THR  54   7.262 -12.855   6.213
  380    HB   THR  54           HB       THR  54   6.120 -14.615   7.582
  381    HG1  THR  54           1HG      THR  54   4.341 -13.675   8.384
  382   1HG2  THR  54          1HG2      THR  54   7.294 -14.149   9.716
  383   2HG2  THR  54          2HG2      THR  54   7.705 -12.553   9.089
  384   3HG2  THR  54          3HG2      THR  54   8.314 -13.999   8.285
  385    H    LYS  55           H        LYS  55   5.714 -14.823   5.574
  386    HA   LYS  55           HA       LYS  55   4.103 -13.929   3.492
  387   1HB   LYS  55          2HB       LYS  55   4.621 -16.512   4.819
  388   2HB   LYS  55          1HB       LYS  55   3.076 -16.407   3.975
  389   1HG   LYS  55          2HG       LYS  55   5.517 -15.494   2.551
  390   2HG   LYS  55          1HG       LYS  55   5.267 -17.227   2.766
  391   1HD   LYS  55          2HD       LYS  55   4.183 -16.905   0.773
  392   2HD   LYS  55          1HD       LYS  55   2.849 -16.645   1.898
  393   1HE   LYS  55          2HE       LYS  55   2.639 -14.497   1.314
  394   2HE   LYS  55          1HE       LYS  55   4.380 -14.224   1.370
  395   1HZ   LYS  55          1HZ       LYS  55   4.619 -15.017  -0.827
  396   2HZ   LYS  55          2HZ       LYS  55   3.317 -13.939  -0.860
  397   3HZ   LYS  55          3HZ       LYS  55   3.034 -15.606  -0.880
  398    H    CYS  56           H        CYS  56   3.032 -15.361   6.582
  399    HA   CYS  56           HA       CYS  56   0.297 -14.884   6.205
  400   1HB   CYS  56          2HB       CYS  56   2.015 -15.378   8.615
  401   2HB   CYS  56          1HB       CYS  56   0.317 -14.944   8.823
  402    HG   CYS  56           HG       CYS  56   0.630 -17.564   8.745
  403    H    GLU  57           H        GLU  57   2.877 -12.820   7.305
  404    HA   GLU  57           HA       GLU  57   1.419 -10.831   8.611
  405   1HB   GLU  57          2HB       GLU  57   4.068 -11.237   7.928
  406   2HB   GLU  57          1HB       GLU  57   3.633  -9.796   7.008
  407   1HG   GLU  57          2HG       GLU  57   3.079 -10.065   9.946
  408   2HG   GLU  57          1HG       GLU  57   4.602  -9.439   9.318
  409    H    LEU  58           H        LEU  58   2.606 -10.751   5.245
  410    HA   LEU  58           HA       LEU  58   1.029  -8.508   4.533
  411   1HB   LEU  58          2HB       LEU  58   2.142 -10.566   2.632
  412   2HB   LEU  58          1HB       LEU  58   1.766  -8.882   2.293
  413    HG   LEU  58           HG       LEU  58   3.886  -9.620   4.292
  414   1HD1  LEU  58          1HD1      LEU  58   5.327  -8.993   2.110
  415   2HD1  LEU  58          2HD1      LEU  58   3.977  -9.843   1.356
  416   3HD1  LEU  58          3HD1      LEU  58   4.947 -10.647   2.591
  417   1HD2  LEU  58          1HD2      LEU  58   3.583  -7.378   4.512
  418   2HD2  LEU  58          2HD2      LEU  58   2.982  -7.183   2.866
  419   3HD2  LEU  58          3HD2      LEU  58   4.713  -7.359   3.158
  420    H    ASP  59           H        ASP  59   0.471 -11.949   4.504
  421    HA   ASP  59           HA       ASP  59  -1.785 -11.945   2.779
  422   1HB   ASP  59          2HB       ASP  59  -0.257 -13.913   3.727
  423   2HB   ASP  59          1HB       ASP  59  -1.552 -13.997   4.925
  424    H    ALA  60           H        ALA  60  -1.344 -11.220   6.139
  425    HA   ALA  60           HA       ALA  60  -4.113 -11.507   6.823
  426   1HB   ALA  60          1HB       ALA  60  -1.856 -11.447   8.304
  427   2HB   ALA  60          2HB       ALA  60  -3.467 -11.147   8.956
  428   3HB   ALA  60          3HB       ALA  60  -2.425  -9.792   8.524
  429    H    ILE  61           H        ILE  61  -2.047  -8.962   5.641
  430    HA   ILE  61           HA       ILE  61  -3.965  -6.871   6.166
  431    HB   ILE  61           HB       ILE  61  -1.284  -6.969   4.822
  432   1HG1  ILE  61          2HG1      ILE  61  -0.884  -5.109   6.505
  433   2HG1  ILE  61          1HG1      ILE  61  -2.477  -5.484   7.169
  434   1HG2  ILE  61          1HG2      ILE  61  -3.281  -4.728   4.647
  435   2HG2  ILE  61          2HG2      ILE  61  -2.458  -5.559   3.328
  436   3HG2  ILE  61          3HG2      ILE  61  -1.550  -4.498   4.403
  437   1HD1  ILE  61          1HD1      ILE  61  -0.112  -7.341   7.023
  438   2HD1  ILE  61          2HD1      ILE  61  -1.713  -7.777   7.623
  439   3HD1  ILE  61          3HD1      ILE  61  -0.755  -6.558   8.466
  440    H    ILE  62           H        ILE  62  -2.528  -8.228   3.181
  441    HA   ILE  62           HA       ILE  62  -4.063  -7.034   1.275
  442    HB   ILE  62           HB       ILE  62  -3.160  -9.914   1.322
  443   1HG1  ILE  62          2HG1      ILE  62  -1.969  -7.404   0.118
  444   2HG1  ILE  62          1HG1      ILE  62  -1.332  -8.316   1.488
  445   1HG2  ILE  62          1HG2      ILE  62  -4.834  -8.513  -0.568
  446   2HG2  ILE  62          2HG2      ILE  62  -4.375 -10.215  -0.520
  447   3HG2  ILE  62          3HG2      ILE  62  -3.332  -9.044  -1.325
  448   1HD1  ILE  62          1HD1      ILE  62  -0.492  -9.968   0.165
  449   2HD1  ILE  62          2HD1      ILE  62  -0.348  -8.591  -0.926
  450   3HD1  ILE  62          3HD1      ILE  62  -1.691  -9.720  -1.103
  451    H    CYS  63           H        CYS  63  -4.917 -10.000   3.048
  452    HA   CYS  63           HA       CYS  63  -7.317 -10.618   1.864
  453   1HB   CYS  63          2HB       CYS  63  -5.993 -11.724   3.858
  454   2HB   CYS  63          1HB       CYS  63  -7.106 -10.777   4.848
  455    HG   CYS  63           HG       CYS  63  -9.069 -12.103   3.583
  456    H    GLU  64           H        GLU  64  -6.578  -8.006   4.036
  457    HA   GLU  64           HA       GLU  64  -9.390  -7.296   4.346
  458   1HB   GLU  64          2HB       GLU  64  -6.878  -6.030   5.461
  459   2HB   GLU  64          1HB       GLU  64  -8.513  -5.486   5.809
  460   1HG   GLU  64          2HG       GLU  64  -8.841  -7.974   6.568
  461   2HG   GLU  64          1HG       GLU  64  -7.086  -7.926   6.732
  462    H    VAL  65           H        VAL  65  -6.478  -6.275   2.701
  463    HA   VAL  65           HA       VAL  65  -7.351  -3.736   1.828
  464    HB   VAL  65           HB       VAL  65  -5.462  -5.546   0.325
  465   1HG1  VAL  65          1HG1      VAL  65  -5.635  -2.542   0.515
  466   2HG1  VAL  65          2HG1      VAL  65  -6.181  -3.521  -0.846
  467   3HG1  VAL  65          3HG1      VAL  65  -4.466  -3.460  -0.434
  468   1HG2  VAL  65          1HG2      VAL  65  -3.684  -4.294   1.670
  469   2HG2  VAL  65          2HG2      VAL  65  -4.574  -5.572   2.491
  470   3HG2  VAL  65          3HG2      VAL  65  -4.989  -3.886   2.782
  471    H    ASP  66           H        ASP  66  -7.444  -6.933   0.310
  472    HA   ASP  66           HA       ASP  66  -8.556  -6.197  -2.135
  473   1HB   ASP  66          2HB       ASP  66  -8.530  -8.737  -0.540
  474   2HB   ASP  66          1HB       ASP  66  -9.490  -8.639  -2.016
  475    H    GLU  67           H        GLU  67 -10.199  -7.327   0.818
  476    HA   GLU  67           HA       GLU  67 -12.353  -7.135   1.527
  477   1HB   GLU  67          2HB       GLU  67 -11.676  -4.622   0.258
  478   2HB   GLU  67          1HB       GLU  67 -13.398  -4.964   0.092
  479   1HG   GLU  67          2HG       GLU  67 -12.256  -5.396   2.772
  480   2HG   GLU  67          1HG       GLU  67 -12.305  -3.722   2.208
  481    H    ASP  68           H        ASP  68 -11.724  -8.686  -0.904
  482    HA   ASP  68           HA       ASP  68 -14.446  -9.120  -1.765
  483   1HB   ASP  68          2HB       ASP  68 -13.972  -8.900  -4.159
  484   2HB   ASP  68          1HB       ASP  68 -13.706  -7.371  -3.326
  485    H    GLY  69           H        GLY  69 -11.024  -9.922  -2.280
  486   1HA   GLY  69          2HA       GLY  69 -10.313 -12.186  -1.678
  487   2HA   GLY  69          1HA       GLY  69 -11.819 -12.766  -2.372
  488    H    SER  70           H        SER  70  -9.233 -10.589  -3.498
  489    HA   SER  70           HA       SER  70  -9.075 -12.222  -5.947
  490   1HB   SER  70          2HB       SER  70  -8.098  -9.969  -6.886
  491   2HB   SER  70          1HB       SER  70  -9.849 -10.182  -6.742
  492    HG   SER  70           HG       SER  70  -9.694  -9.080  -4.712
  493    H    GLY  71           H        GLY  71  -7.316 -10.705  -3.360
  494   1HA   GLY  71          2HA       GLY  71  -5.162 -11.135  -2.628
  495   2HA   GLY  71          1HA       GLY  71  -4.966 -12.243  -3.986
  496    H    THR  72           H        THR  72  -6.100  -9.406  -5.245
  497    HA   THR  72           HA       THR  72  -3.371  -8.433  -5.776
  498    HB   THR  72           HB       THR  72  -4.288  -7.595  -7.940
  499    HG1  THR  72           1HG      THR  72  -6.481  -7.527  -7.390
  500   1HG2  THR  72          1HG2      THR  72  -3.537  -9.459  -8.845
  501   2HG2  THR  72          2HG2      THR  72  -5.036 -10.287  -8.420
  502   3HG2  THR  72          3HG2      THR  72  -3.684 -10.273  -7.288
  503    H    ILE  73           H        ILE  73  -2.945  -6.288  -5.560
  504    HA   ILE  73           HA       ILE  73  -5.046  -4.673  -4.306
  505    HB   ILE  73           HB       ILE  73  -2.084  -4.116  -4.457
  506   1HG1  ILE  73          2HG1      ILE  73  -3.636  -5.169  -2.086
  507   2HG1  ILE  73          1HG1      ILE  73  -2.748  -6.215  -3.198
  508   1HG2  ILE  73          1HG2      ILE  73  -2.445  -2.215  -3.319
  509   2HG2  ILE  73          2HG2      ILE  73  -3.686  -2.943  -2.301
  510   3HG2  ILE  73          3HG2      ILE  73  -4.098  -2.364  -3.915
  511   1HD1  ILE  73          1HD1      ILE  73  -1.021  -4.125  -2.340
  512   2HD1  ILE  73          2HD1      ILE  73  -0.891  -5.861  -2.058
  513   3HD1  ILE  73          3HD1      ILE  73  -1.789  -4.849  -0.928
  514    H    ASP  74           H        ASP  74  -6.038  -3.134  -5.417
  515    HA   ASP  74           HA       ASP  74  -5.324  -2.495  -8.093
  516   1HB   ASP  74          2HB       ASP  74  -7.552  -2.050  -6.340
  517   2HB   ASP  74          1HB       ASP  74  -7.099  -0.517  -7.090
  518    H    PHE  75           H        PHE  75  -5.727   0.221  -8.327
  519    HA   PHE  75           HA       PHE  75  -3.145   1.231  -7.768
  520   1HB   PHE  75          2HB       PHE  75  -4.606   1.936  -9.684
  521   2HB   PHE  75          1HB       PHE  75  -5.598   2.829  -8.529
  522    HD1  PHE  75           1HD      PHE  75  -2.658   2.868 -10.573
  523    HD2  PHE  75           2HD      PHE  75  -4.518   4.686  -7.206
  524    HE1  PHE  75           1HE      PHE  75  -1.161   4.808 -10.799
  525    HE2  PHE  75           2HE      PHE  75  -3.024   6.630  -7.425
  526    HZ   PHE  75           HZ       PHE  75  -1.344   6.692  -9.224
  527    H    GLU  76           H        GLU  76  -6.253   2.601  -6.673
  528    HA   GLU  76           HA       GLU  76  -5.020   4.022  -4.535
  529   1HB   GLU  76          2HB       GLU  76  -7.962   3.422  -4.747
  530   2HB   GLU  76          1HB       GLU  76  -7.187   4.805  -3.989
  531   1HG   GLU  76          2HG       GLU  76  -6.311   5.167  -6.475
  532   2HG   GLU  76          1HG       GLU  76  -7.795   4.288  -6.836
  533    H    GLU  77           H        GLU  77  -6.240   0.827  -4.867
  534    HA   GLU  77           HA       GLU  77  -7.093   0.226  -2.303
  535   1HB   GLU  77          2HB       GLU  77  -5.971  -1.333  -4.559
  536   2HB   GLU  77          1HB       GLU  77  -5.955  -2.111  -2.982
  537   1HG   GLU  77          2HG       GLU  77  -8.425  -1.484  -2.840
  538   2HG   GLU  77          1HG       GLU  77  -8.308  -1.154  -4.573
  539    H    PHE  78           H        PHE  78  -3.883   0.861  -3.432
  540    HA   PHE  78           HA       PHE  78  -2.497  -0.454  -1.308
  541   1HB   PHE  78          2HB       PHE  78  -1.585   0.345  -3.610
  542   2HB   PHE  78          1HB       PHE  78  -1.382   1.903  -2.806
  543    HD1  PHE  78           1HD      PHE  78   0.305   2.234  -1.143
  544    HD2  PHE  78           2HD      PHE  78  -0.281  -1.594  -2.908
  545    HE1  PHE  78           1HE      PHE  78   2.452   1.478  -0.209
  546    HE2  PHE  78           2HE      PHE  78   1.865  -2.357  -1.977
  547    HZ   PHE  78           HZ       PHE  78   3.234  -0.820  -0.624
  548    H    LEU  79           H        LEU  79  -4.427   2.295  -1.368
  549    HA   LEU  79           HA       LEU  79  -3.010   3.587   0.841
  550   1HB   LEU  79          2HB       LEU  79  -5.420   4.421  -0.779
  551   2HB   LEU  79          1HB       LEU  79  -4.810   5.327   0.593
  552    HG   LEU  79           HG       LEU  79  -2.602   4.944  -1.108
  553   1HD1  LEU  79          1HD1      LEU  79  -3.842   4.417  -3.006
  554   2HD1  LEU  79          2HD1      LEU  79  -3.566   6.153  -3.151
  555   3HD1  LEU  79          3HD1      LEU  79  -5.129   5.552  -2.598
  556   1HD2  LEU  79          1HD2      LEU  79  -3.268   7.506  -1.534
  557   2HD2  LEU  79          2HD2      LEU  79  -2.527   6.935  -0.040
  558   3HD2  LEU  79          3HD2      LEU  79  -4.272   7.171  -0.123
  559    H    VAL  80           H        VAL  80  -6.124   2.117   0.033
  560    HA   VAL  80           HA       VAL  80  -7.370   2.407   2.530
  561    HB   VAL  80           HB       VAL  80  -7.784   0.115   0.611
  562   1HG1  VAL  80          1HG1      VAL  80  -9.480   1.349   2.768
  563   2HG1  VAL  80          2HG1      VAL  80  -8.906  -0.314   2.651
  564   3HG1  VAL  80          3HG1      VAL  80 -10.130   0.277   1.527
  565   1HG2  VAL  80          1HG2      VAL  80  -8.927   1.425  -0.811
  566   2HG2  VAL  80          2HG2      VAL  80  -7.969   2.724  -0.104
  567   3HG2  VAL  80          3HG2      VAL  80  -9.602   2.415   0.481
  568    H    MET  81           H        MET  81  -5.088   0.052   1.309
  569    HA   MET  81           HA       MET  81  -5.364  -1.999   3.134
  570   1HB   MET  81          2HB       MET  81  -2.793  -2.193   2.792
  571   2HB   MET  81          1HB       MET  81  -3.861  -2.444   1.426
  572   1HG   MET  81          2HG       MET  81  -3.263  -0.511   0.406
  573   2HG   MET  81          1HG       MET  81  -2.792   0.277   1.913
  574   1HE   MET  81          1HE       MET  81  -1.235  -1.124   3.396
  575   2HE   MET  81          2HE       MET  81   0.455  -1.164   2.879
  576   3HE   MET  81          3HE       MET  81  -0.541  -2.618   2.766
  577    H    MET  82           H        MET  82  -3.649   1.043   3.414
  578    HA   MET  82           HA       MET  82  -2.706   0.445   6.081
  579   1HB   MET  82          2HB       MET  82  -1.835   2.119   4.045
  580   2HB   MET  82          1HB       MET  82  -2.502   3.231   5.240
  581   1HG   MET  82          2HG       MET  82  -1.055   2.333   6.947
  582   2HG   MET  82          1HG       MET  82  -0.450   1.109   5.832
  583   1HE   MET  82          1HE       MET  82   1.761   2.078   3.760
  584   2HE   MET  82          2HE       MET  82   0.889   3.432   3.040
  585   3HE   MET  82          3HE       MET  82   0.032   1.943   3.440
  586    H    VAL  83           H        VAL  83  -5.300   2.225   4.546
  587    HA   VAL  83           HA       VAL  83  -6.100   3.835   6.693
  588    HB   VAL  83           HB       VAL  83  -7.821   2.574   4.548
  589   1HG1  VAL  83          1HG1      VAL  83  -9.453   4.304   5.047
  590   2HG1  VAL  83          2HG1      VAL  83  -8.424   4.927   6.337
  591   3HG1  VAL  83          3HG1      VAL  83  -9.142   3.323   6.481
  592   1HG2  VAL  83          1HG2      VAL  83  -6.087   4.974   4.647
  593   2HG2  VAL  83          2HG2      VAL  83  -7.634   5.127   3.814
  594   3HG2  VAL  83          3HG2      VAL  83  -6.473   3.907   3.298
  595    H    ARG  84           H        ARG  84  -6.639   0.449   6.000
  596    HA   ARG  84           HA       ARG  84  -8.599   0.107   8.083
  597   1HB   ARG  84          2HB       ARG  84  -7.049  -2.012   6.587
  598   2HB   ARG  84          1HB       ARG  84  -8.521  -2.249   7.518
  599   1HG   ARG  84          2HG       ARG  84  -9.328  -0.358   5.749
  600   2HG   ARG  84          1HG       ARG  84  -8.151  -1.259   4.783
  601   1HD   ARG  84          2HD       ARG  84  -9.446  -3.101   4.695
  602   2HD   ARG  84          1HD       ARG  84 -10.009  -2.911   6.355
  603    HE   ARG  84           HE       ARG  84 -11.102  -0.976   4.529
  604   1HH1  ARG  84          1HH1      ARG  84 -11.475  -4.177   5.872
  605   2HH1  ARG  84          2HH1      ARG  84 -13.177  -4.245   5.558
  606   1HH2  ARG  84          1HH2      ARG  84 -13.339  -1.066   4.115
  607   2HH2  ARG  84          2HH2      ARG  84 -14.235  -2.480   4.560
  608    H    GLN  85           H        GLN  85  -5.246   0.391   8.013
  609    HA   GLN  85           HA       GLN  85  -4.929  -1.153  10.498
  610   1HB   GLN  85          2HB       GLN  85  -2.649  -0.017   8.898
  611   2HB   GLN  85          1HB       GLN  85  -2.639  -1.371  10.026
  612   1HG   GLN  85          2HG       GLN  85  -3.516  -2.840   8.482
  613   2HG   GLN  85          1HG       GLN  85  -4.235  -1.550   7.509
  614   1HE2  GLN  85          1HE2      GLN  85  -2.728  -3.612   6.418
  615   2HE2  GLN  85          2HE2      GLN  85  -1.268  -2.953   5.770
  616    H    MET  86           H        MET  86  -4.762   1.992   9.057
  617    HA   MET  86           HA       MET  86  -3.407   3.286  11.215
  618   1HB   MET  86          2HB       MET  86  -4.874   4.176   8.758
  619   2HB   MET  86          1HB       MET  86  -4.471   5.359  10.005
  620   1HG   MET  86          2HG       MET  86  -2.082   4.562   9.804
  621   2HG   MET  86          1HG       MET  86  -2.597   3.674   8.365
  622   1HE   MET  86          1HE       MET  86  -1.459   6.035   5.896
  623   2HE   MET  86          2HE       MET  86  -2.938   5.077   5.841
  624   3HE   MET  86          3HE       MET  86  -1.495   4.427   6.615
  625    H    LYS  87           H        LYS  87  -6.786   3.314  10.073
  626    HA   LYS  87           HA       LYS  87  -7.601   4.097  12.797
  627   1HB   LYS  87          2HB       LYS  87  -9.658   5.039  11.661
  628   2HB   LYS  87          1HB       LYS  87  -8.150   5.900  11.353
  629   1HG   LYS  87          2HG       LYS  87  -9.078   3.787   9.454
  630   2HG   LYS  87          1HG       LYS  87  -9.786   5.408   9.401
  631   1HD   LYS  87          2HD       LYS  87  -6.855   5.364   9.542
  632   2HD   LYS  87          1HD       LYS  87  -7.525   4.640   8.079
  633   1HE   LYS  87          2HE       LYS  87  -8.669   6.635   7.507
  634   2HE   LYS  87          1HE       LYS  87  -8.371   7.342   9.094
  635   1HZ   LYS  87          1HZ       LYS  87  -6.844   8.352   7.662
  636   2HZ   LYS  87          2HZ       LYS  87  -6.439   6.898   6.899
  637   3HZ   LYS  87          3HZ       LYS  87  -5.933   7.189   8.486
  638    H    GLU  88           H        GLU  88  -7.695   1.868  13.397
  639    HA   GLU  88           HA       GLU  88  -9.140  -0.118  12.083
  640   1HB   GLU  88          2HB       GLU  88  -7.563  -0.308  14.105
  641   2HB   GLU  88          1HB       GLU  88  -8.975   0.069  15.082
  642   1HG   GLU  88          2HG       GLU  88  -9.913  -1.955  14.760
  643   2HG   GLU  88          1HG       GLU  88  -9.305  -2.095  13.111
  644    H    ASP  89           H        ASP  89 -11.238  -0.518  11.812
  645    HA   ASP  89           HA       ASP  89 -13.162   1.195  13.221
  646   1HB   ASP  89          2HB       ASP  89 -12.979   0.994  10.613
  647   2HB   ASP  89          1HB       ASP  89 -13.883  -0.503  10.856
  648    H    ALA  90           H        ALA  90 -15.373   0.108  13.523
  649    HA   ALA  90           HA       ALA  90 -14.964  -2.205  15.179
  650   1HB   ALA  90          1HB       ALA  90 -17.722  -1.351  14.587
  651   2HB   ALA  90          2HB       ALA  90 -16.679  -0.137  15.327
  652   3HB   ALA  90          3HB       ALA  90 -16.941  -1.683  16.133
  653   2H    ARG 115          HN2       ARG 115   1.643  -2.677  11.304
  654    H    ARG 115           H        ARG 115   1.679  -4.282  10.696
  655   3H    ARG 115          HN3       ARG 115   2.780  -3.114  10.095
  656    HA   ARG 115           HA       ARG 115   1.217  -3.255   8.468
  657   1HB   ARG 115          2HB       ARG 115  -1.262  -3.093   9.131
  658   2HB   ARG 115          1HB       ARG 115  -0.432  -4.610   9.443
  659   1HG   ARG 115          2HG       ARG 115  -0.031  -3.622  11.804
  660   2HG   ARG 115          1HG       ARG 115  -1.345  -2.525  11.376
  661   1HD   ARG 115          2HD       ARG 115  -2.753  -4.498  10.853
  662   2HD   ARG 115          1HD       ARG 115  -1.449  -5.538  11.423
  663    HE   ARG 115           HE       ARG 115  -2.080  -5.078  13.567
  664   1HH1  ARG 115          1HH1      ARG 115  -3.450  -2.653  11.466
  665   2HH1  ARG 115          2HH1      ARG 115  -4.395  -1.921  12.719
  666   1HH2  ARG 115          1HH2      ARG 115  -3.322  -4.117  15.217
  667   2HH2  ARG 115          2HH2      ARG 115  -4.322  -2.752  14.848
  668    H    MET 116           H        MET 116   0.208  -1.295  11.285
  669    HA   MET 116           HA       MET 116  -0.447   0.965   9.668
  670   1HB   MET 116          2HB       MET 116  -1.545   0.576  11.824
  671   2HB   MET 116          1HB       MET 116  -0.006   0.766  12.653
  672   1HG   MET 116          2HG       MET 116   0.116   3.079  11.995
  673   2HG   MET 116          1HG       MET 116  -1.346   2.914  11.024
  674   1HE   MET 116          1HE       MET 116  -2.204   5.257  14.034
  675   2HE   MET 116          2HE       MET 116  -2.959   4.915  12.478
  676   3HE   MET 116          3HE       MET 116  -1.217   5.169  12.575
  677    H    SER 117           H        SER 117   0.579   3.107   9.951
  678    HA   SER 117           HA       SER 117   2.369   4.488   9.741
  679   1HB   SER 117          2HB       SER 117   3.987   4.430  11.413
  680   2HB   SER 117          1HB       SER 117   2.655   3.552  12.164
  681    HG   SER 117           HG       SER 117   4.747   2.518  12.336
  682    H    ALA 118           H        ALA 118   2.008   2.393   7.834
  683    HA   ALA 118           HA       ALA 118   4.558   1.248   7.193
  684   1HB   ALA 118          1HB       ALA 118   3.108  -0.121   6.191
  685   2HB   ALA 118          2HB       ALA 118   3.056   1.077   4.898
  686   3HB   ALA 118          3HB       ALA 118   1.836   1.100   6.170
  687    H    ASP 119           H        ASP 119   3.511   4.358   7.025
  688    HA   ASP 119           HA       ASP 119   4.068   5.340   4.533
  689   1HB   ASP 119          2HB       ASP 119   3.231   6.651   6.487
  690   2HB   ASP 119          1HB       ASP 119   4.873   6.671   7.122
  691    H    ALA 120           H        ALA 120   6.304   4.050   6.857
  692    HA   ALA 120           HA       ALA 120   8.691   5.232   6.095
  693   1HB   ALA 120          1HB       ALA 120   8.590   2.305   6.707
  694   2HB   ALA 120          2HB       ALA 120   8.180   3.485   7.951
  695   3HB   ALA 120          3HB       ALA 120   9.777   3.511   7.202
  696    H    MET 121           H        MET 121   7.488   2.079   4.910
  697    HA   MET 121           HA       MET 121   9.339   1.816   2.830
  698   1HB   MET 121          2HB       MET 121   8.029  -0.084   3.535
  699   2HB   MET 121          1HB       MET 121   6.530   0.732   3.112
  700   1HG   MET 121          2HG       MET 121   7.902   0.752   0.737
  701   2HG   MET 121          1HG       MET 121   8.376  -0.791   1.449
  702   1HE   MET 121          1HE       MET 121   4.659   0.718   2.212
  703   2HE   MET 121          2HE       MET 121   4.085   0.548   0.552
  704   3HE   MET 121          3HE       MET 121   5.475   1.575   0.904
  705    H    LEU 122           H        LEU 122   6.333   3.559   3.067
  706    HA   LEU 122           HA       LEU 122   5.950   4.064   0.309
  707   1HB   LEU 122          2HB       LEU 122   4.968   5.354   2.834
  708   2HB   LEU 122          1HB       LEU 122   4.626   6.082   1.278
  709    HG   LEU 122           HG       LEU 122   3.582   3.859   0.614
  710   1HD1  LEU 122          1HD1      LEU 122   3.403   3.367   3.567
  711   2HD1  LEU 122          2HD1      LEU 122   4.693   2.667   2.592
  712   3HD1  LEU 122          3HD1      LEU 122   3.010   2.279   2.237
  713   1HD2  LEU 122          1HD2      LEU 122   1.521   4.587   1.298
  714   2HD2  LEU 122          2HD2      LEU 122   2.470   6.052   1.547
  715   3HD2  LEU 122          3HD2      LEU 122   2.083   5.010   2.917
  716    H    ARG 123           H        ARG 123   7.602   5.823   2.902
  717    HA   ARG 123           HA       ARG 123   8.464   7.888   1.038
  718   1HB   ARG 123          2HB       ARG 123   7.723   8.490   3.325
  719   2HB   ARG 123          1HB       ARG 123   9.071   7.572   3.982
  720   1HG   ARG 123          2HG       ARG 123  10.465   9.273   3.706
  721   2HG   ARG 123          1HG       ARG 123   9.984   9.476   2.019
  722   1HD   ARG 123          2HD       ARG 123   9.230  11.467   2.780
  723   2HD   ARG 123          1HD       ARG 123   7.821  10.505   3.226
  724    HE   ARG 123           HE       ARG 123   9.816  10.603   5.283
  725   1HH1  ARG 123          1HH1      ARG 123   7.089  12.275   3.889
  726   2HH1  ARG 123          2HH1      ARG 123   6.705  13.125   5.347
  727   1HH2  ARG 123          1HH2      ARG 123   9.312  11.720   7.202
  728   2HH2  ARG 123          2HH2      ARG 123   7.967  12.811   7.228
  729    H    ALA 124           H        ALA 124   9.430   4.942   1.157
  730    HA   ALA 124           HA       ALA 124  12.240   5.207   1.749
  731   1HB   ALA 124          1HB       ALA 124  12.285   2.964   1.738
  732   2HB   ALA 124          2HB       ALA 124  11.377   2.850   0.230
  733   3HB   ALA 124          3HB       ALA 124  10.527   3.098   1.756
  734    H    LEU 125           H        LEU 125  10.654   3.986  -1.189
  735    HA   LEU 125           HA       LEU 125  12.881   4.783  -2.813
  736   1HB   LEU 125          2HB       LEU 125  10.192   3.750  -3.703
  737   2HB   LEU 125          1HB       LEU 125  11.678   3.762  -4.634
  738    HG   LEU 125           HG       LEU 125  11.570   2.254  -2.054
  739   1HD1  LEU 125          1HD1      LEU 125  10.274   1.500  -4.635
  740   2HD1  LEU 125          2HD1      LEU 125   9.694   1.291  -2.982
  741   3HD1  LEU 125          3HD1      LEU 125  10.983   0.260  -3.601
  742   1HD2  LEU 125          1HD2      LEU 125  13.573   2.722  -3.797
  743   2HD2  LEU 125          2HD2      LEU 125  12.925   1.220  -4.455
  744   3HD2  LEU 125          3HD2      LEU 125  13.469   1.287  -2.778
  745    H    LEU 126           H        LEU 126   9.912   6.225  -1.852
  746    HA   LEU 126           HA       LEU 126   8.910   8.202  -2.360
  747   1HB   LEU 126          2HB       LEU 126  11.756   8.632  -3.070
  748   2HB   LEU 126          1HB       LEU 126  10.607   9.803  -3.690
  749    HG   LEU 126           HG       LEU 126  11.052   9.110  -0.785
  750   1HD1  LEU 126          1HD1      LEU 126  12.848  10.447  -1.636
  751   2HD1  LEU 126          2HD1      LEU 126  11.797  11.478  -0.666
  752   3HD1  LEU 126          3HD1      LEU 126  11.718  11.547  -2.426
  753   1HD2  LEU 126          1HD2      LEU 126   8.821   9.654  -0.790
  754   2HD2  LEU 126          2HD2      LEU 126   8.972  10.725  -2.184
  755   3HD2  LEU 126          3HD2      LEU 126   9.552  11.249  -0.602
  756    H    GLY 127           H        GLY 127   8.052   9.527  -4.131
  757   1HA   GLY 127          2HA       GLY 127   7.731   7.884  -6.526
  758   2HA   GLY 127          1HA       GLY 127   6.728   9.250  -6.061
  759    H    SER 128           H        SER 128   9.037   8.208  -8.191
  760    HA   SER 128           HA       SER 128  10.311   9.222  -9.777
  761   1HB   SER 128          2HB       SER 128   7.977  10.575  -9.772
  762   2HB   SER 128          1HB       SER 128   9.082  11.890  -9.368
  763    HG   SER 128           HG       SER 128   8.971  11.789 -11.576
  764    H    LYS 129           H        LYS 129  11.757  11.242 -10.184
  765    HA   LYS 129           HA       LYS 129  13.040  11.954  -7.628
  766   1HB   LYS 129          2HB       LYS 129  14.146  11.015 -10.214
  767   2HB   LYS 129          1HB       LYS 129  15.052  12.275  -9.388
  768   1HG   LYS 129          2HG       LYS 129  14.637  10.584  -7.339
  769   2HG   LYS 129          1HG       LYS 129  14.670   9.443  -8.684
  770   1HD   LYS 129          2HD       LYS 129  16.901   9.517  -8.236
  771   2HD   LYS 129          1HD       LYS 129  16.805  10.888  -9.344
  772   1HE   LYS 129          2HE       LYS 129  16.723  11.031  -6.331
  773   2HE   LYS 129          1HE       LYS 129  18.102  11.444  -7.350
  774   1HZ   LYS 129          1HZ       LYS 129  16.810  13.391  -6.624
  775   2HZ   LYS 129          2HZ       LYS 129  15.464  12.803  -7.462
  776   3HZ   LYS 129          3HZ       LYS 129  16.860  13.241  -8.309
  777    H    HIS 130           H        HIS 130  12.713  13.056 -11.004
  778    HA   HIS 130           HA       HIS 130  12.805  15.828 -10.008
  779   1HB   HIS 130          2HB       HIS 130  14.156  14.513 -12.202
  780   2HB   HIS 130          1HB       HIS 130  13.200  15.871 -12.788
  781    HD1  HIS 130           1HD      HIS 130  13.675  17.646 -10.182
  782    HD2  HIS 130           2HD      HIS 130  16.599  15.785 -12.474
  783    HE1  HIS 130           1HE      HIS 130  15.789  18.942  -9.758
  784    HE2  HIS 130           2HE      HIS 130  17.524  17.850 -11.221
  785    H    LYS 131           H        LYS 131  11.323  17.334 -10.808
  786    HA   LYS 131           HA       LYS 131   9.376  16.751 -12.774
  787   1HB   LYS 131          2HB       LYS 131   8.596  15.247 -10.927
  788   2HB   LYS 131          1HB       LYS 131   8.350  16.677  -9.933
  789   1HG   LYS 131          2HG       LYS 131   6.490  17.318 -11.063
  790   2HG   LYS 131          1HG       LYS 131   7.045  16.629 -12.591
  791   1HD   LYS 131          2HD       LYS 131   6.091  14.633 -12.177
  792   2HD   LYS 131          1HD       LYS 131   6.543  14.662 -10.471
  793   1HE   LYS 131          2HE       LYS 131   4.707  16.242 -10.036
  794   2HE   LYS 131          1HE       LYS 131   4.241  16.146 -11.733
  795   1HZ   LYS 131          1HZ       LYS 131   3.304  14.136 -11.453
  796   2HZ   LYS 131          2HZ       LYS 131   3.195  14.612  -9.834
  797   3HZ   LYS 131          3HZ       LYS 131   4.461  13.610 -10.336
  Start of MODEL   15
    1   2H    ALA   1          HN2       ALA   1 -25.327   2.785 -11.222
    2    H    ALA   1           H        ALA   1 -24.084   3.653 -10.420
    3   3H    ALA   1          HN3       ALA   1 -23.681   2.435 -11.556
    4    HA   ALA   1           HA       ALA   1 -25.270   1.840  -9.176
    5   1HB   ALA   1          1HB       ALA   1 -24.952  -0.325  -9.732
    6   2HB   ALA   1          2HB       ALA   1 -23.324  -0.045 -10.344
    7   3HB   ALA   1          3HB       ALA   1 -24.722   0.352 -11.343
    8    H    SER   2           H        SER   2 -23.958   0.666  -7.483
    9    HA   SER   2           HA       SER   2 -21.315   1.921  -7.147
   10   1HB   SER   2          2HB       SER   2 -21.820   2.091  -4.704
   11   2HB   SER   2          1HB       SER   2 -22.856   3.108  -5.705
   12    HG   SER   2           HG       SER   2 -23.572   0.527  -4.769
   13    H    MET   3           H        MET   3 -20.117   0.796  -5.249
   14    HA   MET   3           HA       MET   3 -20.715  -1.974  -4.818
   15   1HB   MET   3          2HB       MET   3 -18.545  -2.763  -5.859
   16   2HB   MET   3          1HB       MET   3 -19.819  -2.318  -6.986
   17   1HG   MET   3          2HG       MET   3 -18.503   0.035  -6.743
   18   2HG   MET   3          1HG       MET   3 -17.184  -1.117  -6.539
   19   1HE   MET   3          1HE       MET   3 -18.556   1.000  -9.462
   20   2HE   MET   3          2HE       MET   3 -19.903   0.337  -8.535
   21   3HE   MET   3          3HE       MET   3 -19.650  -0.165 -10.207
   22    H    THR   4           H        THR   4 -18.099   0.436  -4.829
   23    HA   THR   4           HA       THR   4 -17.776   0.410  -2.037
   24    HB   THR   4           HB       THR   4 -16.863  -1.837  -2.432
   25    HG1  THR   4           1HG      THR   4 -15.203  -1.528  -1.118
   26   1HG2  THR   4          1HG2      THR   4 -15.945  -1.166  -4.764
   27   2HG2  THR   4          2HG2      THR   4 -15.081  -2.347  -3.780
   28   3HG2  THR   4          3HG2      THR   4 -14.518  -0.676  -3.852
   29    H    ASP   5           H        ASP   5 -17.252   2.470  -1.771
   30    HA   ASP   5           HA       ASP   5 -15.473   3.763  -3.708
   31   1HB   ASP   5          2HB       ASP   5 -17.225   4.993  -1.569
   32   2HB   ASP   5          1HB       ASP   5 -16.287   5.880  -2.774
   33    H    GLN   6           H        GLN   6 -15.098   2.139  -0.912
   34    HA   GLN   6           HA       GLN   6 -13.665   3.746   0.820
   35   1HB   GLN   6          2HB       GLN   6 -12.625   1.707   1.646
   36   2HB   GLN   6          1HB       GLN   6 -14.330   1.431   1.320
   37   1HG   GLN   6          2HG       GLN   6 -13.627   0.476  -0.903
   38   2HG   GLN   6          1HG       GLN   6 -11.970   0.533  -0.305
   39   1HE2  GLN   6          1HE2      GLN   6 -11.570  -0.605   1.756
   40   2HE2  GLN   6          2HE2      GLN   6 -12.416  -2.084   2.044
   41    H    GLN   7           H        GLN   7 -12.735   2.485  -2.272
   42    HA   GLN   7           HA       GLN   7  -9.923   2.778  -1.965
   43   1HB   GLN   7          2HB       GLN   7 -11.214   3.009  -4.645
   44   2HB   GLN   7          1HB       GLN   7  -9.735   2.177  -4.187
   45   1HG   GLN   7          2HG       GLN   7 -11.452   0.662  -2.847
   46   2HG   GLN   7          1HG       GLN   7 -12.542   1.240  -4.107
   47   1HE2  GLN   7          1HE2      GLN   7 -10.885   1.386  -6.265
   48   2HE2  GLN   7          2HE2      GLN   7 -10.325  -0.192  -6.686
   49    H    ALA   8           H        ALA   8 -12.478   4.978  -2.537
   50    HA   ALA   8           HA       ALA   8 -10.744   7.020  -3.662
   51   1HB   ALA   8          1HB       ALA   8 -12.613   8.062  -4.376
   52   2HB   ALA   8          2HB       ALA   8 -13.498   7.732  -2.887
   53   3HB   ALA   8          3HB       ALA   8 -13.342   6.478  -4.115
   54    H    GLU   9           H        GLU   9 -12.780   6.566  -0.775
   55    HA   GLU   9           HA       GLU   9 -12.207   8.946   0.529
   56   1HB   GLU   9          2HB       GLU   9 -12.639   6.233   1.796
   57   2HB   GLU   9          1HB       GLU   9 -12.805   7.785   2.606
   58   1HG   GLU   9          2HG       GLU   9 -14.724   8.347   1.367
   59   2HG   GLU   9          1HG       GLU   9 -14.448   7.041   0.207
   60    H    ALA  10           H        ALA  10 -10.443   5.901   0.508
   61    HA   ALA  10           HA       ALA  10  -8.545   6.174   2.408
   62   1HB   ALA  10          1HB       ALA  10  -8.779   4.817  -0.131
   63   2HB   ALA  10          2HB       ALA  10  -8.002   4.286   1.366
   64   3HB   ALA  10          3HB       ALA  10  -7.105   5.270   0.208
   65    H    ARG  11           H        ARG  11  -8.099   7.366  -0.928
   66    HA   ARG  11           HA       ARG  11  -5.707   8.705  -0.547
   67   1HB   ARG  11          2HB       ARG  11  -7.777   8.611  -2.558
   68   2HB   ARG  11          1HB       ARG  11  -7.173  10.253  -2.385
   69   1HG   ARG  11          2HG       ARG  11  -4.864   9.360  -2.667
   70   2HG   ARG  11          1HG       ARG  11  -5.577   7.785  -3.024
   71   1HD   ARG  11          2HD       ARG  11  -4.987   9.128  -5.042
   72   2HD   ARG  11          1HD       ARG  11  -6.681   8.644  -4.960
   73    HE   ARG  11           HE       ARG  11  -6.201  11.244  -3.853
   74   1HH1  ARG  11          1HH1      ARG  11  -6.774   9.480  -6.809
   75   2HH1  ARG  11          2HH1      ARG  11  -7.423  10.849  -7.648
   76   1HH2  ARG  11          1HH2      ARG  11  -7.054  13.047  -4.955
   77   2HH2  ARG  11          2HH2      ARG  11  -7.581  12.874  -6.595
   78    H    ALA  12           H        ALA  12  -8.935   9.628   0.345
   79    HA   ALA  12           HA       ALA  12  -8.134  12.357   0.976
   80   1HB   ALA  12          1HB       ALA  12 -10.812  10.999   1.249
   81   2HB   ALA  12          2HB       ALA  12 -10.293  12.010  -0.100
   82   3HB   ALA  12          3HB       ALA  12 -10.492  12.715   1.503
   83    H    PHE  13           H        PHE  13  -8.454   9.307   2.525
   84    HA   PHE  13           HA       PHE  13  -9.000  10.261   5.157
   85   1HB   PHE  13          2HB       PHE  13  -8.671   7.731   3.867
   86   2HB   PHE  13          1HB       PHE  13  -7.623   7.776   5.287
   87    HD1  PHE  13           1HD      PHE  13  -8.755   8.657   7.476
   88    HD2  PHE  13           2HD      PHE  13 -10.870   7.112   4.122
   89    HE1  PHE  13           1HE      PHE  13 -10.690   8.181   8.919
   90    HE2  PHE  13           2HE      PHE  13 -12.809   6.634   5.559
   91    HZ   PHE  13           HZ       PHE  13 -12.720   7.168   7.961
   92    H    LEU  14           H        LEU  14  -6.254  10.465   3.230
   93    HA   LEU  14           HA       LEU  14  -4.602  11.000   5.599
   94   1HB   LEU  14          2HB       LEU  14  -3.588   9.679   3.084
   95   2HB   LEU  14          1HB       LEU  14  -2.681   9.983   4.561
   96    HG   LEU  14           HG       LEU  14  -5.110   8.319   4.854
   97   1HD1  LEU  14          1HD1      LEU  14  -3.727   7.692   2.683
   98   2HD1  LEU  14          2HD1      LEU  14  -4.411   6.464   3.747
   99   3HD1  LEU  14          3HD1      LEU  14  -2.705   6.893   3.875
  100   1HD2  LEU  14          1HD2      LEU  14  -3.269   8.998   6.571
  101   2HD2  LEU  14          2HD2      LEU  14  -2.371   7.673   5.836
  102   3HD2  LEU  14          3HD2      LEU  14  -3.938   7.367   6.585
  103    H    SER  15           H        SER  15  -2.542  12.224   4.908
  104    HA   SER  15           HA       SER  15  -3.418  14.565   3.453
  105   1HB   SER  15          2HB       SER  15  -0.598  14.351   4.371
  106   2HB   SER  15          1HB       SER  15  -1.747  15.686   4.538
  107    HG   SER  15           HG       SER  15  -2.827  14.276   6.122
  108    H    GLU  16           H        GLU  16  -2.043  15.576   1.792
  109    HA   GLU  16           HA       GLU  16  -1.617  13.958  -0.411
  110   1HB   GLU  16          2HB       GLU  16  -0.716  16.692   0.366
  111   2HB   GLU  16          1HB       GLU  16   0.052  15.940  -1.025
  112   1HG   GLU  16          2HG       GLU  16  -2.867  15.762  -1.027
  113   2HG   GLU  16          1HG       GLU  16  -2.236  17.407  -1.092
  114    H    GLU  17           H        GLU  17   0.433  14.586   2.302
  115    HA   GLU  17           HA       GLU  17   2.932  13.884   1.270
  116   1HB   GLU  17          2HB       GLU  17   1.683  14.063   3.944
  117   2HB   GLU  17          1HB       GLU  17   3.091  13.011   3.837
  118   1HG   GLU  17          2HG       GLU  17   3.396  15.644   2.571
  119   2HG   GLU  17          1HG       GLU  17   3.200  15.660   4.323
  120    H    MET  18           H        MET  18   0.617  11.859   3.070
  121    HA   MET  18           HA       MET  18   1.957   9.438   2.850
  122   1HB   MET  18          2HB       MET  18  -0.408  10.280   3.956
  123   2HB   MET  18          1HB       MET  18  -0.970   9.233   2.654
  124   1HG   MET  18          2HG       MET  18  -0.797   7.937   4.639
  125   2HG   MET  18          1HG       MET  18   0.493   7.437   3.547
  126   1HE   MET  18          1HE       MET  18   0.118   7.241   7.039
  127   2HE   MET  18          2HE       MET  18   1.857   7.102   7.296
  128   3HE   MET  18          3HE       MET  18   1.090   6.235   5.966
  129    H    ILE  19           H        ILE  19   0.130  11.190   0.479
  130    HA   ILE  19           HA       ILE  19  -0.329   8.985  -1.290
  131    HB   ILE  19           HB       ILE  19  -0.508  11.972  -1.632
  132   1HG1  ILE  19          2HG1      ILE  19  -2.571   9.757  -1.652
  133   2HG1  ILE  19          1HG1      ILE  19  -2.279  10.892  -0.332
  134   1HG2  ILE  19          1HG2      ILE  19   0.145  11.329  -3.783
  135   2HG2  ILE  19          2HG2      ILE  19  -1.619  11.374  -3.860
  136   3HG2  ILE  19          3HG2      ILE  19  -0.781   9.828  -3.714
  137   1HD1  ILE  19          1HD1      ILE  19  -3.740  12.284  -1.224
  138   2HD1  ILE  19          2HD1      ILE  19  -4.008  11.162  -2.557
  139   3HD1  ILE  19          3HD1      ILE  19  -2.755  12.397  -2.683
  140    H    ALA  20           H        ALA  20   1.738  11.865  -1.610
  141    HA   ALA  20           HA       ALA  20   3.183  11.134  -3.822
  142   1HB   ALA  20          1HB       ALA  20   3.492  13.306  -3.070
  143   2HB   ALA  20          2HB       ALA  20   5.044  12.538  -2.729
  144   3HB   ALA  20          3HB       ALA  20   3.877  12.789  -1.428
  145    H    GLU  21           H        GLU  21   3.430   9.882  -0.598
  146    HA   GLU  21           HA       GLU  21   5.957   8.551  -1.123
  147   1HB   GLU  21          2HB       GLU  21   4.248   8.078   1.302
  148   2HB   GLU  21          1HB       GLU  21   5.994   7.962   1.144
  149   1HG   GLU  21          2HG       GLU  21   5.219  10.636   0.569
  150   2HG   GLU  21          1HG       GLU  21   4.448  10.135   2.073
  151    H    PHE  22           H        PHE  22   2.536   7.898  -1.017
  152    HA   PHE  22           HA       PHE  22   2.562   5.096  -0.892
  153   1HB   PHE  22          2HB       PHE  22   0.655   7.181  -1.783
  154   2HB   PHE  22          1HB       PHE  22   0.404   5.581  -2.469
  155    HD1  PHE  22           1HD      PHE  22   1.112   3.827  -0.245
  156    HD2  PHE  22           2HD      PHE  22  -1.043   7.492  -0.258
  157    HE1  PHE  22           1HE      PHE  22  -0.068   3.134   1.798
  158    HE2  PHE  22           2HE      PHE  22  -2.221   6.809   1.786
  159    HZ   PHE  22           HZ       PHE  22  -1.737   4.628   2.820
  160    H    LYS  23           H        LYS  23   2.968   7.347  -3.548
  161    HA   LYS  23           HA       LYS  23   2.989   5.324  -5.582
  162   1HB   LYS  23          2HB       LYS  23   2.323   7.792  -5.834
  163   2HB   LYS  23          1HB       LYS  23   4.054   8.124  -5.875
  164   1HG   LYS  23          2HG       LYS  23   3.780   7.896  -8.090
  165   2HG   LYS  23          1HG       LYS  23   3.897   6.174  -7.729
  166   1HD   LYS  23          2HD       LYS  23   1.466   6.018  -7.615
  167   2HD   LYS  23          1HD       LYS  23   1.331   7.754  -7.928
  168   1HE   LYS  23          2HE       LYS  23   2.317   7.469 -10.117
  169   2HE   LYS  23          1HE       LYS  23   2.596   5.757  -9.804
  170   1HZ   LYS  23          1HZ       LYS  23   0.635   6.083 -11.161
  171   2HZ   LYS  23          2HZ       LYS  23  -0.057   7.079  -9.983
  172   3HZ   LYS  23          3HZ       LYS  23   0.199   5.439  -9.658
  173    H    ALA  24           H        ALA  24   5.220   6.307  -3.279
  174    HA   ALA  24           HA       ALA  24   7.669   6.464  -4.459
  175   1HB   ALA  24          1HB       ALA  24   7.167   6.585  -2.011
  176   2HB   ALA  24          2HB       ALA  24   8.627   5.685  -2.423
  177   3HB   ALA  24          3HB       ALA  24   7.154   4.820  -1.987
  178    H    ALA  25           H        ALA  25   6.587   3.351  -3.106
  179    HA   ALA  25           HA       ALA  25   8.378   1.937  -4.878
  180   1HB   ALA  25          1HB       ALA  25   7.489  -0.076  -3.634
  181   2HB   ALA  25          2HB       ALA  25   6.569   1.058  -2.647
  182   3HB   ALA  25          3HB       ALA  25   8.331   1.133  -2.663
  183    H    PHE  26           H        PHE  26   5.345   3.129  -5.333
  184    HA   PHE  26           HA       PHE  26   3.665   1.242  -6.277
  185   1HB   PHE  26          2HB       PHE  26   3.883   3.980  -6.566
  186   2HB   PHE  26          1HB       PHE  26   3.917   3.400  -8.227
  187    HD1  PHE  26           1HD      PHE  26   2.000   2.305  -9.203
  188    HD2  PHE  26           2HD      PHE  26   1.921   3.688  -5.180
  189    HE1  PHE  26           1HE      PHE  26  -0.449   2.064  -9.173
  190    HE2  PHE  26           2HE      PHE  26  -0.528   3.448  -5.142
  191    HZ   PHE  26           HZ       PHE  26  -1.715   2.635  -7.140
  192    H    ASP  27           H        ASP  27   6.663   2.222  -7.797
  193    HA   ASP  27           HA       ASP  27   6.152   0.858 -10.266
  194   1HB   ASP  27          2HB       ASP  27   7.893   2.810  -9.539
  195   2HB   ASP  27          1HB       ASP  27   8.957   1.406  -9.518
  196    H    MET  28           H        MET  28   8.661   0.279  -7.795
  197    HA   MET  28           HA       MET  28   9.346  -2.280  -8.673
  198   1HB   MET  28          2HB       MET  28   9.930  -0.585  -6.390
  199   2HB   MET  28          1HB       MET  28   9.836  -2.278  -5.925
  200   1HG   MET  28          2HG       MET  28  11.726  -2.818  -7.001
  201   2HG   MET  28          1HG       MET  28  11.381  -1.746  -8.363
  202   1HE   MET  28          1HE       MET  28  11.766   1.604  -6.617
  203   2HE   MET  28          2HE       MET  28  11.087   0.671  -7.951
  204   3HE   MET  28          3HE       MET  28  12.740   1.281  -8.052
  205    H    PHE  29           H        PHE  29   6.746  -1.213  -6.612
  206    HA   PHE  29           HA       PHE  29   6.119  -3.594  -5.303
  207   1HB   PHE  29          2HB       PHE  29   4.807  -1.051  -5.835
  208   2HB   PHE  29          1HB       PHE  29   3.658  -2.391  -5.820
  209    HD1  PHE  29           1HD      PHE  29   5.213   0.006  -3.848
  210    HD2  PHE  29           2HD      PHE  29   4.054  -4.085  -3.797
  211    HE1  PHE  29           1HE      PHE  29   5.209   0.044  -1.390
  212    HE2  PHE  29           2HE      PHE  29   4.044  -4.052  -1.339
  213    HZ   PHE  29           HZ       PHE  29   4.618  -1.989  -0.131
  214    H    ASP  30           H        ASP  30   4.560  -2.313  -8.253
  215    HA   ASP  30           HA       ASP  30   3.106  -4.629  -8.811
  216   1HB   ASP  30          2HB       ASP  30   3.339  -2.089  -9.927
  217   2HB   ASP  30          1HB       ASP  30   3.825  -3.187 -11.221
  218    H    ALA  31           H        ALA  31   6.385  -3.975  -9.208
  219    HA   ALA  31           HA       ALA  31   8.142  -5.198  -9.993
  220   1HB   ALA  31          1HB       ALA  31   7.387  -7.691 -10.617
  221   2HB   ALA  31          2HB       ALA  31   6.024  -7.220  -9.602
  222   3HB   ALA  31          3HB       ALA  31   7.664  -7.153  -8.960
  223    H    ASP  32           H        ASP  32   5.421  -6.529 -11.872
  224    HA   ASP  32           HA       ASP  32   6.921  -5.968 -14.325
  225   1HB   ASP  32          2HB       ASP  32   5.329  -7.504 -15.412
  226   2HB   ASP  32          1HB       ASP  32   6.136  -8.266 -14.039
  227    H    GLY  33           H        GLY  33   4.075  -5.034 -12.574
  228   1HA   GLY  33          2HA       GLY  33   2.701  -3.207 -12.899
  229   2HA   GLY  33          1HA       GLY  33   3.667  -2.784 -14.304
  230    H    GLY  34           H        GLY  34   2.081  -5.888 -13.842
  231   1HA   GLY  34          2HA       GLY  34   0.501  -5.338 -16.261
  232   2HA   GLY  34          1HA       GLY  34   0.878  -6.936 -15.619
  233    H    GLY  35           H        GLY  35   0.043  -7.019 -13.141
  234   1HA   GLY  35          2HA       GLY  35  -2.826  -6.348 -13.339
  235   2HA   GLY  35          1HA       GLY  35  -2.172  -7.718 -12.443
  236    H    ASP  36           H        ASP  36  -1.984  -7.483 -10.316
  237    HA   ASP  36           HA       ASP  36  -1.697  -4.766  -9.225
  238   1HB   ASP  36          2HB       ASP  36  -3.709  -6.869  -8.511
  239   2HB   ASP  36          1HB       ASP  36  -3.143  -5.751  -7.264
  240    H    ILE  37           H        ILE  37  -1.421  -5.194  -6.627
  241    HA   ILE  37           HA       ILE  37   1.130  -6.534  -6.458
  242    HB   ILE  37           HB       ILE  37  -0.446  -5.056  -4.351
  243   1HG1  ILE  37          2HG1      ILE  37   1.865  -4.187  -6.100
  244   2HG1  ILE  37          1HG1      ILE  37   0.201  -3.605  -6.199
  245   1HG2  ILE  37          1HG2      ILE  37   1.031  -5.727  -2.854
  246   2HG2  ILE  37          2HG2      ILE  37   2.354  -5.107  -3.840
  247   3HG2  ILE  37          3HG2      ILE  37   1.784  -6.760  -4.069
  248   1HD1  ILE  37          1HD1      ILE  37   1.881  -3.277  -3.736
  249   2HD1  ILE  37          2HD1      ILE  37   0.383  -2.451  -4.159
  250   3HD1  ILE  37          3HD1      ILE  37   1.864  -2.099  -5.048
  251    H    SER  38           H        SER  38   1.238  -8.647  -6.101
  252    HA   SER  38           HA       SER  38  -0.907 -10.029  -4.707
  253   1HB   SER  38          2HB       SER  38   0.682 -10.745  -6.828
  254   2HB   SER  38          1HB       SER  38   1.457 -11.599  -5.489
  255    HG   SER  38           HG       SER  38  -0.800 -12.296  -4.989
  256    H    THR  39           H        THR  39   0.568 -12.129  -3.555
  257    HA   THR  39           HA       THR  39   1.313 -10.909  -1.079
  258    HB   THR  39           HB       THR  39   2.005 -13.376  -0.574
  259    HG1  THR  39           1HG      THR  39   1.945 -14.537  -2.317
  260   1HG2  THR  39          1HG2      THR  39  -0.533 -14.030  -0.641
  261   2HG2  THR  39          2HG2      THR  39  -0.735 -12.311  -0.975
  262   3HG2  THR  39          3HG2      THR  39   0.075 -12.832   0.502
  263    H    LYS  40           H        LYS  40   3.030 -11.966  -3.893
  264    HA   LYS  40           HA       LYS  40   5.591 -12.035  -2.524
  265   1HB   LYS  40          2HB       LYS  40   6.510 -12.604  -4.741
  266   2HB   LYS  40          1HB       LYS  40   5.192 -13.677  -4.268
  267   1HG   LYS  40          2HG       LYS  40   4.361 -13.282  -6.294
  268   2HG   LYS  40          1HG       LYS  40   3.889 -11.700  -5.658
  269   1HD   LYS  40          2HD       LYS  40   5.542 -10.611  -6.774
  270   2HD   LYS  40          1HD       LYS  40   6.666 -11.966  -6.652
  271   1HE   LYS  40          2HE       LYS  40   5.999 -12.859  -8.608
  272   2HE   LYS  40          1HE       LYS  40   4.303 -12.469  -8.321
  273   1HZ   LYS  40          1HZ       LYS  40   5.306 -10.040  -8.721
  274   2HZ   LYS  40          2HZ       LYS  40   4.676 -11.000  -9.963
  275   3HZ   LYS  40          3HZ       LYS  40   6.347 -10.942  -9.705
  276    H    GLU  41           H        GLU  41   3.812  -9.945  -4.726
  277    HA   GLU  41           HA       GLU  41   5.896  -8.216  -5.440
  278   1HB   GLU  41          2HB       GLU  41   2.921  -8.003  -5.359
  279   2HB   GLU  41          1HB       GLU  41   3.857  -6.531  -5.589
  280   1HG   GLU  41          2HG       GLU  41   4.712  -7.239  -7.624
  281   2HG   GLU  41          1HG       GLU  41   4.362  -8.935  -7.292
  282    H    LEU  42           H        LEU  42   4.039  -8.473  -2.519
  283    HA   LEU  42           HA       LEU  42   4.687  -5.862  -1.537
  284   1HB   LEU  42          2HB       LEU  42   2.851  -7.789  -0.856
  285   2HB   LEU  42          1HB       LEU  42   4.009  -7.891   0.464
  286    HG   LEU  42           HG       LEU  42   2.329  -6.387   1.175
  287   1HD1  LEU  42          1HD1      LEU  42   4.406  -5.540   1.853
  288   2HD1  LEU  42          2HD1      LEU  42   3.552  -4.153   1.177
  289   3HD1  LEU  42          3HD1      LEU  42   4.803  -4.964   0.234
  290   1HD2  LEU  42          1HD2      LEU  42   1.101  -5.774  -0.672
  291   2HD2  LEU  42          2HD2      LEU  42   2.527  -5.318  -1.604
  292   3HD2  LEU  42          3HD2      LEU  42   1.951  -4.273  -0.304
  293    H    GLY  43           H        GLY  43   5.663  -9.116  -0.428
  294   1HA   GLY  43          2HA       GLY  43   7.598  -8.389   1.388
  295   2HA   GLY  43          1HA       GLY  43   7.660  -9.868   0.431
  296    H    THR  44           H        THR  44   7.837  -8.384  -2.102
  297    HA   THR  44           HA       THR  44  10.586  -8.345  -2.449
  298    HB   THR  44           HB       THR  44   8.270  -7.234  -3.979
  299    HG1  THR  44           1HG      THR  44  10.285  -9.162  -4.420
  300   1HG2  THR  44          1HG2      THR  44   9.654  -5.521  -4.629
  301   2HG2  THR  44          2HG2      THR  44  10.028  -6.760  -5.829
  302   3HG2  THR  44          3HG2      THR  44  11.117  -6.495  -4.467
  303    H    VAL  45           H        VAL  45   8.709  -5.384  -2.856
  304    HA   VAL  45           HA       VAL  45  10.831  -3.645  -2.374
  305    HB   VAL  45           HB       VAL  45   8.876  -2.925  -3.578
  306   1HG1  VAL  45          1HG1      VAL  45   7.167  -4.209  -2.508
  307   2HG1  VAL  45          2HG1      VAL  45   6.739  -2.505  -2.376
  308   3HG1  VAL  45          3HG1      VAL  45   7.406  -3.357  -0.982
  309   1HG2  VAL  45          1HG2      VAL  45   9.172  -0.813  -2.940
  310   2HG2  VAL  45          2HG2      VAL  45  10.158  -1.441  -1.621
  311   3HG2  VAL  45          3HG2      VAL  45   8.445  -1.108  -1.361
  312    H    MET  46           H        MET  46   8.584  -5.148  -0.150
  313    HA   MET  46           HA       MET  46   9.144  -3.390   2.032
  314   1HB   MET  46          2HB       MET  46   7.627  -5.918   1.653
  315   2HB   MET  46          1HB       MET  46   8.149  -5.528   3.293
  316   1HG   MET  46          2HG       MET  46   6.468  -3.786   1.499
  317   2HG   MET  46          1HG       MET  46   5.895  -4.737   2.875
  318   1HE   MET  46          1HE       MET  46   4.711  -2.991   3.715
  319   2HE   MET  46          2HE       MET  46   5.284  -1.492   4.447
  320   3HE   MET  46          3HE       MET  46   5.465  -3.022   5.308
  321    H    ARG  47           H        ARG  47  10.439  -6.483   0.948
  322    HA   ARG  47           HA       ARG  47  12.076  -6.780   3.313
  323   1HB   ARG  47          2HB       ARG  47  11.929  -8.367   0.749
  324   2HB   ARG  47          1HB       ARG  47  12.993  -8.767   2.091
  325   1HG   ARG  47          2HG       ARG  47  11.282  -9.487   3.420
  326   2HG   ARG  47          1HG       ARG  47  10.091  -8.443   2.643
  327   1HD   ARG  47          2HD       ARG  47   9.404 -10.328   1.643
  328   2HD   ARG  47          1HD       ARG  47  10.796 -10.074   0.584
  329    HE   ARG  47           HE       ARG  47  10.499 -12.093   2.632
  330   1HH1  ARG  47          1HH1      ARG  47  12.721 -10.354   0.575
  331   2HH1  ARG  47          2HH1      ARG  47  13.952 -11.568   0.669
  332   1HH2  ARG  47          1HH2      ARG  47  12.117 -13.688   2.755
  333   2HH2  ARG  47          2HH2      ARG  47  13.610 -13.460   1.905
  334    H    MET  48           H        MET  48  12.410  -5.426   0.140
  335    HA   MET  48           HA       MET  48  15.318  -5.359   0.351
  336   1HB   MET  48          2HB       MET  48  15.310  -4.514  -1.915
  337   2HB   MET  48          1HB       MET  48  14.275  -5.937  -1.813
  338   1HG   MET  48          2HG       MET  48  12.571  -4.796  -2.626
  339   2HG   MET  48          1HG       MET  48  12.699  -3.615  -1.324
  340   1HE   MET  48          1HE       MET  48  11.642  -2.064  -3.938
  341   2HE   MET  48          2HE       MET  48  12.749  -0.743  -3.560
  342   3HE   MET  48          3HE       MET  48  12.016  -1.679  -2.258
  343    H    LEU  49           H        LEU  49  13.104  -3.635   1.829
  344    HA   LEU  49           HA       LEU  49  14.523  -1.088   1.415
  345   1HB   LEU  49          2HB       LEU  49  11.617  -1.663   1.801
  346   2HB   LEU  49          1HB       LEU  49  12.272  -0.144   2.385
  347    HG   LEU  49           HG       LEU  49  12.267  -1.134  -0.462
  348   1HD1  LEU  49          1HD1      LEU  49  10.162  -0.273  -0.107
  349   2HD1  LEU  49          2HD1      LEU  49  11.036   1.156  -0.653
  350   3HD1  LEU  49          3HD1      LEU  49  10.727   0.914   1.067
  351   1HD2  LEU  49          1HD2      LEU  49  13.208   1.196  -0.896
  352   2HD2  LEU  49          2HD2      LEU  49  14.316  -0.017  -0.259
  353   3HD2  LEU  49          3HD2      LEU  49  13.641   1.210   0.812
  354    H    GLY  50           H        GLY  50  12.817  -3.133   3.757
  355   1HA   GLY  50          2HA       GLY  50  14.642  -2.935   5.801
  356   2HA   GLY  50          1HA       GLY  50  13.581  -1.544   6.016
  357    H    GLN  51           H        GLN  51  11.188  -2.831   5.087
  358    HA   GLN  51           HA       GLN  51  10.340  -4.014   7.520
  359   1HB   GLN  51          2HB       GLN  51   9.047  -2.794   5.494
  360   2HB   GLN  51          1HB       GLN  51   8.726  -4.478   5.074
  361   1HG   GLN  51          2HG       GLN  51   6.909  -3.891   6.379
  362   2HG   GLN  51          1HG       GLN  51   7.970  -4.719   7.518
  363   1HE2  GLN  51          1HE2      GLN  51   5.905  -2.335   7.431
  364   2HE2  GLN  51          2HE2      GLN  51   6.640  -1.192   8.498
  365    H    ASN  52           H        ASN  52   9.412  -6.165   7.769
  366    HA   ASN  52           HA       ASN  52  10.384  -8.184   5.901
  367   1HB   ASN  52          2HB       ASN  52  11.372  -9.526   7.715
  368   2HB   ASN  52          1HB       ASN  52  12.192  -7.974   7.518
  369   1HD2  ASN  52          1HD2      ASN  52  10.812 -10.078   9.690
  370   2HD2  ASN  52          2HD2      ASN  52  10.649  -9.009  11.037
  371    HA   PRO  53           HA       PRO  53   6.147  -8.907   7.886
  372   1HB   PRO  53          2HB       PRO  53   4.703  -8.773   5.587
  373   2HB   PRO  53          1HB       PRO  53   5.027  -7.363   6.601
  374   1HG   PRO  53          2HG       PRO  53   6.422  -8.260   4.106
  375   2HG   PRO  53          1HG       PRO  53   5.906  -6.628   4.572
  376   1HD   PRO  53          2HD       PRO  53   8.464  -7.452   4.833
  377   2HD   PRO  53          1HD       PRO  53   7.711  -6.322   5.983
  378    H    THR  54           H        THR  54   6.400 -11.043   8.307
  379    HA   THR  54           HA       THR  54   7.281 -13.009   6.540
  380    HB   THR  54           HB       THR  54   6.038 -14.584   8.166
  381    HG1  THR  54           1HG      THR  54   4.560 -13.013   8.928
  382   1HG2  THR  54          1HG2      THR  54   7.568 -13.702  10.134
  383   2HG2  THR  54          2HG2      THR  54   8.285 -12.775   8.816
  384   3HG2  THR  54          3HG2      THR  54   8.229 -14.535   8.727
  385    H    LYS  55           H        LYS  55   5.694 -15.072   6.271
  386    HA   LYS  55           HA       LYS  55   4.030 -14.492   4.128
  387   1HB   LYS  55          2HB       LYS  55   4.451 -16.841   5.893
  388   2HB   LYS  55          1HB       LYS  55   2.963 -16.821   4.947
  389   1HG   LYS  55          2HG       LYS  55   5.461 -16.192   3.500
  390   2HG   LYS  55          1HG       LYS  55   5.256 -17.855   4.053
  391   1HD   LYS  55          2HD       LYS  55   4.124 -18.126   2.131
  392   2HD   LYS  55          1HD       LYS  55   2.805 -17.332   2.992
  393   1HE   LYS  55          2HE       LYS  55   3.026 -15.403   1.828
  394   2HE   LYS  55          1HE       LYS  55   4.778 -15.556   1.702
  395   1HZ   LYS  55          1HZ       LYS  55   4.280 -17.421   0.072
  396   2HZ   LYS  55          2HZ       LYS  55   3.993 -15.842  -0.459
  397   3HZ   LYS  55          3HZ       LYS  55   2.700 -16.819   0.022
  398    H    CYS  56           H        CYS  56   3.027 -15.363   7.441
  399    HA   CYS  56           HA       CYS  56   0.291 -14.896   7.068
  400   1HB   CYS  56          2HB       CYS  56   1.513 -16.062   9.025
  401   2HB   CYS  56          1HB       CYS  56   1.681 -14.439   9.700
  402    HG   CYS  56           HG       CYS  56  -1.199 -14.897   9.107
  403    H    GLU  57           H        GLU  57   2.939 -12.738   7.784
  404    HA   GLU  57           HA       GLU  57   1.520 -10.516   8.712
  405   1HB   GLU  57          2HB       GLU  57   4.168 -11.106   8.155
  406   2HB   GLU  57          1HB       GLU  57   3.786  -9.831   6.996
  407   1HG   GLU  57          2HG       GLU  57   3.147  -9.559   9.913
  408   2HG   GLU  57          1HG       GLU  57   4.734  -9.151   9.264
  409    H    LEU  58           H        LEU  58   2.834 -10.946   5.424
  410    HA   LEU  58           HA       LEU  58   1.358  -8.850   4.280
  411   1HB   LEU  58          2HB       LEU  58   2.349 -11.303   2.829
  412   2HB   LEU  58          1HB       LEU  58   2.051  -9.707   2.152
  413    HG   LEU  58           HG       LEU  58   4.129 -10.092   4.285
  414   1HD1  LEU  58          1HD1      LEU  58   4.230 -10.963   1.464
  415   2HD1  LEU  58          2HD1      LEU  58   5.117 -11.552   2.871
  416   3HD1  LEU  58          3HD1      LEU  58   5.626 -10.067   2.067
  417   1HD2  LEU  58          1HD2      LEU  58   3.341  -8.003   2.340
  418   2HD2  LEU  58          2HD2      LEU  58   5.066  -8.200   2.652
  419   3HD2  LEU  58          3HD2      LEU  58   3.964  -7.851   3.983
  420    H    ASP  59           H        ASP  59   0.692 -12.311   4.555
  421    HA   ASP  59           HA       ASP  59  -1.660 -12.314   2.984
  422   1HB   ASP  59          2HB       ASP  59  -0.147 -14.275   3.997
  423   2HB   ASP  59          1HB       ASP  59  -1.409 -14.246   5.234
  424    H    ALA  60           H        ALA  60  -1.008 -11.335   6.229
  425    HA   ALA  60           HA       ALA  60  -3.736 -11.503   7.106
  426   1HB   ALA  60          1HB       ALA  60  -1.181 -10.537   8.274
  427   2HB   ALA  60          2HB       ALA  60  -2.373 -11.659   8.931
  428   3HB   ALA  60          3HB       ALA  60  -2.686  -9.924   8.957
  429    H    ILE  61           H        ILE  61  -1.675  -9.106   5.631
  430    HA   ILE  61           HA       ILE  61  -3.521  -6.937   6.094
  431    HB   ILE  61           HB       ILE  61  -0.911  -7.184   4.627
  432   1HG1  ILE  61          2HG1      ILE  61  -0.713  -5.038   6.267
  433   2HG1  ILE  61          1HG1      ILE  61  -1.914  -5.991   7.143
  434   1HG2  ILE  61          1HG2      ILE  61  -1.199  -4.654   4.242
  435   2HG2  ILE  61          2HG2      ILE  61  -2.924  -4.981   4.404
  436   3HG2  ILE  61          3HG2      ILE  61  -1.993  -5.774   3.134
  437   1HD1  ILE  61          1HD1      ILE  61   0.573  -7.322   6.198
  438   2HD1  ILE  61          2HD1      ILE  61  -0.437  -7.677   7.599
  439   3HD1  ILE  61          3HD1      ILE  61   0.636  -6.278   7.617
  440    H    ILE  62           H        ILE  62  -2.245  -8.548   3.163
  441    HA   ILE  62           HA       ILE  62  -3.824  -7.438   1.237
  442    HB   ILE  62           HB       ILE  62  -3.026 -10.344   1.439
  443   1HG1  ILE  62          2HG1      ILE  62  -1.741  -7.944   0.116
  444   2HG1  ILE  62          1HG1      ILE  62  -1.108  -8.869   1.481
  445   1HG2  ILE  62          1HG2      ILE  62  -4.728  -9.030  -0.446
  446   2HG2  ILE  62          2HG2      ILE  62  -4.214 -10.717  -0.400
  447   3HG2  ILE  62          3HG2      ILE  62  -3.238  -9.520  -1.253
  448   1HD1  ILE  62          1HD1      ILE  62  -1.618 -10.524  -0.847
  449   2HD1  ILE  62          2HD1      ILE  62  -0.166 -10.365   0.141
  450   3HD1  ILE  62          3HD1      ILE  62  -0.472  -9.223  -1.166
  451    H    CYS  63           H        CYS  63  -4.699 -10.093   3.415
  452    HA   CYS  63           HA       CYS  63  -7.188 -10.728   2.314
  453   1HB   CYS  63          2HB       CYS  63  -5.800 -11.867   4.224
  454   2HB   CYS  63          1HB       CYS  63  -6.740 -10.810   5.281
  455    HG   CYS  63           HG       CYS  63  -8.906 -12.019   4.375
  456    H    GLU  64           H        GLU  64  -6.230  -8.235   4.602
  457    HA   GLU  64           HA       GLU  64  -8.951  -7.346   5.018
  458   1HB   GLU  64          2HB       GLU  64  -6.392  -6.924   6.278
  459   2HB   GLU  64          1HB       GLU  64  -7.151  -5.376   5.936
  460   1HG   GLU  64          2HG       GLU  64  -9.102  -7.143   7.032
  461   2HG   GLU  64          1HG       GLU  64  -7.671  -7.148   8.061
  462    H    VAL  65           H        VAL  65  -6.158  -6.472   3.106
  463    HA   VAL  65           HA       VAL  65  -7.071  -3.930   2.239
  464    HB   VAL  65           HB       VAL  65  -5.168  -5.829   0.853
  465   1HG1  VAL  65          1HG1      VAL  65  -5.553  -2.860   0.496
  466   2HG1  VAL  65          2HG1      VAL  65  -6.052  -4.110  -0.642
  467   3HG1  VAL  65          3HG1      VAL  65  -4.339  -3.853  -0.309
  468   1HG2  VAL  65          1HG2      VAL  65  -4.812  -3.850   3.053
  469   2HG2  VAL  65          2HG2      VAL  65  -3.510  -4.063   1.882
  470   3HG2  VAL  65          3HG2      VAL  65  -4.076  -5.434   2.830
  471    H    ASP  66           H        ASP  66  -7.251  -7.179   0.839
  472    HA   ASP  66           HA       ASP  66  -8.714  -6.306  -1.469
  473   1HB   ASP  66          2HB       ASP  66  -7.867  -8.966  -0.371
  474   2HB   ASP  66          1HB       ASP  66  -9.049  -8.889  -1.675
  475    H    GLU  67           H        GLU  67 -10.835  -6.057  -1.676
  476    HA   GLU  67           HA       GLU  67 -12.585  -7.190   0.407
  477   1HB   GLU  67          2HB       GLU  67 -12.587  -4.529  -0.962
  478   2HB   GLU  67          1HB       GLU  67 -14.121  -5.218  -0.430
  479   1HG   GLU  67          2HG       GLU  67 -11.728  -4.623   1.301
  480   2HG   GLU  67          1HG       GLU  67 -13.242  -3.712   1.240
  481    H    ASP  68           H        ASP  68 -11.712  -8.351  -2.176
  482    HA   ASP  68           HA       ASP  68 -14.360  -9.049  -3.147
  483   1HB   ASP  68          2HB       ASP  68 -13.782  -8.655  -5.498
  484   2HB   ASP  68          1HB       ASP  68 -13.713  -7.157  -4.575
  485    H    GLY  69           H        GLY  69 -11.959 -10.279  -1.757
  486   1HA   GLY  69          2HA       GLY  69 -10.795 -12.260  -1.782
  487   2HA   GLY  69          1HA       GLY  69 -12.149 -12.859  -2.728
  488    H    SER  70           H        SER  70  -9.573 -10.501  -3.430
  489    HA   SER  70           HA       SER  70  -8.965 -12.051  -5.858
  490   1HB   SER  70          2HB       SER  70  -7.815  -9.701  -6.413
  491   2HB   SER  70          1HB       SER  70  -9.527 -10.008  -6.733
  492    HG   SER  70           HG       SER  70  -8.652  -8.946  -4.266
  493    H    GLY  71           H        GLY  71  -7.644 -10.676  -2.948
  494   1HA   GLY  71          2HA       GLY  71  -5.630 -11.084  -1.903
  495   2HA   GLY  71          1HA       GLY  71  -5.286 -12.275  -3.155
  496    H    THR  72           H        THR  72  -6.073  -9.295  -4.513
  497    HA   THR  72           HA       THR  72  -3.229  -8.565  -4.720
  498    HB   THR  72           HB       THR  72  -3.483  -8.021  -7.003
  499    HG1  THR  72           1HG      THR  72  -6.276  -8.358  -6.651
  500   1HG2  THR  72          1HG2      THR  72  -4.497 -10.009  -8.079
  501   2HG2  THR  72          2HG2      THR  72  -5.055 -10.530  -6.490
  502   3HG2  THR  72          3HG2      THR  72  -3.327 -10.391  -6.817
  503    H    ILE  73           H        ILE  73  -2.904  -6.252  -5.359
  504    HA   ILE  73           HA       ILE  73  -4.909  -4.555  -4.017
  505    HB   ILE  73           HB       ILE  73  -1.951  -4.025  -4.256
  506   1HG1  ILE  73          2HG1      ILE  73  -3.519  -5.022  -1.861
  507   2HG1  ILE  73          1HG1      ILE  73  -2.431  -6.005  -2.844
  508   1HG2  ILE  73          1HG2      ILE  73  -2.277  -2.075  -3.150
  509   2HG2  ILE  73          2HG2      ILE  73  -3.618  -2.713  -2.199
  510   3HG2  ILE  73          3HG2      ILE  73  -3.883  -2.205  -3.866
  511   1HD1  ILE  73          1HD1      ILE  73  -1.460  -5.202  -0.704
  512   2HD1  ILE  73          2HD1      ILE  73  -1.570  -3.556  -1.328
  513   3HD1  ILE  73          3HD1      ILE  73  -0.541  -4.740  -2.135
  514    H    ASP  74           H        ASP  74  -5.918  -3.143  -5.276
  515    HA   ASP  74           HA       ASP  74  -5.133  -2.697  -7.987
  516   1HB   ASP  74          2HB       ASP  74  -7.508  -2.564  -6.673
  517   2HB   ASP  74          1HB       ASP  74  -7.101  -0.849  -6.785
  518    H    PHE  75           H        PHE  75  -5.645  -0.042  -8.458
  519    HA   PHE  75           HA       PHE  75  -3.158   1.151  -7.919
  520   1HB   PHE  75          2HB       PHE  75  -5.762   2.236  -8.980
  521   2HB   PHE  75          1HB       PHE  75  -4.348   3.269  -8.756
  522    HD1  PHE  75           1HD      PHE  75  -5.719   0.415 -10.623
  523    HD2  PHE  75           2HD      PHE  75  -2.484   3.152 -10.235
  524    HE1  PHE  75           1HE      PHE  75  -4.867  -0.286 -12.823
  525    HE2  PHE  75           2HE      PHE  75  -1.627   2.457 -12.433
  526    HZ   PHE  75           HZ       PHE  75  -2.819   0.736 -13.730
  527    H    GLU  76           H        GLU  76  -6.173   2.795  -7.042
  528    HA   GLU  76           HA       GLU  76  -5.028   4.205  -4.910
  529   1HB   GLU  76          2HB       GLU  76  -7.495   4.497  -4.193
  530   2HB   GLU  76          1HB       GLU  76  -6.986   5.157  -5.742
  531   1HG   GLU  76          2HG       GLU  76  -8.009   2.404  -5.825
  532   2HG   GLU  76          1HG       GLU  76  -9.182   3.639  -5.374
  533    H    GLU  77           H        GLU  77  -6.268   0.989  -5.086
  534    HA   GLU  77           HA       GLU  77  -7.033   0.502  -2.468
  535   1HB   GLU  77          2HB       GLU  77  -6.217  -1.093  -4.764
  536   2HB   GLU  77          1HB       GLU  77  -5.739  -1.833  -3.241
  537   1HG   GLU  77          2HG       GLU  77  -8.099  -1.562  -2.465
  538   2HG   GLU  77          1HG       GLU  77  -8.512  -1.050  -4.106
  539    H    PHE  78           H        PHE  78  -3.867   1.020  -3.778
  540    HA   PHE  78           HA       PHE  78  -2.332  -0.199  -1.740
  541   1HB   PHE  78          2HB       PHE  78  -1.456   0.549  -3.971
  542   2HB   PHE  78          1HB       PHE  78  -1.569   2.217  -3.404
  543    HD1  PHE  78           1HD      PHE  78  -0.101  -1.056  -2.378
  544    HD2  PHE  78           2HD      PHE  78   0.299   3.179  -2.483
  545    HE1  PHE  78           1HE      PHE  78   2.140  -1.247  -1.379
  546    HE2  PHE  78           2HE      PHE  78   2.540   2.995  -1.484
  547    HZ   PHE  78           HZ       PHE  78   3.459   0.784  -0.928
  548    H    LEU  79           H        LEU  79  -4.310   2.568  -1.693
  549    HA   LEU  79           HA       LEU  79  -2.884   3.754   0.570
  550   1HB   LEU  79          2HB       LEU  79  -5.362   4.702  -0.883
  551   2HB   LEU  79          1HB       LEU  79  -4.517   5.579   0.378
  552    HG   LEU  79           HG       LEU  79  -2.519   5.155  -1.455
  553   1HD1  LEU  79          1HD1      LEU  79  -5.119   5.539  -2.916
  554   2HD1  LEU  79          2HD1      LEU  79  -3.906   4.283  -3.163
  555   3HD1  LEU  79          3HD1      LEU  79  -3.550   5.953  -3.607
  556   1HD2  LEU  79          1HD2      LEU  79  -2.630   7.492  -1.847
  557   2HD2  LEU  79          2HD2      LEU  79  -3.181   7.232  -0.191
  558   3HD2  LEU  79          3HD2      LEU  79  -4.352   7.541  -1.472
  559    H    VAL  80           H        VAL  80  -5.900   2.181  -0.308
  560    HA   VAL  80           HA       VAL  80  -7.194   2.428   2.193
  561    HB   VAL  80           HB       VAL  80  -7.574   0.184   0.214
  562   1HG1  VAL  80          1HG1      VAL  80  -9.943   0.361   1.111
  563   2HG1  VAL  80          2HG1      VAL  80  -9.269   1.361   2.397
  564   3HG1  VAL  80          3HG1      VAL  80  -8.729  -0.307   2.203
  565   1HG2  VAL  80          1HG2      VAL  80  -8.608   1.538  -1.229
  566   2HG2  VAL  80          2HG2      VAL  80  -7.794   2.855  -0.387
  567   3HG2  VAL  80          3HG2      VAL  80  -9.443   2.413   0.054
  568    H    MET  81           H        MET  81  -4.961   0.081   0.844
  569    HA   MET  81           HA       MET  81  -5.169  -2.013   2.602
  570   1HB   MET  81          2HB       MET  81  -2.580  -2.136   2.263
  571   2HB   MET  81          1HB       MET  81  -3.646  -2.388   0.895
  572   1HG   MET  81          2HG       MET  81  -3.082  -0.440  -0.097
  573   2HG   MET  81          1HG       MET  81  -2.683   0.360   1.424
  574   1HE   MET  81          1HE       MET  81  -0.143  -2.303   2.363
  575   2HE   MET  81          2HE       MET  81  -1.126  -0.956   2.935
  576   3HE   MET  81          3HE       MET  81   0.559  -0.686   2.478
  577    H    MET  82           H        MET  82  -3.502   1.041   2.999
  578    HA   MET  82           HA       MET  82  -2.593   0.357   5.666
  579   1HB   MET  82          2HB       MET  82  -1.635   2.042   3.684
  580   2HB   MET  82          1HB       MET  82  -2.319   3.155   4.868
  581   1HG   MET  82          2HG       MET  82  -0.987   1.936   6.621
  582   2HG   MET  82          1HG       MET  82  -0.172   1.096   5.303
  583   1HE   MET  82          1HE       MET  82   1.257   3.810   3.224
  584   2HE   MET  82          2HE       MET  82   0.765   2.130   3.426
  585   3HE   MET  82          3HE       MET  82   2.302   2.684   4.087
  586    H    VAL  83           H        VAL  83  -5.062   2.310   4.103
  587    HA   VAL  83           HA       VAL  83  -5.896   3.835   6.300
  588    HB   VAL  83           HB       VAL  83  -7.587   2.772   4.028
  589   1HG1  VAL  83          1HG1      VAL  83  -8.944   4.856   4.536
  590   2HG1  VAL  83          2HG1      VAL  83  -8.078   4.916   6.074
  591   3HG1  VAL  83          3HG1      VAL  83  -9.081   3.520   5.680
  592   1HG2  VAL  83          1HG2      VAL  83  -6.551   4.210   2.692
  593   2HG2  VAL  83          2HG2      VAL  83  -5.448   4.620   4.006
  594   3HG2  VAL  83          3HG2      VAL  83  -6.937   5.539   3.783
  595    H    ARG  84           H        ARG  84  -6.602   0.536   5.349
  596    HA   ARG  84           HA       ARG  84  -8.723   0.134   7.215
  597   1HB   ARG  84          2HB       ARG  84  -6.979  -1.859   5.758
  598   2HB   ARG  84          1HB       ARG  84  -8.425  -2.266   6.672
  599   1HG   ARG  84          2HG       ARG  84  -9.295  -0.306   4.937
  600   2HG   ARG  84          1HG       ARG  84  -8.150  -1.245   3.969
  601   1HD   ARG  84          2HD       ARG  84  -9.680  -2.829   3.701
  602   2HD   ARG  84          1HD       ARG  84  -9.741  -3.071   5.446
  603    HE   ARG  84           HE       ARG  84 -11.646  -1.656   3.817
  604   1HH1  ARG  84          1HH1      ARG  84 -10.367  -2.063   7.040
  605   2HH1  ARG  84          2HH1      ARG  84 -11.797  -1.471   7.816
  606   1HH2  ARG  84          1HH2      ARG  84 -13.527  -0.877   4.838
  607   2HH2  ARG  84          2HH2      ARG  84 -13.590  -0.799   6.567
  608    H    GLN  85           H        GLN  85  -5.313   0.211   7.485
  609    HA   GLN  85           HA       GLN  85  -5.426  -1.202  10.064
  610   1HB   GLN  85          2HB       GLN  85  -2.890  -0.496   8.604
  611   2HB   GLN  85          1HB       GLN  85  -3.137  -1.719   9.850
  612   1HG   GLN  85          2HG       GLN  85  -4.044  -1.803   6.984
  613   2HG   GLN  85          1HG       GLN  85  -2.845  -2.835   7.773
  614   1HE2  GLN  85          1HE2      GLN  85  -5.505  -3.292   6.377
  615   2HE2  GLN  85          2HE2      GLN  85  -6.375  -4.313   7.466
  616    H    MET  86           H        MET  86  -5.175   1.859   8.644
  617    HA   MET  86           HA       MET  86  -3.658   3.054  10.802
  618   1HB   MET  86          2HB       MET  86  -4.771   3.970   8.198
  619   2HB   MET  86          1HB       MET  86  -4.504   5.187   9.447
  620   1HG   MET  86          2HG       MET  86  -2.144   4.118   9.611
  621   2HG   MET  86          1HG       MET  86  -2.524   3.474   8.010
  622   1HE   MET  86          1HE       MET  86  -2.590   5.700   5.619
  623   2HE   MET  86          2HE       MET  86  -1.863   4.233   6.271
  624   3HE   MET  86          3HE       MET  86  -0.876   5.675   6.040
  625    H    LYS  87           H        LYS  87  -6.996   2.983   9.632
  626    HA   LYS  87           HA       LYS  87  -8.001   4.832  11.542
  627   1HB   LYS  87          2HB       LYS  87  -9.184   2.893   9.614
  628   2HB   LYS  87          1HB       LYS  87 -10.212   3.487  10.918
  629   1HG   LYS  87          2HG       LYS  87 -10.485   5.462   9.933
  630   2HG   LYS  87          1HG       LYS  87  -8.756   5.626   9.599
  631   1HD   LYS  87          2HD       LYS  87  -9.977   5.596   7.515
  632   2HD   LYS  87          1HD       LYS  87  -9.030   4.114   7.661
  633   1HE   LYS  87          2HE       LYS  87 -10.864   2.797   7.825
  634   2HE   LYS  87          1HE       LYS  87 -11.784   4.009   8.716
  635   1HZ   LYS  87          1HZ       LYS  87 -12.240   3.351   6.166
  636   2HZ   LYS  87          2HZ       LYS  87 -11.215   4.680   5.957
  637   3HZ   LYS  87          3HZ       LYS  87 -12.648   4.849   6.840
  638    H    GLU  88           H        GLU  88  -6.706   3.733  13.328
  639    HA   GLU  88           HA       GLU  88  -8.508   1.904  14.746
  640   1HB   GLU  88          2HB       GLU  88  -5.852   1.288  13.788
  641   2HB   GLU  88          1HB       GLU  88  -5.913   1.179  15.542
  642   1HG   GLU  88          2HG       GLU  88  -7.954  -0.278  15.253
  643   2HG   GLU  88          1HG       GLU  88  -7.560  -0.328  13.535
  644    H    ASP  89           H        ASP  89  -9.214   3.424  16.180
  645    HA   ASP  89           HA       ASP  89  -7.528   5.321  17.449
  646   1HB   ASP  89          2HB       ASP  89 -10.207   5.099  17.165
  647   2HB   ASP  89          1HB       ASP  89 -10.029   4.524  18.826
  648    H    ALA  90           H        ALA  90  -7.355   5.443  19.885
  649    HA   ALA  90           HA       ALA  90  -5.913   3.200  20.824
  650   1HB   ALA  90          1HB       ALA  90  -6.690   5.840  21.902
  651   2HB   ALA  90          2HB       ALA  90  -5.113   5.051  21.852
  652   3HB   ALA  90          3HB       ALA  90  -6.290   4.591  23.082
  653   2H    ARG 115          HN2       ARG 115   2.309  -1.999  10.590
  654    H    ARG 115           H        ARG 115   2.057  -3.286   9.484
  655   3H    ARG 115          HN3       ARG 115   2.957  -1.909   9.003
  656    HA   ARG 115           HA       ARG 115   0.966  -1.523   8.044
  657   1HB   ARG 115          2HB       ARG 115  -1.179  -1.938   9.315
  658   2HB   ARG 115          1HB       ARG 115  -0.255  -3.377   8.909
  659   1HG   ARG 115          2HG       ARG 115   0.755  -2.993  11.312
  660   2HG   ARG 115          1HG       ARG 115  -0.764  -2.129  11.556
  661   1HD   ARG 115          2HD       ARG 115  -1.879  -4.040  11.761
  662   2HD   ARG 115          1HD       ARG 115  -1.251  -4.626  10.222
  663    HE   ARG 115           HE       ARG 115   0.616  -4.838  12.401
  664   1HH1  ARG 115          1HH1      ARG 115  -2.011  -6.400  10.715
  665   2HH1  ARG 115          2HH1      ARG 115  -1.558  -7.991  11.226
  666   1HH2  ARG 115          1HH2      ARG 115   1.213  -6.931  13.073
  667   2HH2  ARG 115          2HH2      ARG 115   0.271  -8.293  12.565
  668    H    MET 116           H        MET 116  -0.810   0.146   8.550
  669    HA   MET 116           HA       MET 116  -1.376   2.238   9.224
  670   1HB   MET 116          2HB       MET 116  -1.645   1.285  11.431
  671   2HB   MET 116          1HB       MET 116   0.082   1.399  11.735
  672   1HG   MET 116          2HG       MET 116  -0.180   3.906  11.454
  673   2HG   MET 116          1HG       MET 116  -1.919   3.625  11.528
  674   1HE   MET 116          1HE       MET 116  -2.978   2.138  13.691
  675   2HE   MET 116          2HE       MET 116  -1.982   1.726  15.088
  676   3HE   MET 116          3HE       MET 116  -1.641   1.001  13.517
  677    H    SER 117           H        SER 117   1.742   2.063  10.921
  678    HA   SER 117           HA       SER 117   2.574   4.505   9.599
  679   1HB   SER 117          2HB       SER 117   4.248   4.680  11.229
  680   2HB   SER 117          1HB       SER 117   2.905   3.934  12.095
  681    HG   SER 117           HG       SER 117   3.975   2.084  12.204
  682    H    ALA 118           H        ALA 118   2.381   2.733   7.653
  683    HA   ALA 118           HA       ALA 118   4.871   1.343   7.199
  684   1HB   ALA 118          1HB       ALA 118   3.588   1.337   4.790
  685   2HB   ALA 118          2HB       ALA 118   2.242   1.483   5.920
  686   3HB   ALA 118          3HB       ALA 118   3.367   0.133   6.058
  687    H    ASP 119           H        ASP 119   4.040   4.515   7.102
  688    HA   ASP 119           HA       ASP 119   4.794   5.648   4.762
  689   1HB   ASP 119          2HB       ASP 119   4.061   6.892   6.769
  690   2HB   ASP 119          1HB       ASP 119   5.640   6.618   7.497
  691    H    ALA 120           H        ALA 120   6.875   4.020   7.039
  692    HA   ALA 120           HA       ALA 120   9.367   4.997   6.364
  693   1HB   ALA 120          1HB       ALA 120   9.240   2.072   6.679
  694   2HB   ALA 120          2HB       ALA 120   8.499   3.012   7.975
  695   3HB   ALA 120          3HB       ALA 120  10.193   3.269   7.556
  696    H    MET 121           H        MET 121   8.127   1.927   5.022
  697    HA   MET 121           HA       MET 121   9.933   1.780   2.909
  698   1HB   MET 121          2HB       MET 121   8.581  -0.133   3.531
  699   2HB   MET 121          1HB       MET 121   7.106   0.720   3.102
  700   1HG   MET 121          2HG       MET 121   8.440   0.847   0.758
  701   2HG   MET 121          1HG       MET 121   9.054  -0.675   1.403
  702   1HE   MET 121          1HE       MET 121   5.304   0.551   2.269
  703   2HE   MET 121          2HE       MET 121   4.611   0.261   0.674
  704   3HE   MET 121          3HE       MET 121   5.910   1.437   0.870
  705    H    LEU 122           H        LEU 122   6.949   3.541   3.251
  706    HA   LEU 122           HA       LEU 122   6.529   4.201   0.541
  707   1HB   LEU 122          2HB       LEU 122   5.648   5.328   3.164
  708   2HB   LEU 122          1HB       LEU 122   5.360   6.251   1.708
  709    HG   LEU 122           HG       LEU 122   4.092   4.316   0.783
  710   1HD1  LEU 122          1HD1      LEU 122   3.544   2.438   2.066
  711   2HD1  LEU 122          2HD1      LEU 122   4.096   3.189   3.562
  712   3HD1  LEU 122          3HD1      LEU 122   5.269   2.667   2.356
  713   1HD2  LEU 122          1HD2      LEU 122   2.881   5.043   3.417
  714   2HD2  LEU 122          2HD2      LEU 122   2.126   4.919   1.829
  715   3HD2  LEU 122          3HD2      LEU 122   3.166   6.292   2.204
  716    H    ARG 123           H        ARG 123   8.434   5.664   3.120
  717    HA   ARG 123           HA       ARG 123   9.242   7.867   1.393
  718   1HB   ARG 123          2HB       ARG 123   8.731   8.139   3.860
  719   2HB   ARG 123          1HB       ARG 123  10.223   7.264   4.181
  720   1HG   ARG 123          2HG       ARG 123  10.628   9.450   2.323
  721   2HG   ARG 123          1HG       ARG 123   9.942   9.994   3.855
  722   1HD   ARG 123          2HD       ARG 123  11.748   9.150   5.092
  723   2HD   ARG 123          1HD       ARG 123  12.298   8.138   3.757
  724    HE   ARG 123           HE       ARG 123  12.369  10.954   3.182
  725   1HH1  ARG 123          1HH1      ARG 123  14.116   8.273   4.574
  726   2HH1  ARG 123          2HH1      ARG 123  15.669   9.003   4.346
  727   1HH2  ARG 123          1HH2      ARG 123  14.411  11.918   2.882
  728   2HH2  ARG 123          2HH2      ARG 123  15.837  11.073   3.386
  729    H    ALA 124           H        ALA 124  10.088   4.785   1.412
  730    HA   ALA 124           HA       ALA 124  12.943   4.942   1.628
  731   1HB   ALA 124          1HB       ALA 124  11.037   2.891   1.563
  732   2HB   ALA 124          2HB       ALA 124  12.783   2.732   1.750
  733   3HB   ALA 124          3HB       ALA 124  12.057   2.645   0.145
  734    H    LEU 125           H        LEU 125  11.113   3.748  -1.167
  735    HA   LEU 125           HA       LEU 125  13.160   4.624  -2.967
  736   1HB   LEU 125          2HB       LEU 125  10.427   3.544  -3.634
  737   2HB   LEU 125          1HB       LEU 125  11.825   3.607  -4.694
  738    HG   LEU 125           HG       LEU 125  11.998   2.067  -2.140
  739   1HD1  LEU 125          1HD1      LEU 125   9.922   1.544  -3.759
  740   2HD1  LEU 125          2HD1      LEU 125  10.776   0.313  -2.832
  741   3HD1  LEU 125          3HD1      LEU 125  11.170   0.567  -4.532
  742   1HD2  LEU 125          1HD2      LEU 125  13.140   1.094  -4.670
  743   2HD2  LEU 125          2HD2      LEU 125  13.842   1.159  -3.054
  744   3HD2  LEU 125          3HD2      LEU 125  13.810   2.607  -4.061
  745    H    LEU 126           H        LEU 126  10.618   6.246  -1.533
  746    HA   LEU 126           HA       LEU 126   9.394   7.751  -3.469
  747   1HB   LEU 126          2HB       LEU 126   9.237   7.790  -0.852
  748   2HB   LEU 126          1HB       LEU 126  10.382   9.109  -0.997
  749    HG   LEU 126           HG       LEU 126   7.590   8.996  -2.130
  750   1HD1  LEU 126          1HD1      LEU 126   8.582  11.167  -0.374
  751   2HD1  LEU 126          2HD1      LEU 126   8.251   9.601   0.367
  752   3HD1  LEU 126          3HD1      LEU 126   6.974  10.454  -0.501
  753   1HD2  LEU 126          1HD2      LEU 126   8.902  10.083  -3.782
  754   2HD2  LEU 126          2HD2      LEU 126   9.791  11.000  -2.567
  755   3HD2  LEU 126          3HD2      LEU 126   8.088  11.348  -2.862
  756    H    GLY 127           H        GLY 127  10.118   9.014  -5.045
  757   1HA   GLY 127          2HA       GLY 127  12.377  10.792  -4.562
  758   2HA   GLY 127          1HA       GLY 127  12.589   9.594  -5.831
  759    H    SER 128           H        SER 128  11.053  12.553  -4.904
  760    HA   SER 128           HA       SER 128  10.511  13.157  -7.680
  761   1HB   SER 128          2HB       SER 128   8.446  11.982  -6.862
  762   2HB   SER 128          1HB       SER 128   8.238  13.280  -5.687
  763    HG   SER 128           HG       SER 128   8.082  14.738  -7.432
  764    H    LYS 129           H        LYS 129   9.411  14.401  -4.522
  765    HA   LYS 129           HA       LYS 129   9.979  17.103  -5.272
  766   1HB   LYS 129          2HB       LYS 129   8.149  16.398  -3.699
  767   2HB   LYS 129          1HB       LYS 129   9.390  16.033  -2.509
  768   1HG   LYS 129          2HG       LYS 129   8.835  18.134  -1.850
  769   2HG   LYS 129          1HG       LYS 129  10.108  18.523  -3.008
  770   1HD   LYS 129          2HD       LYS 129   8.546  19.917  -3.852
  771   2HD   LYS 129          1HD       LYS 129   7.968  18.454  -4.650
  772   1HE   LYS 129          2HE       LYS 129   6.949  18.856  -1.926
  773   2HE   LYS 129          1HE       LYS 129   6.445  20.082  -3.089
  774   1HZ   LYS 129          1HZ       LYS 129   5.176  17.775  -2.748
  775   2HZ   LYS 129          2HZ       LYS 129   6.241  17.326  -3.981
  776   3HZ   LYS 129          3HZ       LYS 129   5.178  18.621  -4.213
  777    H    HIS 130           H        HIS 130  11.544  18.495  -4.399
  778    HA   HIS 130           HA       HIS 130  14.117  17.435  -4.126
  779   1HB   HIS 130          2HB       HIS 130  12.869  20.099  -3.817
  780   2HB   HIS 130          1HB       HIS 130  14.406  19.873  -2.988
  781    HD1  HIS 130           1HD      HIS 130  15.763  21.369  -4.533
  782    HD2  HIS 130           2HD      HIS 130  13.759  18.327  -6.534
  783    HE1  HIS 130           1HE      HIS 130  16.689  21.379  -6.872
  784    HE2  HIS 130           2HE      HIS 130  15.524  19.472  -8.038
  785    H    LYS 131           H        LYS 131  15.575  17.823  -2.221
  786    HA   LYS 131           HA       LYS 131  14.215  16.899   0.208
  787   1HB   LYS 131          2HB       LYS 131  16.430  16.111   0.928
  788   2HB   LYS 131          1HB       LYS 131  15.970  15.428  -0.625
  789   1HG   LYS 131          2HG       LYS 131  17.526  17.916  -0.768
  790   2HG   LYS 131          1HG       LYS 131  18.377  16.524  -0.093
  791   1HD   LYS 131          2HD       LYS 131  18.095  15.262  -2.049
  792   2HD   LYS 131          1HD       LYS 131  16.829  16.331  -2.658
  793   1HE   LYS 131          2HE       LYS 131  19.557  17.437  -2.184
  794   2HE   LYS 131          1HE       LYS 131  19.275  16.445  -3.614
  795   1HZ   LYS 131          1HZ       LYS 131  18.932  18.999  -3.716
  796   2HZ   LYS 131          2HZ       LYS 131  17.435  18.656  -3.009
  797   3HZ   LYS 131          3HZ       LYS 131  17.838  17.976  -4.505
  Start of MODEL   16
    1   2H    ALA   1          HN2       ALA   1 -22.592   1.755 -13.446
    2    H    ALA   1           H        ALA   1 -22.997   1.133 -11.899
    3   3H    ALA   1          HN3       ALA   1 -23.487   2.715 -12.341
    4    HA   ALA   1           HA       ALA   1 -20.666   1.961 -12.305
    5   1HB   ALA   1          1HB       ALA   1 -20.746   4.024 -13.237
    6   2HB   ALA   1          2HB       ALA   1 -20.785   4.520 -11.545
    7   3HB   ALA   1          3HB       ALA   1 -22.283   4.432 -12.472
    8    H    SER   2           H        SER   2 -19.685   3.342 -10.312
    9    HA   SER   2           HA       SER   2 -19.311   3.381  -8.069
   10   1HB   SER   2          2HB       SER   2 -22.270   3.552  -8.269
   11   2HB   SER   2          1HB       SER   2 -21.605   3.137  -6.690
   12    HG   SER   2           HG       SER   2 -21.847   5.420  -7.048
   13    H    MET   3           H        MET   3 -18.923   1.975  -6.350
   14    HA   MET   3           HA       MET   3 -20.205  -0.599  -6.222
   15   1HB   MET   3          2HB       MET   3 -17.537  -0.255  -7.471
   16   2HB   MET   3          1HB       MET   3 -17.709  -1.595  -6.346
   17   1HG   MET   3          2HG       MET   3 -18.430  -2.740  -8.112
   18   2HG   MET   3          1HG       MET   3 -19.943  -1.867  -7.880
   19   1HE   MET   3          1HE       MET   3 -16.487  -1.151  -8.915
   20   2HE   MET   3          2HE       MET   3 -16.658   0.096 -10.149
   21   3HE   MET   3          3HE       MET   3 -16.581  -1.602 -10.617
   22    H    THR   4           H        THR   4 -17.402   1.335  -5.222
   23    HA   THR   4           HA       THR   4 -18.091   1.146  -2.471
   24    HB   THR   4           HB       THR   4 -17.157  -1.117  -2.780
   25    HG1  THR   4           1HG      THR   4 -16.824   0.119  -0.806
   26   1HG2  THR   4          1HG2      THR   4 -15.290  -1.574  -3.870
   27   2HG2  THR   4          2HG2      THR   4 -14.383  -0.378  -2.945
   28   3HG2  THR   4          3HG2      THR   4 -15.260   0.109  -4.395
   29    H    ASP   5           H        ASP   5 -17.498   3.035  -1.669
   30    HA   ASP   5           HA       ASP   5 -15.507   4.643  -3.011
   31   1HB   ASP   5          2HB       ASP   5 -17.344   5.156  -0.672
   32   2HB   ASP   5          1HB       ASP   5 -16.148   6.333  -1.222
   33    H    GLN   6           H        GLN   6 -15.203   2.214  -0.862
   34    HA   GLN   6           HA       GLN   6 -13.653   3.139   1.235
   35   1HB   GLN   6          2HB       GLN   6 -12.767   0.885   1.402
   36   2HB   GLN   6          1HB       GLN   6 -14.484   0.826   1.028
   37   1HG   GLN   6          2HG       GLN   6 -13.993  -0.545  -0.633
   38   2HG   GLN   6          1HG       GLN   6 -13.222   0.815  -1.448
   39   1HE2  GLN   6          1HE2      GLN   6 -12.530  -1.576   1.081
   40   2HE2  GLN   6          2HE2      GLN   6 -10.901  -1.878   0.589
   41    H    GLN   7           H        GLN   7 -12.844   2.863  -2.115
   42    HA   GLN   7           HA       GLN   7  -9.992   3.179  -1.576
   43   1HB   GLN   7          2HB       GLN   7 -10.331   3.378  -4.335
   44   2HB   GLN   7          1HB       GLN   7  -9.767   1.973  -3.440
   45   1HG   GLN   7          2HG       GLN   7 -12.097   1.176  -3.286
   46   2HG   GLN   7          1HG       GLN   7 -12.607   2.557  -4.263
   47   1HE2  GLN   7          1HE2      GLN   7 -13.205   0.082  -5.128
   48   2HE2  GLN   7          2HE2      GLN   7 -12.238  -0.336  -6.497
   49    H    ALA   8           H        ALA   8 -12.709   5.099  -2.180
   50    HA   ALA   8           HA       ALA   8 -11.204   7.261  -3.386
   51   1HB   ALA   8          1HB       ALA   8 -14.078   6.739  -2.832
   52   2HB   ALA   8          2HB       ALA   8 -13.292   7.289  -4.312
   53   3HB   ALA   8          3HB       ALA   8 -13.550   8.416  -2.980
   54    H    GLU   9           H        GLU   9 -13.024   6.682  -0.379
   55    HA   GLU   9           HA       GLU   9 -12.441   9.131   0.854
   56   1HB   GLU   9          2HB       GLU   9 -12.774   6.532   2.343
   57   2HB   GLU   9          1HB       GLU   9 -13.206   8.151   2.876
   58   1HG   GLU   9          2HG       GLU   9 -14.612   7.561   0.464
   59   2HG   GLU   9          1HG       GLU   9 -14.833   6.233   1.609
   60    H    ALA  10           H        ALA  10 -10.735   6.045   0.842
   61    HA   ALA  10           HA       ALA  10  -8.795   6.390   2.725
   62   1HB   ALA  10          1HB       ALA  10  -8.512   4.366   1.784
   63   2HB   ALA  10          2HB       ALA  10  -7.355   5.213   0.758
   64   3HB   ALA  10          3HB       ALA  10  -9.000   4.928   0.183
   65    H    ARG  11           H        ARG  11  -8.482   7.366  -0.694
   66    HA   ARG  11           HA       ARG  11  -6.020   8.620  -0.535
   67   1HB   ARG  11          2HB       ARG  11  -7.693   8.169  -2.549
   68   2HB   ARG  11          1HB       ARG  11  -8.130   9.846  -2.254
   69   1HG   ARG  11          2HG       ARG  11  -6.234  10.624  -3.147
   70   2HG   ARG  11          1HG       ARG  11  -5.247   9.378  -2.382
   71   1HD   ARG  11          2HD       ARG  11  -5.340   8.021  -4.178
   72   2HD   ARG  11          1HD       ARG  11  -7.022   8.424  -4.522
   73    HE   ARG  11           HE       ARG  11  -5.713  10.672  -5.231
   74   1HH1  ARG  11          1HH1      ARG  11  -5.236   7.309  -6.030
   75   2HH1  ARG  11          2HH1      ARG  11  -4.573   7.646  -7.594
   76   1HH2  ARG  11          1HH2      ARG  11  -4.845  11.117  -7.289
   77   2HH2  ARG  11          2HH2      ARG  11  -4.351   9.807  -8.309
   78    H    ALA  12           H        ALA  12  -9.124   9.690   0.575
   79    HA   ALA  12           HA       ALA  12  -8.188  12.417   1.014
   80   1HB   ALA  12          1HB       ALA  12 -10.881  11.153   1.508
   81   2HB   ALA  12          2HB       ALA  12 -10.428  12.153   0.127
   82   3HB   ALA  12          3HB       ALA  12 -10.496  12.858   1.742
   83    H    PHE  13           H        PHE  13  -8.588   9.443   2.719
   84    HA   PHE  13           HA       PHE  13  -8.822  10.540   5.340
   85   1HB   PHE  13          2HB       PHE  13  -8.533   7.877   4.138
   86   2HB   PHE  13          1HB       PHE  13  -7.749   8.037   5.711
   87    HD1  PHE  13           1HD      PHE  13 -10.882   7.777   3.939
   88    HD2  PHE  13           2HD      PHE  13  -9.095   8.705   7.687
   89    HE1  PHE  13           1HE      PHE  13 -13.060   7.482   5.045
   90    HE2  PHE  13           2HE      PHE  13 -11.268   8.413   8.801
   91    HZ   PHE  13           HZ       PHE  13 -13.255   7.800   7.480
   92    H    LEU  14           H        LEU  14  -6.177   9.960   3.192
   93    HA   LEU  14           HA       LEU  14  -4.273  10.518   5.369
   94   1HB   LEU  14          2HB       LEU  14  -3.637   9.307   2.682
   95   2HB   LEU  14          1HB       LEU  14  -2.577   9.419   4.081
   96    HG   LEU  14           HG       LEU  14  -5.127   7.837   4.196
   97   1HD1  LEU  14          1HD1      LEU  14  -3.728   5.840   3.678
   98   2HD1  LEU  14          2HD1      LEU  14  -2.444   6.935   3.169
   99   3HD1  LEU  14          3HD1      LEU  14  -3.984   6.921   2.309
  100   1HD2  LEU  14          1HD2      LEU  14  -3.818   8.478   6.257
  101   2HD2  LEU  14          2HD2      LEU  14  -2.525   7.444   5.651
  102   3HD2  LEU  14          3HD2      LEU  14  -4.103   6.754   6.030
  103    H    SER  15           H        SER  15  -2.370  11.812   4.759
  104    HA   SER  15           HA       SER  15  -3.197  14.169   3.312
  105   1HB   SER  15          2HB       SER  15  -1.600  13.809   5.481
  106   2HB   SER  15          1HB       SER  15  -0.379  13.946   4.205
  107    HG   SER  15           HG       SER  15  -1.445  15.926   5.369
  108    H    GLU  16           H        GLU  16  -1.824  15.165   1.644
  109    HA   GLU  16           HA       GLU  16  -1.413  13.565  -0.564
  110   1HB   GLU  16          2HB       GLU  16  -0.008  16.147   0.153
  111   2HB   GLU  16          1HB       GLU  16   0.004  15.414  -1.445
  112   1HG   GLU  16          2HG       GLU  16  -1.853  16.500  -1.934
  113   2HG   GLU  16          1HG       GLU  16  -2.693  15.610  -0.665
  114    H    GLU  17           H        GLU  17   0.647  14.125   2.161
  115    HA   GLU  17           HA       GLU  17   3.116  13.301   1.117
  116   1HB   GLU  17          2HB       GLU  17   1.905  13.617   3.802
  117   2HB   GLU  17          1HB       GLU  17   3.291  12.535   3.706
  118   1HG   GLU  17          2HG       GLU  17   3.353  15.321   2.592
  119   2HG   GLU  17          1HG       GLU  17   3.751  14.961   4.272
  120    H    MET  18           H        MET  18   0.708  11.454   2.987
  121    HA   MET  18           HA       MET  18   1.982   8.973   2.816
  122   1HB   MET  18          2HB       MET  18  -0.262   9.924   4.055
  123   2HB   MET  18          1HB       MET  18  -0.959   8.883   2.815
  124   1HG   MET  18          2HG       MET  18  -0.737   7.457   4.607
  125   2HG   MET  18          1HG       MET  18   0.722   7.125   3.677
  126   1HE   MET  18          1HE       MET  18   1.581   6.817   7.586
  127   2HE   MET  18          2HE       MET  18   1.006   5.921   6.179
  128   3HE   MET  18          3HE       MET  18  -0.123   6.879   7.137
  129    H    ILE  19           H        ILE  19   0.250  10.746   0.432
  130    HA   ILE  19           HA       ILE  19  -0.367   8.431  -1.196
  131    HB   ILE  19           HB       ILE  19  -0.713  11.393  -1.623
  132   1HG1  ILE  19          2HG1      ILE  19  -2.741   9.152  -1.569
  133   2HG1  ILE  19          1HG1      ILE  19  -2.299  10.109  -0.152
  134   1HG2  ILE  19          1HG2      ILE  19  -0.647   9.241  -3.621
  135   2HG2  ILE  19          2HG2      ILE  19  -0.451  10.982  -3.817
  136   3HG2  ILE  19          3HG2      ILE  19  -2.067  10.284  -3.697
  137   1HD1  ILE  19          1HD1      ILE  19  -3.787  10.944  -2.604
  138   2HD1  ILE  19          2HD1      ILE  19  -2.965  12.134  -1.594
  139   3HD1  ILE  19          3HD1      ILE  19  -4.235  11.120  -0.907
  140    H    ALA  20           H        ALA  20   1.506  11.404  -1.828
  141    HA   ALA  20           HA       ALA  20   2.843  10.588  -4.085
  142   1HB   ALA  20          1HB       ALA  20   2.921  12.866  -3.255
  143   2HB   ALA  20          2HB       ALA  20   4.556  12.251  -3.505
  144   3HB   ALA  20          3HB       ALA  20   3.891  12.352  -1.874
  145    H    GLU  21           H        GLU  21   3.371   9.623  -0.804
  146    HA   GLU  21           HA       GLU  21   5.956   8.437  -1.328
  147   1HB   GLU  21          2HB       GLU  21   4.178   8.277   1.115
  148   2HB   GLU  21          1HB       GLU  21   5.840   7.717   1.018
  149   1HG   GLU  21          2HG       GLU  21   6.701   9.860   0.965
  150   2HG   GLU  21          1HG       GLU  21   5.181  10.564   0.416
  151    H    PHE  22           H        PHE  22   2.598   7.496  -1.068
  152    HA   PHE  22           HA       PHE  22   2.928   4.715  -0.863
  153   1HB   PHE  22          2HB       PHE  22   0.686   4.770  -0.792
  154   2HB   PHE  22          1HB       PHE  22   0.774   6.505  -1.063
  155    HD1  PHE  22           1HD      PHE  22  -0.253   7.425  -2.914
  156    HD2  PHE  22           2HD      PHE  22   0.684   3.275  -2.917
  157    HE1  PHE  22           1HE      PHE  22  -1.462   7.156  -5.039
  158    HE2  PHE  22           2HE      PHE  22  -0.523   2.998  -5.042
  159    HZ   PHE  22           HZ       PHE  22  -1.599   4.942  -6.106
  160    H    LYS  23           H        LYS  23   3.008   6.918  -3.569
  161    HA   LYS  23           HA       LYS  23   3.003   4.890  -5.585
  162   1HB   LYS  23          2HB       LYS  23   2.383   7.445  -5.719
  163   2HB   LYS  23          1HB       LYS  23   4.105   7.633  -6.052
  164   1HG   LYS  23          2HG       LYS  23   3.116   7.498  -8.155
  165   2HG   LYS  23          1HG       LYS  23   3.763   5.880  -7.877
  166   1HD   LYS  23          2HD       LYS  23   1.674   5.314  -8.594
  167   2HD   LYS  23          1HD       LYS  23   1.337   5.497  -6.867
  168   1HE   LYS  23          2HE       LYS  23   0.350   7.597  -7.167
  169   2HE   LYS  23          1HE       LYS  23   1.061   7.802  -8.767
  170   1HZ   LYS  23          1HZ       LYS  23  -1.452   7.052  -8.370
  171   2HZ   LYS  23          2HZ       LYS  23  -0.720   5.529  -8.447
  172   3HZ   LYS  23          3HZ       LYS  23  -0.563   6.609  -9.739
  173    H    ALA  24           H        ALA  24   5.336   6.093  -3.433
  174    HA   ALA  24           HA       ALA  24   7.721   6.151  -4.745
  175   1HB   ALA  24          1HB       ALA  24   8.762   5.353  -2.664
  176   2HB   ALA  24          2HB       ALA  24   7.172   4.881  -2.065
  177   3HB   ALA  24          3HB       ALA  24   7.531   6.582  -2.373
  178    H    ALA  25           H        ALA  25   6.794   3.192  -3.008
  179    HA   ALA  25           HA       ALA  25   8.558   1.576  -4.541
  180   1HB   ALA  25          1HB       ALA  25   8.240   0.843  -2.361
  181   2HB   ALA  25          2HB       ALA  25   7.298  -0.303  -3.318
  182   3HB   ALA  25          3HB       ALA  25   6.486   1.006  -2.459
  183    H    PHE  26           H        PHE  26   5.597   2.831  -5.395
  184    HA   PHE  26           HA       PHE  26   4.110   0.824  -6.511
  185   1HB   PHE  26          2HB       PHE  26   3.843   3.452  -6.528
  186   2HB   PHE  26          1HB       PHE  26   4.538   3.293  -8.137
  187    HD1  PHE  26           1HD      PHE  26   3.213   2.670  -9.949
  188    HD2  PHE  26           2HD      PHE  26   1.756   2.109  -5.990
  189    HE1  PHE  26           1HE      PHE  26   0.997   2.094 -10.850
  190    HE2  PHE  26           2HE      PHE  26  -0.462   1.532  -6.884
  191    HZ   PHE  26           HZ       PHE  26  -0.843   1.523  -9.317
  192    H    ASP  27           H        ASP  27   7.158   2.100  -7.638
  193    HA   ASP  27           HA       ASP  27   7.043   0.921 -10.236
  194   1HB   ASP  27          2HB       ASP  27   8.532   2.878  -9.362
  195   2HB   ASP  27          1HB       ASP  27   9.617   1.590  -8.845
  196    H    MET  28           H        MET  28   9.212   0.163  -7.506
  197    HA   MET  28           HA       MET  28  10.032  -2.325  -8.482
  198   1HB   MET  28          2HB       MET  28   9.969  -1.149  -5.711
  199   2HB   MET  28          1HB       MET  28  10.590  -2.767  -6.014
  200   1HG   MET  28          2HG       MET  28  12.543  -1.682  -6.209
  201   2HG   MET  28          1HG       MET  28  11.974  -1.401  -7.860
  202   1HE   MET  28          1HE       MET  28  14.012   0.666  -7.554
  203   2HE   MET  28          2HE       MET  28  14.109   0.163  -5.866
  204   3HE   MET  28          3HE       MET  28  13.848   1.861  -6.267
  205    H    PHE  29           H        PHE  29   7.177  -1.375  -6.747
  206    HA   PHE  29           HA       PHE  29   6.357  -3.795  -5.651
  207   1HB   PHE  29          2HB       PHE  29   5.014  -1.296  -6.521
  208   2HB   PHE  29          1HB       PHE  29   3.980  -2.715  -6.341
  209    HD1  PHE  29           1HD      PHE  29   5.212  -4.065  -4.044
  210    HD2  PHE  29           2HD      PHE  29   4.484   0.070  -4.738
  211    HE1  PHE  29           1HE      PHE  29   5.104  -3.677  -1.616
  212    HE2  PHE  29           2HE      PHE  29   4.377   0.463  -2.313
  213    HZ   PHE  29           HZ       PHE  29   4.688  -1.412  -0.749
  214    H    ASP  30           H        ASP  30   4.997  -2.422  -8.644
  215    HA   ASP  30           HA       ASP  30   3.834  -4.782  -9.549
  216   1HB   ASP  30          2HB       ASP  30   4.664  -2.237 -10.905
  217   2HB   ASP  30          1HB       ASP  30   4.045  -3.590 -11.857
  218    H    ALA  31           H        ALA  31   4.697  -6.595 -10.229
  219    HA   ALA  31           HA       ALA  31   7.495  -6.664 -11.054
  220   1HB   ALA  31          1HB       ALA  31   7.278  -9.099 -10.858
  221   2HB   ALA  31          2HB       ALA  31   5.563  -8.912 -10.494
  222   3HB   ALA  31          3HB       ALA  31   6.775  -8.278  -9.380
  223    H    ASP  32           H        ASP  32   4.314  -7.705 -12.243
  224    HA   ASP  32           HA       ASP  32   5.456  -8.127 -14.907
  225   1HB   ASP  32          2HB       ASP  32   3.268  -9.178 -15.431
  226   2HB   ASP  32          1HB       ASP  32   4.080  -9.945 -14.063
  227    H    GLY  33           H        GLY  33   3.295  -6.055 -13.125
  228   1HA   GLY  33          2HA       GLY  33   2.541  -3.941 -13.689
  229   2HA   GLY  33          1HA       GLY  33   3.331  -4.113 -15.249
  230    H    GLY  34           H        GLY  34   0.950  -6.335 -13.897
  231   1HA   GLY  34          2HA       GLY  34  -1.249  -5.238 -15.372
  232   2HA   GLY  34          1HA       GLY  34  -0.560  -6.651 -16.168
  233    H    GLY  35           H        GLY  35  -0.627  -6.286 -12.683
  234   1HA   GLY  35          2HA       GLY  35  -3.046  -7.816 -12.352
  235   2HA   GLY  35          1HA       GLY  35  -1.586  -8.757 -12.056
  236    H    ASP  36           H        ASP  36  -1.721  -5.349 -11.330
  237    HA   ASP  36           HA       ASP  36  -1.481  -4.204  -9.380
  238   1HB   ASP  36          2HB       ASP  36  -3.494  -6.314  -8.714
  239   2HB   ASP  36          1HB       ASP  36  -2.880  -5.278  -7.419
  240    H    ILE  37           H        ILE  37  -1.129  -4.723  -6.808
  241    HA   ILE  37           HA       ILE  37   1.390  -6.153  -6.777
  242    HB   ILE  37           HB       ILE  37  -0.005  -4.517  -4.657
  243   1HG1  ILE  37          2HG1      ILE  37   2.410  -3.957  -6.394
  244   2HG1  ILE  37          1HG1      ILE  37   0.816  -3.212  -6.555
  245   1HG2  ILE  37          1HG2      ILE  37   2.648  -4.716  -3.934
  246   2HG2  ILE  37          2HG2      ILE  37   2.243  -6.349  -4.462
  247   3HG2  ILE  37          3HG2      ILE  37   1.298  -5.573  -3.191
  248   1HD1  ILE  37          1HD1      ILE  37   1.070  -2.106  -4.444
  249   2HD1  ILE  37          2HD1      ILE  37   2.482  -1.772  -5.444
  250   3HD1  ILE  37          3HD1      ILE  37   2.586  -2.952  -4.138
  251    H    SER  38           H        SER  38   1.646  -8.167  -6.101
  252    HA   SER  38           HA       SER  38  -0.581  -9.517  -4.773
  253   1HB   SER  38          2HB       SER  38   0.318 -11.548  -5.538
  254   2HB   SER  38          1HB       SER  38   0.664 -10.425  -6.858
  255    HG   SER  38           HG       SER  38   2.768 -10.145  -5.765
  256    H    THR  39           H        THR  39   0.867 -11.580  -3.525
  257    HA   THR  39           HA       THR  39   1.518 -10.319  -1.058
  258    HB   THR  39           HB       THR  39   2.315 -12.740  -0.509
  259    HG1  THR  39           1HG      THR  39   2.484 -13.710  -2.424
  260   1HG2  THR  39          1HG2      THR  39   0.078 -11.681   0.080
  261   2HG2  THR  39          2HG2      THR  39   0.157 -13.442   0.015
  262   3HG2  THR  39          3HG2      THR  39  -0.558 -12.542  -1.322
  263    H    LYS  40           H        LYS  40   3.500 -12.240  -3.321
  264    HA   LYS  40           HA       LYS  40   5.945 -11.807  -2.024
  265   1HB   LYS  40          2HB       LYS  40   5.105 -13.290  -4.175
  266   2HB   LYS  40          1HB       LYS  40   6.119 -12.069  -4.943
  267   1HG   LYS  40          2HG       LYS  40   7.075 -13.648  -2.577
  268   2HG   LYS  40          1HG       LYS  40   7.216 -14.260  -4.232
  269   1HD   LYS  40          2HD       LYS  40   8.190 -11.508  -3.623
  270   2HD   LYS  40          1HD       LYS  40   9.168 -12.888  -3.120
  271   1HE   LYS  40          2HE       LYS  40   9.720 -13.440  -5.241
  272   2HE   LYS  40          1HE       LYS  40   8.144 -12.976  -5.883
  273   1HZ   LYS  40          1HZ       LYS  40   9.595 -11.417  -6.766
  274   2HZ   LYS  40          2HZ       LYS  40  10.486 -11.264  -5.336
  275   3HZ   LYS  40          3HZ       LYS  40   8.932 -10.601  -5.440
  276    H    GLU  41           H        GLU  41   4.215  -9.907  -4.412
  277    HA   GLU  41           HA       GLU  41   6.256  -8.194  -5.232
  278   1HB   GLU  41          2HB       GLU  41   3.281  -7.944  -5.054
  279   2HB   GLU  41          1HB       GLU  41   4.238  -6.527  -5.464
  280   1HG   GLU  41          2HG       GLU  41   5.284  -7.972  -7.283
  281   2HG   GLU  41          1HG       GLU  41   3.966  -9.101  -6.976
  282    H    LEU  42           H        LEU  42   4.409  -8.261  -2.279
  283    HA   LEU  42           HA       LEU  42   5.141  -5.614  -1.454
  284   1HB   LEU  42          2HB       LEU  42   3.297  -7.564  -0.624
  285   2HB   LEU  42          1HB       LEU  42   4.386  -7.327   0.738
  286    HG   LEU  42           HG       LEU  42   2.454  -5.874   0.941
  287   1HD1  LEU  42          1HD1      LEU  42   4.517  -5.018   1.831
  288   2HD1  LEU  42          2HD1      LEU  42   3.619  -3.693   1.092
  289   3HD1  LEU  42          3HD1      LEU  42   4.994  -4.406   0.247
  290   1HD2  LEU  42          1HD2      LEU  42   1.664  -5.548  -1.227
  291   2HD2  LEU  42          2HD2      LEU  42   3.239  -5.022  -1.824
  292   3HD2  LEU  42          3HD2      LEU  42   2.298  -3.966  -0.770
  293    H    GLY  43           H        GLY  43   5.993  -8.848  -0.194
  294   1HA   GLY  43          2HA       GLY  43   7.900  -8.148   1.645
  295   2HA   GLY  43          1HA       GLY  43   7.970  -9.630   0.694
  296    H    THR  44           H        THR  44   8.212  -8.075  -1.827
  297    HA   THR  44           HA       THR  44  10.981  -8.096  -2.098
  298    HB   THR  44           HB       THR  44   8.721  -6.973  -3.697
  299    HG1  THR  44           1HG      THR  44   9.541  -9.204  -3.758
  300   1HG2  THR  44          1HG2      THR  44  10.118  -5.258  -4.307
  301   2HG2  THR  44          2HG2      THR  44  10.543  -6.497  -5.489
  302   3HG2  THR  44          3HG2      THR  44  11.578  -6.225  -4.088
  303    H    VAL  45           H        VAL  45   9.146  -5.110  -2.555
  304    HA   VAL  45           HA       VAL  45  11.295  -3.415  -1.963
  305    HB   VAL  45           HB       VAL  45   9.420  -2.670  -3.299
  306   1HG1  VAL  45          1HG1      VAL  45   7.294  -2.032  -1.941
  307   2HG1  VAL  45          2HG1      VAL  45   7.870  -3.264  -0.818
  308   3HG1  VAL  45          3HG1      VAL  45   7.521  -3.691  -2.494
  309   1HG2  VAL  45          1HG2      VAL  45   9.700  -0.542  -2.684
  310   2HG2  VAL  45          2HG2      VAL  45  10.689  -1.176  -1.368
  311   3HG2  VAL  45          3HG2      VAL  45   8.984  -0.814  -1.096
  312    H    MET  46           H        MET  46   8.927  -4.918   0.110
  313    HA   MET  46           HA       MET  46   9.318  -3.154   2.322
  314   1HB   MET  46          2HB       MET  46   7.871  -5.705   1.847
  315   2HB   MET  46          1HB       MET  46   8.300  -5.328   3.516
  316   1HG   MET  46          2HG       MET  46   6.670  -3.607   1.655
  317   2HG   MET  46          1HG       MET  46   6.061  -4.566   3.008
  318   1HE   MET  46          1HE       MET  46   5.464  -1.420   4.916
  319   2HE   MET  46          2HE       MET  46   5.378  -3.159   5.207
  320   3HE   MET  46          3HE       MET  46   4.798  -2.488   3.681
  321    H    ARG  47           H        ARG  47  10.877  -6.063   1.189
  322    HA   ARG  47           HA       ARG  47  12.321  -6.422   3.685
  323   1HB   ARG  47          2HB       ARG  47  12.327  -7.928   1.075
  324   2HB   ARG  47          1HB       ARG  47  13.440  -8.298   2.384
  325   1HG   ARG  47          2HG       ARG  47  11.680  -8.947   3.824
  326   2HG   ARG  47          1HG       ARG  47  10.456  -8.289   2.735
  327   1HD   ARG  47          2HD       ARG  47  10.277 -10.431   2.061
  328   2HD   ARG  47          1HD       ARG  47  11.690 -10.024   1.080
  329    HE   ARG  47           HE       ARG  47  12.781 -10.867   3.404
  330   1HH1  ARG  47          1HH1      ARG  47  10.408 -12.254   1.254
  331   2HH1  ARG  47          2HH1      ARG  47  10.840 -13.889   1.630
  332   1HH2  ARG  47          1HH2      ARG  47  13.351 -13.016   3.899
  333   2HH2  ARG  47          2HH2      ARG  47  12.510 -14.321   3.132
  334    H    MET  48           H        MET  48  12.828  -4.998   0.549
  335    HA   MET  48           HA       MET  48  15.701  -4.783   1.004
  336   1HB   MET  48          2HB       MET  48  15.813  -3.868  -1.252
  337   2HB   MET  48          1HB       MET  48  14.923  -5.390  -1.240
  338   1HG   MET  48          2HG       MET  48  13.125  -4.430  -2.099
  339   2HG   MET  48          1HG       MET  48  13.138  -3.163  -0.876
  340   1HE   MET  48          1HE       MET  48  11.995  -1.871  -3.320
  341   2HE   MET  48          2HE       MET  48  13.083  -0.486  -3.447
  342   3HE   MET  48          3HE       MET  48  12.603  -1.090  -1.861
  343    H    LEU  49           H        LEU  49  13.285  -3.200   2.307
  344    HA   LEU  49           HA       LEU  49  14.571  -0.565   2.022
  345   1HB   LEU  49          2HB       LEU  49  11.681  -1.310   2.321
  346   2HB   LEU  49          1HB       LEU  49  12.250   0.273   2.815
  347    HG   LEU  49           HG       LEU  49  12.307  -0.901   0.039
  348   1HD1  LEU  49          1HD1      LEU  49  10.197  -0.052   0.286
  349   2HD1  LEU  49          2HD1      LEU  49  11.052   1.383  -0.274
  350   3HD1  LEU  49          3HD1      LEU  49  10.704   1.176   1.443
  351   1HD2  LEU  49          1HD2      LEU  49  13.105   1.621  -0.342
  352   2HD2  LEU  49          2HD2      LEU  49  14.230   0.280  -0.130
  353   3HD2  LEU  49          3HD2      LEU  49  13.839   1.326   1.234
  354    H    GLY  50           H        GLY  50  12.922  -2.788   4.236
  355   1HA   GLY  50          2HA       GLY  50  14.591  -2.518   6.378
  356   2HA   GLY  50          1HA       GLY  50  13.472  -1.168   6.550
  357    H    GLN  51           H        GLN  51  11.187  -2.565   5.472
  358    HA   GLN  51           HA       GLN  51  10.248  -3.770   7.860
  359   1HB   GLN  51          2HB       GLN  51   9.037  -2.637   5.719
  360   2HB   GLN  51          1HB       GLN  51   8.787  -4.344   5.352
  361   1HG   GLN  51          2HG       GLN  51   6.929  -4.015   6.578
  362   2HG   GLN  51          1HG       GLN  51   8.033  -4.351   7.911
  363   1HE2  GLN  51          1HE2      GLN  51   9.144  -2.391   8.811
  364   2HE2  GLN  51          2HE2      GLN  51   8.192  -0.961   8.992
  365    H    ASN  52           H        ASN  52   9.328  -5.964   8.011
  366    HA   ASN  52           HA       ASN  52  10.568  -7.948   6.266
  367   1HB   ASN  52          2HB       ASN  52  11.901  -7.346   8.499
  368   2HB   ASN  52          1HB       ASN  52  10.754  -8.499   9.184
  369   1HD2  ASN  52          1HD2      ASN  52  10.650 -10.622   8.176
  370   2HD2  ASN  52          2HD2      ASN  52  12.086 -11.298   7.498
  371    HA   PRO  53           HA       PRO  53   6.230  -8.915   7.902
  372   1HB   PRO  53          2HB       PRO  53   4.801  -8.454   5.663
  373   2HB   PRO  53          1HB       PRO  53   5.162  -7.175   6.828
  374   1HG   PRO  53          2HG       PRO  53   6.513  -7.805   4.231
  375   2HG   PRO  53          1HG       PRO  53   6.041  -6.228   4.891
  376   1HD   PRO  53          2HD       PRO  53   8.583  -7.194   5.021
  377   2HD   PRO  53          1HD       PRO  53   7.898  -6.100   6.243
  378    H    THR  54           H        THR  54   6.505 -11.087   8.009
  379    HA   THR  54           HA       THR  54   7.447 -12.769   6.004
  380    HB   THR  54           HB       THR  54   6.428 -14.608   7.314
  381    HG1  THR  54           1HG      THR  54   5.347 -12.535   8.916
  382   1HG2  THR  54          1HG2      THR  54   7.827 -12.476   8.898
  383   2HG2  THR  54          2HG2      THR  54   8.525 -13.909   8.146
  384   3HG2  THR  54          3HG2      THR  54   7.453 -14.078   9.537
  385    H    LYS  55           H        LYS  55   5.903 -14.764   5.354
  386    HA   LYS  55           HA       LYS  55   4.275 -13.837   3.293
  387   1HB   LYS  55          2HB       LYS  55   5.316 -16.140   3.548
  388   2HB   LYS  55          1HB       LYS  55   3.972 -16.529   4.622
  389   1HG   LYS  55          2HG       LYS  55   3.327 -17.366   2.545
  390   2HG   LYS  55          1HG       LYS  55   2.457 -15.837   2.689
  391   1HD   LYS  55          2HD       LYS  55   4.502 -14.842   1.445
  392   2HD   LYS  55          1HD       LYS  55   4.826 -16.515   0.986
  393   1HE   LYS  55          2HE       LYS  55   2.197 -16.353   0.406
  394   2HE   LYS  55          1HE       LYS  55   2.684 -14.683   0.116
  395   1HZ   LYS  55          1HZ       LYS  55   4.626 -15.980  -1.147
  396   2HZ   LYS  55          2HZ       LYS  55   3.188 -15.509  -1.902
  397   3HZ   LYS  55          3HZ       LYS  55   3.369 -17.097  -1.349
  398    H    CYS  56           H        CYS  56   3.278 -15.302   6.387
  399    HA   CYS  56           HA       CYS  56   0.521 -14.888   6.030
  400   1HB   CYS  56          2HB       CYS  56   2.298 -15.529   8.330
  401   2HB   CYS  56          1HB       CYS  56   0.682 -14.924   8.702
  402    HG   CYS  56           HG       CYS  56   0.487 -17.213   6.771
  403    H    GLU  57           H        GLU  57   3.072 -12.811   7.193
  404    HA   GLU  57           HA       GLU  57   1.557 -10.878   8.527
  405   1HB   GLU  57          2HB       GLU  57   4.230 -11.227   7.882
  406   2HB   GLU  57          1HB       GLU  57   3.788  -9.759   7.012
  407   1HG   GLU  57          2HG       GLU  57   3.164 -10.140   9.922
  408   2HG   GLU  57          1HG       GLU  57   4.708  -9.498   9.364
  409    H    LEU  58           H        LEU  58   2.689 -10.870   5.144
  410    HA   LEU  58           HA       LEU  58   1.127  -8.572   4.466
  411   1HB   LEU  58          2HB       LEU  58   2.294 -10.555   2.523
  412   2HB   LEU  58          1HB       LEU  58   1.936  -8.854   2.251
  413    HG   LEU  58           HG       LEU  58   3.978  -9.618   4.303
  414   1HD1  LEU  58          1HD1      LEU  58   4.555  -9.345   1.358
  415   2HD1  LEU  58          2HD1      LEU  58   4.528 -10.872   2.241
  416   3HD1  LEU  58          3HD1      LEU  58   5.721  -9.638   2.649
  417   1HD2  LEU  58          1HD2      LEU  58   4.921  -7.436   3.121
  418   2HD2  LEU  58          2HD2      LEU  58   3.716  -7.359   4.407
  419   3HD2  LEU  58          3HD2      LEU  58   3.216  -7.227   2.720
  420    H    ASP  59           H        ASP  59   0.715 -12.048   4.203
  421    HA   ASP  59           HA       ASP  59  -1.534 -12.028   2.493
  422   1HB   ASP  59          2HB       ASP  59  -0.195 -13.999   4.252
  423   2HB   ASP  59          1HB       ASP  59  -1.895 -14.313   3.890
  424    H    ALA  60           H        ALA  60  -1.162 -11.407   5.877
  425    HA   ALA  60           HA       ALA  60  -3.926 -11.849   6.517
  426   1HB   ALA  60          1HB       ALA  60  -1.951 -12.030   8.123
  427   2HB   ALA  60          2HB       ALA  60  -3.391 -11.198   8.710
  428   3HB   ALA  60          3HB       ALA  60  -1.989 -10.267   8.182
  429    H    ILE  61           H        ILE  61  -1.939  -9.150   5.531
  430    HA   ILE  61           HA       ILE  61  -3.970  -7.186   6.115
  431    HB   ILE  61           HB       ILE  61  -1.248  -7.075   4.856
  432   1HG1  ILE  61          2HG1      ILE  61  -1.391  -5.114   6.740
  433   2HG1  ILE  61          1HG1      ILE  61  -2.541  -6.284   7.390
  434   1HG2  ILE  61          1HG2      ILE  61  -2.501  -5.619   3.443
  435   2HG2  ILE  61          2HG2      ILE  61  -1.588  -4.616   4.570
  436   3HG2  ILE  61          3HG2      ILE  61  -3.312  -4.882   4.825
  437   1HD1  ILE  61          1HD1      ILE  61  -0.914  -7.913   7.660
  438   2HD1  ILE  61          2HD1      ILE  61  -0.087  -6.423   8.120
  439   3HD1  ILE  61          3HD1      ILE  61   0.195  -7.135   6.530
  440    H    ILE  62           H        ILE  62  -2.412  -8.372   3.121
  441    HA   ILE  62           HA       ILE  62  -3.924  -7.104   1.226
  442    HB   ILE  62           HB       ILE  62  -2.932  -9.955   1.154
  443   1HG1  ILE  62          2HG1      ILE  62  -1.775  -7.340   0.162
  444   2HG1  ILE  62          1HG1      ILE  62  -1.139  -8.358   1.458
  445   1HG2  ILE  62          1HG2      ILE  62  -3.909  -8.204  -1.100
  446   2HG2  ILE  62          2HG2      ILE  62  -4.678  -9.674  -0.502
  447   3HG2  ILE  62          3HG2      ILE  62  -3.106  -9.761  -1.296
  448   1HD1  ILE  62          1HD1      ILE  62  -0.413  -8.391  -1.218
  449   2HD1  ILE  62          2HD1      ILE  62  -1.390  -9.843  -0.996
  450   3HD1  ILE  62          3HD1      ILE  62   0.026  -9.568   0.019
  451    H    CYS  63           H        CYS  63  -4.736 -10.123   2.910
  452    HA   CYS  63           HA       CYS  63  -7.102 -10.741   1.598
  453   1HB   CYS  63          2HB       CYS  63  -5.755 -11.987   3.490
  454   2HB   CYS  63          1HB       CYS  63  -6.894 -11.160   4.557
  455    HG   CYS  63           HG       CYS  63  -8.115 -12.878   2.305
  456    H    GLU  64           H        GLU  64  -6.420  -8.220   3.859
  457    HA   GLU  64           HA       GLU  64  -9.254  -7.678   4.310
  458   1HB   GLU  64          2HB       GLU  64  -6.712  -6.872   5.618
  459   2HB   GLU  64          1HB       GLU  64  -8.031  -5.709   5.661
  460   1HG   GLU  64          2HG       GLU  64  -9.348  -7.038   6.983
  461   2HG   GLU  64          1HG       GLU  64  -8.573  -8.528   6.445
  462    H    VAL  65           H        VAL  65  -6.424  -6.343   2.701
  463    HA   VAL  65           HA       VAL  65  -7.604  -3.839   2.054
  464    HB   VAL  65           HB       VAL  65  -5.714  -3.337   0.836
  465   1HG1  VAL  65          1HG1      VAL  65  -3.792  -4.129   2.016
  466   2HG1  VAL  65          2HG1      VAL  65  -4.639  -5.590   2.517
  467   3HG1  VAL  65          3HG1      VAL  65  -5.129  -4.026   3.164
  468   1HG2  VAL  65          1HG2      VAL  65  -5.698  -4.786  -0.961
  469   2HG2  VAL  65          2HG2      VAL  65  -5.664  -6.223   0.062
  470   3HG2  VAL  65          3HG2      VAL  65  -4.218  -5.228  -0.107
  471    H    ASP  66           H        ASP  66  -7.607  -6.990   0.563
  472    HA   ASP  66           HA       ASP  66  -8.788  -6.040  -1.899
  473   1HB   ASP  66          2HB       ASP  66  -7.955  -8.714  -0.832
  474   2HB   ASP  66          1HB       ASP  66  -9.042  -8.631  -2.216
  475    H    GLU  67           H        GLU  67 -10.846  -5.421  -1.889
  476    HA   GLU  67           HA       GLU  67 -12.738  -6.464   0.016
  477   1HB   GLU  67          2HB       GLU  67 -14.317  -4.908  -0.997
  478   2HB   GLU  67          1HB       GLU  67 -12.786  -4.099  -0.662
  479   1HG   GLU  67          2HG       GLU  67 -12.917  -3.347  -2.748
  480   2HG   GLU  67          1HG       GLU  67 -12.440  -4.979  -3.232
  481    H    ASP  68           H        ASP  68 -11.872  -7.065  -3.291
  482    HA   ASP  68           HA       ASP  68 -14.267  -8.693  -3.712
  483   1HB   ASP  68          2HB       ASP  68 -13.554  -8.797  -6.058
  484   2HB   ASP  68          1HB       ASP  68 -13.657  -7.129  -5.499
  485    H    GLY  69           H        GLY  69 -11.713  -9.322  -2.050
  486   1HA   GLY  69          2HA       GLY  69 -10.369 -11.142  -1.634
  487   2HA   GLY  69          1HA       GLY  69 -11.737 -12.064  -2.238
  488    H    SER  70           H        SER  70  -9.207  -9.981  -3.655
  489    HA   SER  70           HA       SER  70  -8.817 -12.042  -5.721
  490   1HB   SER  70          2HB       SER  70  -7.585  -9.870  -6.768
  491   2HB   SER  70          1HB       SER  70  -9.294 -10.242  -7.031
  492    HG   SER  70           HG       SER  70  -9.116  -8.122  -6.337
  493    H    GLY  71           H        GLY  71  -7.298 -10.291  -3.160
  494   1HA   GLY  71          2HA       GLY  71  -5.269 -10.781  -2.133
  495   2HA   GLY  71          1HA       GLY  71  -4.915 -11.909  -3.441
  496    H    THR  72           H        THR  72  -5.833  -9.142  -4.942
  497    HA   THR  72           HA       THR  72  -3.047  -8.221  -5.149
  498    HB   THR  72           HB       THR  72  -3.414  -7.656  -7.386
  499    HG1  THR  72           1HG      THR  72  -6.195  -7.852  -6.872
  500   1HG2  THR  72          1HG2      THR  72  -5.352  -9.810  -7.653
  501   2HG2  THR  72          2HG2      THR  72  -3.949 -10.233  -6.671
  502   3HG2  THR  72          3HG2      THR  72  -3.727  -9.647  -8.320
  503    H    ILE  73           H        ILE  73  -2.702  -5.925  -5.475
  504    HA   ILE  73           HA       ILE  73  -4.734  -4.312  -4.079
  505    HB   ILE  73           HB       ILE  73  -1.753  -3.876  -4.234
  506   1HG1  ILE  73          2HG1      ILE  73  -3.444  -4.645  -1.844
  507   2HG1  ILE  73          1HG1      ILE  73  -2.520  -5.800  -2.810
  508   1HG2  ILE  73          1HG2      ILE  73  -2.149  -2.109  -2.557
  509   2HG2  ILE  73          2HG2      ILE  73  -3.886  -2.349  -2.747
  510   3HG2  ILE  73          3HG2      ILE  73  -2.922  -1.764  -4.104
  511   1HD1  ILE  73          1HD1      ILE  73  -0.535  -5.134  -1.949
  512   2HD1  ILE  73          2HD1      ILE  73  -1.576  -4.728  -0.585
  513   3HD1  ILE  73          3HD1      ILE  73  -1.066  -3.468  -1.710
  514    H    ASP  74           H        ASP  74  -5.754  -2.850  -5.265
  515    HA   ASP  74           HA       ASP  74  -4.853  -2.174  -7.912
  516   1HB   ASP  74          2HB       ASP  74  -7.315  -2.360  -6.789
  517   2HB   ASP  74          1HB       ASP  74  -7.062  -0.614  -6.716
  518    H    PHE  75           H        PHE  75  -5.532   0.441  -8.249
  519    HA   PHE  75           HA       PHE  75  -3.222   1.797  -7.404
  520   1HB   PHE  75          2HB       PHE  75  -5.831   2.900  -8.468
  521   2HB   PHE  75          1HB       PHE  75  -4.341   3.830  -8.298
  522    HD1  PHE  75           1HD      PHE  75  -6.249   1.673 -10.395
  523    HD2  PHE  75           2HD      PHE  75  -2.295   3.022  -9.588
  524    HE1  PHE  75           1HE      PHE  75  -5.545   0.938 -12.636
  525    HE2  PHE  75           2HE      PHE  75  -1.584   2.291 -11.826
  526    HZ   PHE  75           HZ       PHE  75  -3.210   1.248 -13.354
  527    H    GLU  76           H        GLU  76  -6.560   2.746  -6.583
  528    HA   GLU  76           HA       GLU  76  -5.756   4.268  -4.334
  529   1HB   GLU  76          2HB       GLU  76  -8.415   3.251  -5.302
  530   2HB   GLU  76          1HB       GLU  76  -8.269   4.122  -3.781
  531   1HG   GLU  76          2HG       GLU  76  -7.731   6.107  -4.810
  532   2HG   GLU  76          1HG       GLU  76  -7.140   5.313  -6.269
  533    H    GLU  77           H        GLU  77  -6.643   0.930  -4.769
  534    HA   GLU  77           HA       GLU  77  -7.386   0.208  -2.205
  535   1HB   GLU  77          2HB       GLU  77  -6.525  -1.141  -4.597
  536   2HB   GLU  77          1HB       GLU  77  -5.827  -1.921  -3.184
  537   1HG   GLU  77          2HG       GLU  77  -7.933  -2.385  -2.262
  538   2HG   GLU  77          1HG       GLU  77  -8.751  -1.269  -3.367
  539    H    PHE  78           H        PHE  78  -4.177   0.814  -3.496
  540    HA   PHE  78           HA       PHE  78  -2.680  -0.316  -1.393
  541   1HB   PHE  78          2HB       PHE  78  -1.857   0.533  -3.681
  542   2HB   PHE  78          1HB       PHE  78  -1.809   2.130  -2.927
  543    HD1  PHE  78           1HD      PHE  78  -0.383   2.430  -0.857
  544    HD2  PHE  78           2HD      PHE  78  -0.114  -0.982  -3.382
  545    HE1  PHE  78           1HE      PHE  78   1.840   1.926   0.069
  546    HE2  PHE  78           2HE      PHE  78   2.110  -1.494  -2.462
  547    HZ   PHE  78           HZ       PHE  78   3.089  -0.038  -0.733
  548    H    LEU  79           H        LEU  79  -4.695   2.427  -1.447
  549    HA   LEU  79           HA       LEU  79  -3.329   3.699   0.796
  550   1HB   LEU  79          2HB       LEU  79  -5.771   4.482  -0.802
  551   2HB   LEU  79          1HB       LEU  79  -5.183   5.387   0.579
  552    HG   LEU  79           HG       LEU  79  -2.966   5.109  -1.121
  553   1HD1  LEU  79          1HD1      LEU  79  -5.516   5.534  -2.619
  554   2HD1  LEU  79          2HD1      LEU  79  -4.109   4.562  -3.051
  555   3HD1  LEU  79          3HD1      LEU  79  -4.031   6.322  -3.151
  556   1HD2  LEU  79          1HD2      LEU  79  -2.819   7.321  -0.773
  557   2HD2  LEU  79          2HD2      LEU  79  -4.164   7.064   0.337
  558   3HD2  LEU  79          3HD2      LEU  79  -4.473   7.619  -1.308
  559    H    VAL  80           H        VAL  80  -6.367   2.094  -0.021
  560    HA   VAL  80           HA       VAL  80  -7.613   2.326   2.490
  561    HB   VAL  80           HB       VAL  80  -7.974   0.012   0.593
  562   1HG1  VAL  80          1HG1      VAL  80  -9.714   1.306   2.677
  563   2HG1  VAL  80          2HG1      VAL  80  -9.111  -0.351   2.641
  564   3HG1  VAL  80          3HG1      VAL  80 -10.327   0.171   1.476
  565   1HG2  VAL  80          1HG2      VAL  80  -8.235   1.824  -0.839
  566   2HG2  VAL  80          2HG2      VAL  80  -8.956   2.834   0.412
  567   3HG2  VAL  80          3HG2      VAL  80  -9.879   1.504  -0.288
  568    H    MET  81           H        MET  81  -5.435  -0.084   1.127
  569    HA   MET  81           HA       MET  81  -5.563  -2.109   2.958
  570   1HB   MET  81          2HB       MET  81  -2.994  -2.262   2.533
  571   2HB   MET  81          1HB       MET  81  -4.106  -2.522   1.204
  572   1HG   MET  81          2HG       MET  81  -3.440  -0.745   0.101
  573   2HG   MET  81          1HG       MET  81  -3.254   0.241   1.551
  574   1HE   MET  81          1HE       MET  81  -1.437  -0.392   3.316
  575   2HE   MET  81          2HE       MET  81   0.188  -0.939   2.902
  576   3HE   MET  81          3HE       MET  81  -1.123  -2.111   3.073
  577    H    MET  82           H        MET  82  -3.853   0.940   3.226
  578    HA   MET  82           HA       MET  82  -2.886   0.317   5.887
  579   1HB   MET  82          2HB       MET  82  -2.005   1.969   3.813
  580   2HB   MET  82          1HB       MET  82  -2.560   3.081   5.062
  581   1HG   MET  82          2HG       MET  82  -1.127   1.860   6.691
  582   2HG   MET  82          1HG       MET  82  -0.491   0.914   5.347
  583   1HE   MET  82          1HE       MET  82   1.013   3.427   3.053
  584   2HE   MET  82          2HE       MET  82   0.360   1.816   3.344
  585   3HE   MET  82          3HE       MET  82   1.982   2.223   3.901
  586    H    VAL  83           H        VAL  83  -5.397   2.215   4.340
  587    HA   VAL  83           HA       VAL  83  -6.131   3.842   6.511
  588    HB   VAL  83           HB       VAL  83  -7.909   2.743   4.325
  589   1HG1  VAL  83          1HG1      VAL  83  -8.311   5.181   6.050
  590   2HG1  VAL  83          2HG1      VAL  83  -9.140   3.639   6.273
  591   3HG1  VAL  83          3HG1      VAL  83  -9.398   4.575   4.799
  592   1HG2  VAL  83          1HG2      VAL  83  -7.212   5.492   3.984
  593   2HG2  VAL  83          2HG2      VAL  83  -6.906   4.127   2.910
  594   3HG2  VAL  83          3HG2      VAL  83  -5.739   4.539   4.169
  595    H    ARG  84           H        ARG  84  -6.940   0.531   5.681
  596    HA   ARG  84           HA       ARG  84  -9.014   0.240   7.619
  597   1HB   ARG  84          2HB       ARG  84  -7.364  -1.874   6.224
  598   2HB   ARG  84          1HB       ARG  84  -8.849  -2.160   7.122
  599   1HG   ARG  84          2HG       ARG  84  -9.698  -0.296   5.367
  600   2HG   ARG  84          1HG       ARG  84  -8.448  -1.101   4.410
  601   1HD   ARG  84          2HD       ARG  84  -9.674  -2.960   4.170
  602   2HD   ARG  84          1HD       ARG  84 -10.179  -2.952   5.859
  603    HE   ARG  84           HE       ARG  84 -11.633  -0.949   4.772
  604   1HH1  ARG  84          1HH1      ARG  84 -11.148  -4.290   3.893
  605   2HH1  ARG  84          2HH1      ARG  84 -12.719  -4.462   3.183
  606   1HH2  ARG  84          1HH2      ARG  84 -13.698  -1.172   3.838
  607   2HH2  ARG  84          2HH2      ARG  84 -14.165  -2.691   3.152
  608    H    GLN  85           H        GLN  85  -5.605   0.265   7.818
  609    HA   GLN  85           HA       GLN  85  -5.680  -1.110  10.420
  610   1HB   GLN  85          2HB       GLN  85  -3.168  -0.430   8.905
  611   2HB   GLN  85          1HB       GLN  85  -3.396  -1.637  10.170
  612   1HG   GLN  85          2HG       GLN  85  -4.368  -1.752   7.324
  613   2HG   GLN  85          1HG       GLN  85  -3.146  -2.774   8.093
  614   1HE2  GLN  85          1HE2      GLN  85  -5.160  -3.977   6.792
  615   2HE2  GLN  85          2HE2      GLN  85  -6.263  -4.706   7.905
  616    H    MET  86           H        MET  86  -5.180   1.909   8.855
  617    HA   MET  86           HA       MET  86  -3.707   3.144  10.988
  618   1HB   MET  86          2HB       MET  86  -4.907   4.019   8.406
  619   2HB   MET  86          1HB       MET  86  -4.579   5.255   9.622
  620   1HG   MET  86          2HG       MET  86  -2.224   4.246   9.722
  621   2HG   MET  86          1HG       MET  86  -2.655   3.446   8.206
  622   1HE   MET  86          1HE       MET  86  -1.077   5.571   5.978
  623   2HE   MET  86          2HE       MET  86  -2.782   5.264   5.639
  624   3HE   MET  86          3HE       MET  86  -1.811   4.042   6.457
  625    H    LYS  87           H        LYS  87  -7.023   3.538   9.732
  626    HA   LYS  87           HA       LYS  87  -7.862   5.169  11.906
  627   1HB   LYS  87          2HB       LYS  87  -9.283   3.729   9.686
  628   2HB   LYS  87          1HB       LYS  87 -10.198   4.501  10.981
  629   1HG   LYS  87          2HG       LYS  87 -10.147   6.167   9.412
  630   2HG   LYS  87          1HG       LYS  87  -8.727   6.576  10.386
  631   1HD   LYS  87          2HD       LYS  87  -8.260   4.716   8.144
  632   2HD   LYS  87          1HD       LYS  87  -8.701   6.364   7.693
  633   1HE   LYS  87          2HE       LYS  87  -6.676   6.126   9.817
  634   2HE   LYS  87          1HE       LYS  87  -6.175   5.554   8.227
  635   1HZ   LYS  87          1HZ       LYS  87  -6.575   7.656   7.285
  636   2HZ   LYS  87          2HZ       LYS  87  -5.740   7.964   8.724
  637   3HZ   LYS  87          3HZ       LYS  87  -7.411   8.213   8.647
  638    H    GLU  88           H        GLU  88  -7.955   1.725  11.244
  639    HA   GLU  88           HA       GLU  88  -9.414   1.251  13.742
  640   1HB   GLU  88          2HB       GLU  88  -9.726   0.099  11.300
  641   2HB   GLU  88          1HB       GLU  88  -8.638  -1.052  12.064
  642   1HG   GLU  88          2HG       GLU  88 -10.604  -1.957  12.714
  643   2HG   GLU  88          1HG       GLU  88 -10.390  -0.816  14.041
  644    H    ASP  89           H        ASP  89  -8.643  -0.728  14.998
  645    HA   ASP  89           HA       ASP  89  -5.714  -0.926  15.012
  646   1HB   ASP  89          2HB       ASP  89  -5.739  -0.792  17.502
  647   2HB   ASP  89          1HB       ASP  89  -6.229   0.712  16.716
  648    H    ALA  90           H        ALA  90  -4.877  -2.864  15.822
  649    HA   ALA  90           HA       ALA  90  -6.838  -5.048  15.942
  650   1HB   ALA  90          1HB       ALA  90  -3.871  -5.290  15.489
  651   2HB   ALA  90          2HB       ALA  90  -5.046  -5.099  14.189
  652   3HB   ALA  90          3HB       ALA  90  -5.107  -6.522  15.230
  653   2H    ARG 115          HN2       ARG 115  -1.247  -3.063   7.575
  654    H    ARG 115           H        ARG 115  -0.843  -1.964   6.319
  655   3H    ARG 115          HN3       ARG 115  -0.276  -3.581   6.259
  656    HA   ARG 115           HA       ARG 115   0.753  -2.973   8.525
  657   1HB   ARG 115          2HB       ARG 115   2.763  -2.104   7.146
  658   2HB   ARG 115          1HB       ARG 115   2.155  -3.719   6.815
  659   1HG   ARG 115          2HG       ARG 115   0.703  -2.340   5.036
  660   2HG   ARG 115          1HG       ARG 115   2.123  -1.297   5.132
  661   1HD   ARG 115          2HD       ARG 115   2.788  -2.735   3.480
  662   2HD   ARG 115          1HD       ARG 115   3.407  -3.578   4.899
  663    HE   ARG 115           HE       ARG 115   1.820  -5.227   4.597
  664   1HH1  ARG 115          1HH1      ARG 115   1.209  -2.579   2.403
  665   2HH1  ARG 115          2HH1      ARG 115   0.062  -3.467   1.459
  666   1HH2  ARG 115          1HH2      ARG 115   0.310  -6.390   3.356
  667   2HH2  ARG 115          2HH2      ARG 115  -0.450  -5.627   1.998
  668    H    MET 116           H        MET 116  -0.326  -1.339   9.698
  669    HA   MET 116           HA       MET 116  -0.610   1.326   8.899
  670   1HB   MET 116          2HB       MET 116  -1.736   0.251  10.860
  671   2HB   MET 116          1HB       MET 116  -0.208   0.338  11.727
  672   1HG   MET 116          2HG       MET 116  -1.052   2.888  10.585
  673   2HG   MET 116          1HG       MET 116  -2.179   2.227  11.769
  674   1HE   MET 116          1HE       MET 116   0.180   5.043  12.047
  675   2HE   MET 116          2HE       MET 116  -0.287   4.946  13.745
  676   3HE   MET 116          3HE       MET 116  -1.493   4.692  12.483
  677    H    SER 117           H        SER 117   0.560   3.218   9.568
  678    HA   SER 117           HA       SER 117   2.452   4.474   9.685
  679   1HB   SER 117          2HB       SER 117   3.927   4.037  11.464
  680   2HB   SER 117          1HB       SER 117   2.408   3.310  11.987
  681    HG   SER 117           HG       SER 117   4.787   2.090  11.169
  682    H    ALA 118           H        ALA 118   2.169   2.421   7.589
  683    HA   ALA 118           HA       ALA 118   4.789   1.371   7.070
  684   1HB   ALA 118          1HB       ALA 118   3.322  -0.002   6.042
  685   2HB   ALA 118          2HB       ALA 118   3.539   1.124   4.702
  686   3HB   ALA 118          3HB       ALA 118   2.144   1.283   5.770
  687    H    ASP 119           H        ASP 119   3.637   4.448   6.938
  688    HA   ASP 119           HA       ASP 119   4.258   5.563   4.536
  689   1HB   ASP 119          2HB       ASP 119   3.362   6.825   6.438
  690   2HB   ASP 119          1HB       ASP 119   4.918   6.710   7.254
  691    H    ALA 120           H        ALA 120   6.482   4.257   6.881
  692    HA   ALA 120           HA       ALA 120   8.858   5.481   6.149
  693   1HB   ALA 120          1HB       ALA 120   8.767   2.555   6.790
  694   2HB   ALA 120          2HB       ALA 120   8.378   3.762   8.016
  695   3HB   ALA 120          3HB       ALA 120   9.968   3.760   7.254
  696    H    MET 121           H        MET 121   7.806   2.264   4.994
  697    HA   MET 121           HA       MET 121   9.670   2.069   2.923
  698   1HB   MET 121          2HB       MET 121   8.436   0.122   3.650
  699   2HB   MET 121          1HB       MET 121   6.910   0.861   3.186
  700   1HG   MET 121          2HG       MET 121   8.309   0.911   0.836
  701   2HG   MET 121          1HG       MET 121   8.865  -0.589   1.578
  702   1HE   MET 121          1HE       MET 121   4.939   0.715   2.110
  703   2HE   MET 121          2HE       MET 121   4.629   0.564   0.379
  704   3HE   MET 121          3HE       MET 121   5.922   1.617   0.956
  705    H    LEU 122           H        LEU 122   6.541   3.613   3.096
  706    HA   LEU 122           HA       LEU 122   6.170   4.092   0.343
  707   1HB   LEU 122          2HB       LEU 122   5.111   5.339   2.855
  708   2HB   LEU 122          1HB       LEU 122   4.769   6.077   1.304
  709    HG   LEU 122           HG       LEU 122   3.829   3.808   0.600
  710   1HD1  LEU 122          1HD1      LEU 122   4.908   2.648   2.593
  711   2HD1  LEU 122          2HD1      LEU 122   3.231   2.234   2.234
  712   3HD1  LEU 122          3HD1      LEU 122   3.604   3.341   3.556
  713   1HD2  LEU 122          1HD2      LEU 122   1.712   4.441   1.252
  714   2HD2  LEU 122          2HD2      LEU 122   2.600   5.955   1.430
  715   3HD2  LEU 122          3HD2      LEU 122   2.245   4.970   2.850
  716    H    ARG 123           H        ARG 123   7.822   5.875   2.902
  717    HA   ARG 123           HA       ARG 123   8.539   8.016   1.062
  718   1HB   ARG 123          2HB       ARG 123   7.876   8.409   3.477
  719   2HB   ARG 123          1HB       ARG 123   9.415   7.690   3.930
  720   1HG   ARG 123          2HG       ARG 123  10.268   9.535   2.170
  721   2HG   ARG 123          1HG       ARG 123   8.822  10.337   2.786
  722   1HD   ARG 123          2HD       ARG 123   9.670   9.900   5.099
  723   2HD   ARG 123          1HD       ARG 123  11.170   9.317   4.377
  724    HE   ARG 123           HE       ARG 123  10.541  11.906   3.417
  725   1HH1  ARG 123          1HH1      ARG 123  11.754  10.246   6.238
  726   2HH1  ARG 123          2HH1      ARG 123  12.668  11.605   6.800
  727   1HH2  ARG 123          1HH2      ARG 123  11.743  13.696   4.156
  728   2HH2  ARG 123          2HH2      ARG 123  12.661  13.564   5.618
  729    H    ALA 124           H        ALA 124   9.720   5.001   1.822
  730    HA   ALA 124           HA       ALA 124  12.469   5.332   2.080
  731   1HB   ALA 124          1HB       ALA 124  11.473   3.194   2.466
  732   2HB   ALA 124          2HB       ALA 124  12.620   3.027   1.136
  733   3HB   ALA 124          3HB       ALA 124  10.890   3.107   0.803
  734    H    LEU 125           H        LEU 125  11.110   4.018  -0.907
  735    HA   LEU 125           HA       LEU 125  13.279   4.965  -2.473
  736   1HB   LEU 125          2HB       LEU 125  10.622   3.980  -3.488
  737   2HB   LEU 125          1HB       LEU 125  12.165   3.955  -4.323
  738    HG   LEU 125           HG       LEU 125  11.877   2.441  -1.765
  739   1HD1  LEU 125          1HD1      LEU 125  11.355   0.508  -3.531
  740   2HD1  LEU 125          2HD1      LEU 125  10.518   1.848  -4.315
  741   3HD1  LEU 125          3HD1      LEU 125  10.099   1.392  -2.664
  742   1HD2  LEU 125          1HD2      LEU 125  13.987   2.851  -3.335
  743   2HD2  LEU 125          2HD2      LEU 125  13.312   1.440  -4.151
  744   3HD2  LEU 125          3HD2      LEU 125  13.742   1.349  -2.443
  745    H    LEU 126           H        LEU 126  10.164   6.256  -1.650
  746    HA   LEU 126           HA       LEU 126   9.073   8.174  -2.202
  747   1HB   LEU 126          2HB       LEU 126  11.939   8.820  -2.211
  748   2HB   LEU 126          1HB       LEU 126  10.946   9.950  -3.113
  749    HG   LEU 126           HG       LEU 126  10.517   9.198  -0.220
  750   1HD1  LEU 126          1HD1      LEU 126  12.558  10.683  -1.076
  751   2HD1  LEU 126          2HD1      LEU 126  11.694  11.023   0.422
  752   3HD1  LEU 126          3HD1      LEU 126  11.308  11.928  -1.041
  753   1HD2  LEU 126          1HD2      LEU 126   8.991  11.173  -0.272
  754   2HD2  LEU 126          2HD2      LEU 126   8.434   9.797  -1.225
  755   3HD2  LEU 126          3HD2      LEU 126   9.160  11.189  -2.028
  756    H    GLY 127           H        GLY 127   8.879   9.925  -4.040
  757   1HA   GLY 127          2HA       GLY 127   9.512  10.085  -6.515
  758   2HA   GLY 127          1HA       GLY 127   8.945   8.423  -6.577
  759    H    SER 128           H        SER 128   7.681   9.801  -8.302
  760    HA   SER 128           HA       SER 128   4.988   9.819  -7.493
  761   1HB   SER 128          2HB       SER 128   6.430  12.411  -7.371
  762   2HB   SER 128          1HB       SER 128   4.837  12.432  -8.126
  763    HG   SER 128           HG       SER 128   5.534  12.091  -5.491
  764    H    LYS 129           H        LYS 129   3.701  11.270  -9.288
  765    HA   LYS 129           HA       LYS 129   4.945  10.668 -11.887
  766   1HB   LYS 129          2HB       LYS 129   2.047  10.200 -11.162
  767   2HB   LYS 129          1HB       LYS 129   2.781   9.906 -12.732
  768   1HG   LYS 129          2HG       LYS 129   4.205   8.184 -11.754
  769   2HG   LYS 129          1HG       LYS 129   3.482   8.485 -10.172
  770   1HD   LYS 129          2HD       LYS 129   2.093   6.811 -10.755
  771   2HD   LYS 129          1HD       LYS 129   1.266   8.069 -11.677
  772   1HE   LYS 129          2HE       LYS 129   3.119   7.358 -13.474
  773   2HE   LYS 129          1HE       LYS 129   2.965   5.831 -12.606
  774   1HZ   LYS 129          1HZ       LYS 129   0.918   7.296 -14.143
  775   2HZ   LYS 129          2HZ       LYS 129   0.461   6.193 -12.945
  776   3HZ   LYS 129          3HZ       LYS 129   1.382   5.672 -14.265
  777    H    HIS 130           H        HIS 130   3.913  11.842 -13.710
  778    HA   HIS 130           HA       HIS 130   2.891  14.467 -12.841
  779   1HB   HIS 130          2HB       HIS 130   4.847  13.818 -15.050
  780   2HB   HIS 130          1HB       HIS 130   4.054  15.381 -14.890
  781    HD1  HIS 130           1HD      HIS 130   5.030  17.010 -13.233
  782    HD2  HIS 130           2HD      HIS 130   6.679  13.209 -12.921
  783    HE1  HIS 130           1HE      HIS 130   6.978  17.249 -11.659
  784    HE2  HIS 130           2HE      HIS 130   7.900  14.918 -11.411
  785    H    LYS 131           H        LYS 131   0.771  14.375 -13.291
  786    HA   LYS 131           HA       LYS 131  -0.345  12.919 -15.454
  787   1HB   LYS 131          2HB       LYS 131  -1.371  13.919 -13.183
  788   2HB   LYS 131          1HB       LYS 131  -1.869  15.188 -14.294
  789   1HG   LYS 131          2HG       LYS 131  -3.661  13.900 -14.632
  790   2HG   LYS 131          1HG       LYS 131  -2.591  12.955 -15.669
  791   1HD   LYS 131          2HD       LYS 131  -3.556  11.357 -14.269
  792   2HD   LYS 131          1HD       LYS 131  -1.988  11.673 -13.521
  793   1HE   LYS 131          2HE       LYS 131  -2.947  12.984 -11.821
  794   2HE   LYS 131          1HE       LYS 131  -4.474  13.137 -12.687
  795   1HZ   LYS 131          1HZ       LYS 131  -4.637  10.632 -12.410
  796   2HZ   LYS 131          2HZ       LYS 131  -4.879  11.574 -11.026
  797   3HZ   LYS 131          3HZ       LYS 131  -3.404  10.781 -11.261
  Start of MODEL   17
    1   2H    ALA   1          HN2       ALA   1 -19.743  -0.071 -13.526
    2    H    ALA   1           H        ALA   1 -18.238   0.752 -13.467
    3   3H    ALA   1          HN3       ALA   1 -18.578  -0.319 -14.761
    4    HA   ALA   1           HA       ALA   1 -18.829  -2.078 -13.020
    5   1HB   ALA   1          1HB       ALA   1 -16.953  -1.807 -14.660
    6   2HB   ALA   1          2HB       ALA   1 -16.517  -2.619 -13.156
    7   3HB   ALA   1          3HB       ALA   1 -16.073  -0.931 -13.407
    8    H    SER   2           H        SER   2 -19.547   0.336 -11.578
    9    HA   SER   2           HA       SER   2 -17.757   0.882  -9.476
   10   1HB   SER   2          2HB       SER   2 -20.753   1.058  -9.201
   11   2HB   SER   2          1HB       SER   2 -19.520   2.084  -8.469
   12    HG   SER   2           HG       SER   2 -19.017   2.694 -10.726
   13    H    MET   3           H        MET   3 -18.320   0.428  -7.127
   14    HA   MET   3           HA       MET   3 -19.775  -1.871  -6.398
   15   1HB   MET   3          2HB       MET   3 -17.092  -2.336  -7.395
   16   2HB   MET   3          1HB       MET   3 -17.249  -2.870  -5.728
   17   1HG   MET   3          2HG       MET   3 -18.882  -4.432  -6.249
   18   2HG   MET   3          1HG       MET   3 -19.280  -3.650  -7.777
   19   1HE   MET   3          1HE       MET   3 -17.565  -3.161  -9.424
   20   2HE   MET   3          2HE       MET   3 -17.308  -4.659 -10.319
   21   3HE   MET   3          3HE       MET   3 -15.953  -3.873  -9.508
   22    H    THR   4           H        THR   4 -16.975   0.160  -5.676
   23    HA   THR   4           HA       THR   4 -18.059   0.939  -3.158
   24    HB   THR   4           HB       THR   4 -17.198  -1.260  -2.506
   25    HG1  THR   4           1HG      THR   4 -16.953   0.015  -0.818
   26   1HG2  THR   4          1HG2      THR   4 -14.455  -0.273  -3.231
   27   2HG2  THR   4          2HG2      THR   4 -15.388  -1.404  -4.211
   28   3HG2  THR   4          3HG2      THR   4 -14.900  -1.849  -2.576
   29    H    ASP   5           H        ASP   5 -17.476   2.982  -2.904
   30    HA   ASP   5           HA       ASP   5 -15.307   4.084  -4.461
   31   1HB   ASP   5          2HB       ASP   5 -17.212   5.409  -2.517
   32   2HB   ASP   5          1HB       ASP   5 -16.077   6.255  -3.572
   33    H    GLN   6           H        GLN   6 -15.291   2.460  -1.643
   34    HA   GLN   6           HA       GLN   6 -13.983   3.959   0.251
   35   1HB   GLN   6          2HB       GLN   6 -13.073   1.876   1.110
   36   2HB   GLN   6          1HB       GLN   6 -14.738   1.645   0.596
   37   1HG   GLN   6          2HG       GLN   6 -14.007   0.571  -1.435
   38   2HG   GLN   6          1HG       GLN   6 -12.322   0.898  -1.035
   39   1HE2  GLN   6          1HE2      GLN   6 -15.059  -1.111  -0.472
   40   2HE2  GLN   6          2HE2      GLN   6 -14.274  -2.274   0.536
   41    H    GLN   7           H        GLN   7 -12.721   2.756  -2.765
   42    HA   GLN   7           HA       GLN   7  -9.962   3.051  -2.087
   43   1HB   GLN   7          2HB       GLN   7 -10.814   3.255  -4.926
   44   2HB   GLN   7          1HB       GLN   7  -9.472   2.367  -4.219
   45   1HG   GLN   7          2HG       GLN   7 -10.679   0.542  -4.550
   46   2HG   GLN   7          1HG       GLN   7 -11.674   1.074  -3.196
   47   1HE2  GLN   7          1HE2      GLN   7 -12.772  -0.528  -5.064
   48   2HE2  GLN   7          2HE2      GLN   7 -13.899   0.351  -6.034
   49    H    ALA   8           H        ALA   8 -12.408   5.267  -2.808
   50    HA   ALA   8           HA       ALA   8 -10.602   7.270  -3.884
   51   1HB   ALA   8          1HB       ALA   8 -12.435   8.395  -4.601
   52   2HB   ALA   8          2HB       ALA   8 -13.374   8.007  -3.160
   53   3HB   ALA   8          3HB       ALA   8 -13.178   6.804  -4.434
   54    H    GLU   9           H        GLU   9 -12.696   6.846  -1.034
   55    HA   GLU   9           HA       GLU   9 -12.039   9.218   0.279
   56   1HB   GLU   9          2HB       GLU   9 -12.609   6.590   1.653
   57   2HB   GLU   9          1HB       GLU   9 -12.901   8.209   2.274
   58   1HG   GLU   9          2HG       GLU   9 -14.363   8.212  -0.032
   59   2HG   GLU   9          1HG       GLU   9 -14.533   6.542   0.521
   60    H    ALA  10           H        ALA  10 -10.471   6.066   0.281
   61    HA   ALA  10           HA       ALA  10  -8.626   6.239   2.265
   62   1HB   ALA  10          1HB       ALA  10  -7.133   5.135   0.274
   63   2HB   ALA  10          2HB       ALA  10  -8.772   4.918  -0.346
   64   3HB   ALA  10          3HB       ALA  10  -8.331   4.267   1.235
   65    H    ARG  11           H        ARG  11  -8.143   7.449  -1.055
   66    HA   ARG  11           HA       ARG  11  -5.629   8.571  -0.712
   67   1HB   ARG  11          2HB       ARG  11  -7.247   8.330  -2.817
   68   2HB   ARG  11          1HB       ARG  11  -7.594  10.010  -2.429
   69   1HG   ARG  11          2HG       ARG  11  -5.600  10.727  -3.158
   70   2HG   ARG  11          1HG       ARG  11  -4.741   9.334  -2.498
   71   1HD   ARG  11          2HD       ARG  11  -4.987   8.108  -4.399
   72   2HD   ARG  11          1HD       ARG  11  -6.528   8.857  -4.813
   73    HE   ARG  11           HE       ARG  11  -4.306  10.655  -5.036
   74   1HH1  ARG  11          1HH1      ARG  11  -6.120   8.163  -6.675
   75   2HH1  ARG  11          2HH1      ARG  11  -5.671   8.703  -8.257
   76   1HH2  ARG  11          1HH2      ARG  11  -3.713  11.366  -7.118
   77   2HH2  ARG  11          2HH2      ARG  11  -4.303  10.520  -8.509
   78    H    ALA  12           H        ALA  12  -8.736   9.702   0.331
   79    HA   ALA  12           HA       ALA  12  -7.675  12.334   1.030
   80   1HB   ALA  12          1HB       ALA  12  -9.846  12.287  -0.057
   81   2HB   ALA  12          2HB       ALA  12 -10.000  12.890   1.594
   82   3HB   ALA  12          3HB       ALA  12 -10.479  11.236   1.211
   83    H    PHE  13           H        PHE  13  -8.351   9.274   2.444
   84    HA   PHE  13           HA       PHE  13  -8.806  10.144   5.113
   85   1HB   PHE  13          2HB       PHE  13  -8.300   7.564   3.745
   86   2HB   PHE  13          1HB       PHE  13  -7.883   7.633   5.460
   87    HD1  PHE  13           1HD      PHE  13  -9.510   6.445   6.585
   88    HD2  PHE  13           2HD      PHE  13 -10.676   9.218   3.573
   89    HE1  PHE  13           1HE      PHE  13 -11.871   6.084   7.173
   90    HE2  PHE  13           2HE      PHE  13 -13.040   8.862   4.158
   91    HZ   PHE  13           HZ       PHE  13 -13.639   7.294   5.959
   92    H    LEU  14           H        LEU  14  -6.020  10.122   3.200
   93    HA   LEU  14           HA       LEU  14  -4.337  10.351   5.604
   94   1HB   LEU  14          2HB       LEU  14  -3.385   9.287   2.949
   95   2HB   LEU  14          1HB       LEU  14  -2.513   9.296   4.477
   96    HG   LEU  14           HG       LEU  14  -5.076   7.765   4.237
   97   1HD1  LEU  14          1HD1      LEU  14  -2.357   6.785   3.380
   98   2HD1  LEU  14          2HD1      LEU  14  -3.747   7.054   2.329
   99   3HD1  LEU  14          3HD1      LEU  14  -3.801   5.790   3.558
  100   1HD2  LEU  14          1HD2      LEU  14  -4.078   8.074   6.441
  101   2HD2  LEU  14          2HD2      LEU  14  -2.562   7.386   5.861
  102   3HD2  LEU  14          3HD2      LEU  14  -4.010   6.383   5.947
  103    H    SER  15           H        SER  15  -2.356  11.645   5.253
  104    HA   SER  15           HA       SER  15  -3.012  14.127   3.995
  105   1HB   SER  15          2HB       SER  15  -0.198  13.665   4.804
  106   2HB   SER  15          1HB       SER  15  -1.294  14.993   5.215
  107    HG   SER  15           HG       SER  15  -1.386  14.010   7.074
  108    H    GLU  16           H        GLU  16  -1.803  15.181   2.316
  109    HA   GLU  16           HA       GLU  16  -1.391  13.716   0.015
  110   1HB   GLU  16          2HB       GLU  16  -0.514  16.407   0.945
  111   2HB   GLU  16          1HB       GLU  16   0.258  15.754  -0.495
  112   1HG   GLU  16          2HG       GLU  16  -1.548  16.088  -1.761
  113   2HG   GLU  16          1HG       GLU  16  -2.650  15.516  -0.510
  114    H    GLU  17           H        GLU  17   0.719  14.241   2.707
  115    HA   GLU  17           HA       GLU  17   3.188  13.554   1.561
  116   1HB   GLU  17          2HB       GLU  17   3.145  14.608   3.706
  117   2HB   GLU  17          1HB       GLU  17   2.107  13.355   4.375
  118   1HG   GLU  17          2HG       GLU  17   3.832  12.004   4.837
  119   2HG   GLU  17          1HG       GLU  17   4.664  12.379   3.329
  120    H    MET  18           H        MET  18   0.775  11.584   3.273
  121    HA   MET  18           HA       MET  18   2.164   9.138   3.031
  122   1HB   MET  18          2HB       MET  18   0.001   9.940   4.434
  123   2HB   MET  18          1HB       MET  18  -0.794   9.057   3.132
  124   1HG   MET  18          2HG       MET  18  -0.527   7.411   4.694
  125   2HG   MET  18          1HG       MET  18   0.930   7.196   3.724
  126   1HE   MET  18          1HE       MET  18   1.481   6.633   7.775
  127   2HE   MET  18          2HE       MET  18   1.362   5.728   6.266
  128   3HE   MET  18          3HE       MET  18  -0.061   6.537   6.924
  129    H    ILE  19           H        ILE  19   0.442  10.983   0.737
  130    HA   ILE  19           HA       ILE  19  -0.294   8.740  -0.940
  131    HB   ILE  19           HB       ILE  19  -0.494  11.726  -1.299
  132   1HG1  ILE  19          2HG1      ILE  19  -2.601   9.558  -1.149
  133   2HG1  ILE  19          1HG1      ILE  19  -2.123  10.600   0.194
  134   1HG2  ILE  19          1HG2      ILE  19  -0.709   9.575  -3.320
  135   2HG2  ILE  19          2HG2      ILE  19  -0.232  11.264  -3.503
  136   3HG2  ILE  19          3HG2      ILE  19  -1.940  10.840  -3.361
  137   1HD1  ILE  19          1HD1      ILE  19  -2.972  11.949  -2.290
  138   2HD1  ILE  19          2HD1      ILE  19  -3.267  12.372  -0.604
  139   3HD1  ILE  19          3HD1      ILE  19  -4.217  11.102  -1.374
  140    H    ALA  20           H        ALA  20   1.729  11.630  -1.483
  141    HA   ALA  20           HA       ALA  20   2.996  10.804  -3.787
  142   1HB   ALA  20          1HB       ALA  20   4.098  12.519  -1.566
  143   2HB   ALA  20          2HB       ALA  20   3.165  13.066  -2.960
  144   3HB   ALA  20          3HB       ALA  20   4.782  12.396  -3.188
  145    H    GLU  21           H        GLU  21   3.507   9.729  -0.541
  146    HA   GLU  21           HA       GLU  21   6.065   8.500  -1.132
  147   1HB   GLU  21          2HB       GLU  21   4.345   8.333   1.351
  148   2HB   GLU  21          1HB       GLU  21   5.993   7.742   1.199
  149   1HG   GLU  21          2HG       GLU  21   6.887   9.891   1.106
  150   2HG   GLU  21          1HG       GLU  21   5.328  10.619   0.720
  151    H    PHE  22           H        PHE  22   2.690   7.631  -0.784
  152    HA   PHE  22           HA       PHE  22   2.988   4.836  -0.644
  153   1HB   PHE  22          2HB       PHE  22   0.840   6.685  -0.823
  154   2HB   PHE  22          1HB       PHE  22   0.617   5.510  -2.114
  155    HD1  PHE  22           1HD      PHE  22   1.790   3.107  -0.784
  156    HD2  PHE  22           2HD      PHE  22  -0.864   6.101   0.665
  157    HE1  PHE  22           1HE      PHE  22   0.869   1.500   0.836
  158    HE2  PHE  22           2HE      PHE  22  -1.789   4.500   2.287
  159    HZ   PHE  22           HZ       PHE  22  -0.921   2.196   2.375
  160    H    LYS  23           H        LYS  23   3.000   7.102  -3.298
  161    HA   LYS  23           HA       LYS  23   2.860   5.119  -5.359
  162   1HB   LYS  23          2HB       LYS  23   2.275   7.668  -5.444
  163   2HB   LYS  23          1HB       LYS  23   3.996   7.863  -5.780
  164   1HG   LYS  23          2HG       LYS  23   3.034   7.781  -7.887
  165   2HG   LYS  23          1HG       LYS  23   3.618   6.134  -7.642
  166   1HD   LYS  23          2HD       LYS  23   1.561   5.386  -8.037
  167   2HD   LYS  23          1HD       LYS  23   1.007   6.225  -6.582
  168   1HE   LYS  23          2HE       LYS  23  -0.328   7.341  -8.002
  169   2HE   LYS  23          1HE       LYS  23   1.125   8.270  -8.369
  170   1HZ   LYS  23          1HZ       LYS  23  -0.241   6.248  -9.965
  171   2HZ   LYS  23          2HZ       LYS  23   1.448   6.269 -10.053
  172   3HZ   LYS  23          3HZ       LYS  23   0.564   7.654 -10.456
  173    H    ALA  24           H        ALA  24   5.278   6.154  -3.245
  174    HA   ALA  24           HA       ALA  24   7.634   6.254  -4.583
  175   1HB   ALA  24          1HB       ALA  24   7.060   4.819  -1.996
  176   2HB   ALA  24          2HB       ALA  24   7.549   6.501  -2.202
  177   3HB   ALA  24          3HB       ALA  24   8.677   5.202  -2.587
  178    H    ALA  25           H        ALA  25   6.839   3.166  -3.033
  179    HA   ALA  25           HA       ALA  25   8.459   1.708  -4.864
  180   1HB   ALA  25          1HB       ALA  25   6.478   0.579  -2.901
  181   2HB   ALA  25          2HB       ALA  25   8.100   1.118  -2.464
  182   3HB   ALA  25          3HB       ALA  25   7.890  -0.222  -3.591
  183    H    PHE  26           H        PHE  26   5.360   2.901  -5.225
  184    HA   PHE  26           HA       PHE  26   3.809   0.929  -6.300
  185   1HB   PHE  26          2HB       PHE  26   3.369   3.470  -6.058
  186   2HB   PHE  26          1HB       PHE  26   4.007   3.583  -7.693
  187    HD1  PHE  26           1HD      PHE  26   1.318   2.155  -5.618
  188    HD2  PHE  26           2HD      PHE  26   2.719   2.912  -9.564
  189    HE1  PHE  26           1HE      PHE  26  -0.896   1.565  -6.513
  190    HE2  PHE  26           2HE      PHE  26   0.507   2.324 -10.466
  191    HZ   PHE  26           HZ       PHE  26  -1.305   1.649  -8.939
  192    H    ASP  27           H        ASP  27   6.666   2.350  -7.702
  193    HA   ASP  27           HA       ASP  27   6.203   1.246 -10.326
  194   1HB   ASP  27          2HB       ASP  27   8.299   2.903  -9.032
  195   2HB   ASP  27          1HB       ASP  27   8.810   1.914 -10.397
  196    H    MET  28           H        MET  28   8.752   0.710  -7.883
  197    HA   MET  28           HA       MET  28   9.804  -1.601  -9.052
  198   1HB   MET  28          2HB       MET  28  10.067  -0.186  -6.514
  199   2HB   MET  28          1HB       MET  28  10.255  -1.926  -6.338
  200   1HG   MET  28          2HG       MET  28  12.041  -1.962  -7.927
  201   2HG   MET  28          1HG       MET  28  11.776  -0.261  -8.330
  202   1HE   MET  28          1HE       MET  28  14.198   0.728  -7.805
  203   2HE   MET  28          2HE       MET  28  14.194   1.484  -6.212
  204   3HE   MET  28          3HE       MET  28  12.787   1.636  -7.264
  205    H    PHE  29           H        PHE  29   6.994  -1.133  -7.069
  206    HA   PHE  29           HA       PHE  29   6.622  -3.691  -6.034
  207   1HB   PHE  29          2HB       PHE  29   5.027  -1.303  -6.409
  208   2HB   PHE  29          1HB       PHE  29   4.060  -2.751  -6.699
  209    HD1  PHE  29           1HD      PHE  29   5.540  -0.623  -4.235
  210    HD2  PHE  29           2HD      PHE  29   4.015  -4.531  -4.916
  211    HE1  PHE  29           1HE      PHE  29   5.286  -0.941  -1.809
  212    HE2  PHE  29           2HE      PHE  29   3.756  -4.858  -2.497
  213    HZ   PHE  29           HZ       PHE  29   4.391  -3.062  -0.936
  214    H    ASP  30           H        ASP  30   4.728  -2.442  -8.774
  215    HA   ASP  30           HA       ASP  30   3.818  -4.851  -9.731
  216   1HB   ASP  30          2HB       ASP  30   4.401  -2.247 -11.125
  217   2HB   ASP  30          1HB       ASP  30   3.739  -3.632 -11.999
  218    H    ALA  31           H        ALA  31   4.809  -6.575 -10.477
  219    HA   ALA  31           HA       ALA  31   7.567  -6.426 -11.373
  220   1HB   ALA  31          1HB       ALA  31   6.604  -8.210  -9.812
  221   2HB   ALA  31          2HB       ALA  31   7.651  -8.751 -11.124
  222   3HB   ALA  31          3HB       ALA  31   5.902  -8.919 -11.266
  223    H    ASP  32           H        ASP  32   4.481  -7.662 -12.650
  224    HA   ASP  32           HA       ASP  32   5.583  -8.017 -15.287
  225   1HB   ASP  32          2HB       ASP  32   3.258  -8.650 -15.901
  226   2HB   ASP  32          1HB       ASP  32   3.876  -9.562 -14.520
  227    H    GLY  33           H        GLY  33   3.872  -5.546 -13.560
  228   1HA   GLY  33          2HA       GLY  33   3.526  -3.339 -14.155
  229   2HA   GLY  33          1HA       GLY  33   4.288  -3.678 -15.702
  230    H    GLY  34           H        GLY  34   1.543  -5.467 -14.441
  231   1HA   GLY  34          2HA       GLY  34  -0.420  -3.953 -15.885
  232   2HA   GLY  34          1HA       GLY  34   0.027  -5.436 -16.725
  233    H    GLY  35           H        GLY  35  -0.014  -5.184 -13.232
  234   1HA   GLY  35          2HA       GLY  35  -2.582  -6.608 -13.138
  235   2HA   GLY  35          1HA       GLY  35  -1.169  -7.363 -12.403
  236    H    ASP  36           H        ASP  36  -0.836  -6.978 -10.319
  237    HA   ASP  36           HA       ASP  36  -1.400  -4.433  -9.115
  238   1HB   ASP  36          2HB       ASP  36  -3.233  -6.758  -8.712
  239   2HB   ASP  36          1HB       ASP  36  -2.896  -5.700  -7.337
  240    H    ILE  37           H        ILE  37  -1.325  -4.921  -6.516
  241    HA   ILE  37           HA       ILE  37   1.256  -6.252  -6.164
  242    HB   ILE  37           HB       ILE  37  -0.237  -4.303  -4.408
  243   1HG1  ILE  37          2HG1      ILE  37   2.349  -4.033  -5.955
  244   2HG1  ILE  37          1HG1      ILE  37   0.792  -3.357  -6.443
  245   1HG2  ILE  37          1HG2      ILE  37   1.683  -4.296  -2.938
  246   2HG2  ILE  37          2HG2      ILE  37   2.492  -5.498  -3.945
  247   3HG2  ILE  37          3HG2      ILE  37   1.028  -5.928  -3.058
  248   1HD1  ILE  37          1HD1      ILE  37   2.443  -1.793  -5.331
  249   2HD1  ILE  37          2HD1      ILE  37   2.086  -2.656  -3.834
  250   3HD1  ILE  37          3HD1      ILE  37   0.798  -1.808  -4.691
  251    H    SER  38           H        SER  38   1.440  -8.127  -5.135
  252    HA   SER  38           HA       SER  38  -0.830  -9.071  -3.511
  253   1HB   SER  38          2HB       SER  38  -0.358 -10.260  -5.747
  254   2HB   SER  38          1HB       SER  38   1.084 -10.902  -4.953
  255    HG   SER  38           HG       SER  38  -1.576 -11.187  -3.997
  256    H    THR  39           H        THR  39   0.401 -11.352  -2.476
  257    HA   THR  39           HA       THR  39   1.802 -10.272  -0.279
  258    HB   THR  39           HB       THR  39   2.390 -12.940  -0.172
  259    HG1  THR  39           1HG      THR  39   1.304 -13.302  -2.154
  260   1HG2  THR  39          1HG2      THR  39   0.723 -11.242   1.188
  261   2HG2  THR  39          2HG2      THR  39   1.009 -12.942   1.563
  262   3HG2  THR  39          3HG2      THR  39  -0.376 -12.476   0.573
  263    H    LYS  40           H        LYS  40   2.856 -11.470  -3.352
  264    HA   LYS  40           HA       LYS  40   5.599 -11.847  -2.509
  265   1HB   LYS  40          2HB       LYS  40   4.063 -12.850  -4.577
  266   2HB   LYS  40          1HB       LYS  40   5.131 -11.707  -5.390
  267   1HG   LYS  40          2HG       LYS  40   6.359 -13.641  -5.492
  268   2HG   LYS  40          1HG       LYS  40   6.995 -12.903  -4.016
  269   1HD   LYS  40          2HD       LYS  40   5.217 -14.277  -2.787
  270   2HD   LYS  40          1HD       LYS  40   5.055 -15.183  -4.292
  271   1HE   LYS  40          2HE       LYS  40   6.594 -16.368  -2.918
  272   2HE   LYS  40          1HE       LYS  40   7.525 -15.597  -4.202
  273   1HZ   LYS  40          1HZ       LYS  40   7.181 -14.266  -1.592
  274   2HZ   LYS  40          2HZ       LYS  40   8.398 -14.044  -2.746
  275   3HZ   LYS  40          3HZ       LYS  40   8.375 -15.447  -1.802
  276    H    GLU  41           H        GLU  41   3.728  -9.481  -4.346
  277    HA   GLU  41           HA       GLU  41   5.959  -7.917  -5.146
  278   1HB   GLU  41          2HB       GLU  41   3.063  -7.096  -4.883
  279   2HB   GLU  41          1HB       GLU  41   4.306  -6.227  -5.771
  280   1HG   GLU  41          2HG       GLU  41   4.479  -8.674  -6.913
  281   2HG   GLU  41          1HG       GLU  41   2.763  -8.604  -6.519
  282    H    LEU  42           H        LEU  42   4.313  -8.223  -2.163
  283    HA   LEU  42           HA       LEU  42   4.961  -5.573  -1.220
  284   1HB   LEU  42          2HB       LEU  42   3.197  -7.624  -0.434
  285   2HB   LEU  42          1HB       LEU  42   4.324  -7.411   0.900
  286    HG   LEU  42           HG       LEU  42   2.442  -6.020   1.325
  287   1HD1  LEU  42          1HD1      LEU  42   4.851  -4.509   0.361
  288   2HD1  LEU  42          2HD1      LEU  42   4.386  -4.914   2.015
  289   3HD1  LEU  42          3HD1      LEU  42   3.477  -3.699   1.114
  290   1HD2  LEU  42          1HD2      LEU  42   2.625  -4.255  -0.975
  291   2HD2  LEU  42          2HD2      LEU  42   1.213  -4.998  -0.222
  292   3HD2  LEU  42          3HD2      LEU  42   2.161  -5.902  -1.401
  293    H    GLY  43           H        GLY  43   5.884  -8.843  -0.115
  294   1HA   GLY  43          2HA       GLY  43   7.882  -8.169   1.643
  295   2HA   GLY  43          1HA       GLY  43   7.898  -9.639   0.671
  296    H    THR  44           H        THR  44   8.004  -8.046  -1.837
  297    HA   THR  44           HA       THR  44  10.756  -8.066  -2.256
  298    HB   THR  44           HB       THR  44   8.390  -7.012  -3.720
  299    HG1  THR  44           1HG      THR  44   8.895  -8.602  -5.007
  300   1HG2  THR  44          1HG2      THR  44  11.152  -6.016  -4.211
  301   2HG2  THR  44          2HG2      THR  44   9.606  -5.181  -4.361
  302   3HG2  THR  44          3HG2      THR  44  10.097  -6.358  -5.582
  303    H    VAL  45           H        VAL  45   8.866  -5.086  -2.531
  304    HA   VAL  45           HA       VAL  45  11.053  -3.392  -2.046
  305    HB   VAL  45           HB       VAL  45   9.078  -2.668  -3.279
  306   1HG1  VAL  45          1HG1      VAL  45   7.096  -3.310  -2.493
  307   2HG1  VAL  45          2HG1      VAL  45   7.208  -1.939  -1.389
  308   3HG1  VAL  45          3HG1      VAL  45   7.723  -3.540  -0.860
  309   1HG2  VAL  45          1HG2      VAL  45   9.649  -0.587  -2.762
  310   2HG2  VAL  45          2HG2      VAL  45  10.448  -1.187  -1.310
  311   3HG2  VAL  45          3HG2      VAL  45   8.758  -0.686  -1.243
  312    H    MET  46           H        MET  46   8.851  -4.979   0.115
  313    HA   MET  46           HA       MET  46   9.317  -3.228   2.336
  314   1HB   MET  46          2HB       MET  46   7.892  -5.814   1.913
  315   2HB   MET  46          1HB       MET  46   8.337  -5.370   3.561
  316   1HG   MET  46          2HG       MET  46   6.654  -3.735   1.671
  317   2HG   MET  46          1HG       MET  46   6.068  -4.683   3.043
  318   1HE   MET  46          1HE       MET  46   4.804  -3.083   3.932
  319   2HE   MET  46          2HE       MET  46   5.255  -1.528   4.634
  320   3HE   MET  46          3HE       MET  46   5.586  -3.023   5.512
  321    H    ARG  47           H        ARG  47  10.758  -6.187   1.129
  322    HA   ARG  47           HA       ARG  47  12.340  -6.572   3.526
  323   1HB   ARG  47          2HB       ARG  47  12.243  -8.013   0.878
  324   2HB   ARG  47          1HB       ARG  47  13.390  -8.423   2.145
  325   1HG   ARG  47          2HG       ARG  47  11.720  -9.189   3.578
  326   2HG   ARG  47          1HG       ARG  47  10.445  -8.361   2.684
  327   1HD   ARG  47          2HD       ARG  47  10.072 -10.388   1.789
  328   2HD   ARG  47          1HD       ARG  47  11.454  -9.987   0.762
  329    HE   ARG  47           HE       ARG  47  12.612 -11.131   2.916
  330   1HH1  ARG  47          1HH1      ARG  47  10.009 -12.127   0.815
  331   2HH1  ARG  47          2HH1      ARG  47  10.333 -13.817   1.009
  332   1HH2  ARG  47          1HH2      ARG  47  13.040 -13.352   3.171
  333   2HH2  ARG  47          2HH2      ARG  47  12.054 -14.513   2.346
  334    H    MET  48           H        MET  48  12.719  -5.120   0.380
  335    HA   MET  48           HA       MET  48  15.605  -4.896   0.718
  336   1HB   MET  48          2HB       MET  48  15.619  -3.960  -1.531
  337   2HB   MET  48          1HB       MET  48  14.722  -5.477  -1.497
  338   1HG   MET  48          2HG       MET  48  12.883  -4.501  -2.250
  339   2HG   MET  48          1HG       MET  48  12.977  -3.229  -1.033
  340   1HE   MET  48          1HE       MET  48  11.796  -1.799  -3.564
  341   2HE   MET  48          2HE       MET  48  12.935  -0.462  -3.391
  342   3HE   MET  48          3HE       MET  48  12.330  -1.296  -1.960
  343    H    LEU  49           H        LEU  49  13.249  -3.328   2.145
  344    HA   LEU  49           HA       LEU  49  14.520  -0.688   1.834
  345   1HB   LEU  49          2HB       LEU  49  11.651  -1.450   2.233
  346   2HB   LEU  49          1HB       LEU  49  12.228   0.116   2.771
  347    HG   LEU  49           HG       LEU  49  12.245  -0.936  -0.056
  348   1HD1  LEU  49          1HD1      LEU  49  10.082  -0.226   0.363
  349   2HD1  LEU  49          2HD1      LEU  49  10.837   1.218  -0.307
  350   3HD1  LEU  49          3HD1      LEU  49  10.604   1.071   1.435
  351   1HD2  LEU  49          1HD2      LEU  49  14.174   0.329  -0.023
  352   2HD2  LEU  49          2HD2      LEU  49  13.551   1.442   1.194
  353   3HD2  LEU  49          3HD2      LEU  49  12.962   1.529  -0.466
  354    H    GLY  50           H        GLY  50  12.982  -2.946   4.082
  355   1HA   GLY  50          2HA       GLY  50  14.728  -2.746   6.155
  356   2HA   GLY  50          1HA       GLY  50  13.658  -1.365   6.397
  357    H    GLN  51           H        GLN  51  11.310  -2.711   5.348
  358    HA   GLN  51           HA       GLN  51  10.392  -3.907   7.748
  359   1HB   GLN  51          2HB       GLN  51   9.261  -2.934   5.334
  360   2HB   GLN  51          1HB       GLN  51   8.692  -4.589   5.544
  361   1HG   GLN  51          2HG       GLN  51   8.573  -2.711   7.853
  362   2HG   GLN  51          1HG       GLN  51   7.382  -2.566   6.561
  363   1HE2  GLN  51          1HE2      GLN  51   8.496  -4.432   9.232
  364   2HE2  GLN  51          2HE2      GLN  51   7.199  -5.573   9.255
  365    H    ASN  52           H        ASN  52   9.476  -6.095   7.935
  366    HA   ASN  52           HA       ASN  52  10.632  -8.081   6.132
  367   1HB   ASN  52          2HB       ASN  52  12.248  -7.671   8.013
  368   2HB   ASN  52          1HB       ASN  52  11.010  -8.267   9.122
  369   1HD2  ASN  52          1HD2      ASN  52  13.488  -9.449   8.936
  370   2HD2  ASN  52          2HD2      ASN  52  13.321 -11.025   8.251
  371    HA   PRO  53           HA       PRO  53   6.361  -9.058   7.921
  372   1HB   PRO  53          2HB       PRO  53   4.849  -8.590   5.738
  373   2HB   PRO  53          1HB       PRO  53   5.258  -7.310   6.888
  374   1HG   PRO  53          2HG       PRO  53   6.510  -7.949   4.242
  375   2HG   PRO  53          1HG       PRO  53   6.063  -6.370   4.915
  376   1HD   PRO  53          2HD       PRO  53   8.608  -7.334   4.958
  377   2HD   PRO  53          1HD       PRO  53   7.964  -6.240   6.202
  378    H    THR  54           H        THR  54   6.645 -11.232   8.009
  379    HA   THR  54           HA       THR  54   7.491 -12.887   5.923
  380    HB   THR  54           HB       THR  54   5.652 -14.052   7.938
  381    HG1  THR  54           1HG      THR  54   6.758 -13.443   9.629
  382   1HG2  THR  54          1HG2      THR  54   7.781 -14.966   6.354
  383   2HG2  THR  54          2HG2      THR  54   6.844 -15.866   7.547
  384   3HG2  THR  54          3HG2      THR  54   8.324 -15.038   8.030
  385    H    LYS  55           H        LYS  55   5.906 -14.919   5.426
  386    HA   LYS  55           HA       LYS  55   4.122 -14.021   3.485
  387   1HB   LYS  55          2HB       LYS  55   4.787 -16.610   4.729
  388   2HB   LYS  55          1HB       LYS  55   3.172 -16.518   4.025
  389   1HG   LYS  55          2HG       LYS  55   4.727 -15.412   2.064
  390   2HG   LYS  55          1HG       LYS  55   5.784 -16.657   2.730
  391   1HD   LYS  55          2HD       LYS  55   4.573 -18.305   1.824
  392   2HD   LYS  55          1HD       LYS  55   3.053 -17.593   2.369
  393   1HE   LYS  55          2HE       LYS  55   2.661 -16.613   0.386
  394   2HE   LYS  55          1HE       LYS  55   4.348 -16.146   0.175
  395   1HZ   LYS  55          1HZ       LYS  55   4.660 -18.673  -0.250
  396   2HZ   LYS  55          2HZ       LYS  55   4.071 -17.681  -1.487
  397   3HZ   LYS  55          3HZ       LYS  55   3.004 -18.643  -0.595
  398    H    CYS  56           H        CYS  56   3.389 -15.393   6.692
  399    HA   CYS  56           HA       CYS  56   0.610 -15.029   6.556
  400   1HB   CYS  56          2HB       CYS  56   2.588 -15.508   8.728
  401   2HB   CYS  56          1HB       CYS  56   0.997 -14.905   9.202
  402    HG   CYS  56           HG       CYS  56   1.062 -17.459   7.469
  403    H    GLU  57           H        GLU  57   3.213 -12.870   7.430
  404    HA   GLU  57           HA       GLU  57   1.744 -10.870   8.728
  405   1HB   GLU  57          2HB       GLU  57   4.392 -11.257   7.998
  406   2HB   GLU  57          1HB       GLU  57   3.913  -9.836   7.069
  407   1HG   GLU  57          2HG       GLU  57   3.559 -10.135  10.045
  408   2HG   GLU  57          1HG       GLU  57   4.914  -9.314   9.271
  409    H    LEU  58           H        LEU  58   2.873 -10.895   5.343
  410    HA   LEU  58           HA       LEU  58   1.270  -8.689   4.576
  411   1HB   LEU  58          2HB       LEU  58   2.374 -10.815   2.744
  412   2HB   LEU  58          1HB       LEU  58   1.970  -9.151   2.336
  413    HG   LEU  58           HG       LEU  58   4.124  -9.770   4.340
  414   1HD1  LEU  58          1HD1      LEU  58   4.967 -10.973   2.549
  415   2HD1  LEU  58          2HD1      LEU  58   5.664  -9.370   2.306
  416   3HD1  LEU  58          3HD1      LEU  58   4.269  -9.879   1.354
  417   1HD2  LEU  58          1HD2      LEU  58   3.193  -7.417   2.782
  418   2HD2  LEU  58          2HD2      LEU  58   4.919  -7.559   3.122
  419   3HD2  LEU  58          3HD2      LEU  58   3.758  -7.521   4.450
  420    H    ASP  59           H        ASP  59   0.744 -12.140   4.658
  421    HA   ASP  59           HA       ASP  59  -1.542 -12.217   2.984
  422   1HB   ASP  59          2HB       ASP  59  -0.278 -14.051   4.963
  423   2HB   ASP  59          1HB       ASP  59  -1.964 -14.353   4.530
  424    H    ALA  60           H        ALA  60  -1.048 -11.342   6.301
  425    HA   ALA  60           HA       ALA  60  -3.795 -11.593   7.058
  426   1HB   ALA  60          1HB       ALA  60  -1.504 -11.410   8.476
  427   2HB   ALA  60          2HB       ALA  60  -3.103 -11.087   9.147
  428   3HB   ALA  60          3HB       ALA  60  -2.089  -9.751   8.601
  429    H    ILE  61           H        ILE  61  -1.775  -9.102   5.688
  430    HA   ILE  61           HA       ILE  61  -3.683  -6.990   6.112
  431    HB   ILE  61           HB       ILE  61  -1.080  -7.188   4.618
  432   1HG1  ILE  61          2HG1      ILE  61  -0.669  -5.182   6.233
  433   2HG1  ILE  61          1HG1      ILE  61  -2.091  -5.796   7.080
  434   1HG2  ILE  61          1HG2      ILE  61  -3.145  -5.033   4.437
  435   2HG2  ILE  61          2HG2      ILE  61  -2.185  -5.775   3.158
  436   3HG2  ILE  61          3HG2      ILE  61  -1.431  -4.649   4.285
  437   1HD1  ILE  61          1HD1      ILE  61   0.338  -7.460   6.470
  438   2HD1  ILE  61          2HD1      ILE  61  -1.015  -7.869   7.526
  439   3HD1  ILE  61          3HD1      ILE  61   0.098  -6.578   7.978
  440    H    ILE  62           H        ILE  62  -2.359  -8.568   3.188
  441    HA   ILE  62           HA       ILE  62  -3.978  -7.513   1.262
  442    HB   ILE  62           HB       ILE  62  -3.041 -10.378   1.471
  443   1HG1  ILE  62          2HG1      ILE  62  -1.895  -7.904   0.165
  444   2HG1  ILE  62          1HG1      ILE  62  -1.178  -8.870   1.456
  445   1HG2  ILE  62          1HG2      ILE  62  -4.124  -8.887  -0.918
  446   2HG2  ILE  62          2HG2      ILE  62  -4.887 -10.248  -0.095
  447   3HG2  ILE  62          3HG2      ILE  62  -3.371 -10.481  -0.966
  448   1HD1  ILE  62          1HD1      ILE  62  -1.067 -10.768  -0.193
  449   2HD1  ILE  62          2HD1      ILE  62  -0.010  -9.395  -0.522
  450   3HD1  ILE  62          3HD1      ILE  62  -1.504  -9.599  -1.439
  451    H    CYS  63           H        CYS  63  -4.730 -10.327   3.307
  452    HA   CYS  63           HA       CYS  63  -7.213 -10.962   2.218
  453   1HB   CYS  63          2HB       CYS  63  -5.738 -12.100   4.108
  454   2HB   CYS  63          1HB       CYS  63  -6.815 -11.193   5.173
  455    HG   CYS  63           HG       CYS  63  -8.548 -12.871   4.792
  456    H    GLU  64           H        GLU  64  -6.284  -8.492   4.516
  457    HA   GLU  64           HA       GLU  64  -9.020  -7.735   5.084
  458   1HB   GLU  64          2HB       GLU  64  -6.337  -6.986   6.070
  459   2HB   GLU  64          1HB       GLU  64  -7.523  -5.687   6.065
  460   1HG   GLU  64          2HG       GLU  64  -8.611  -8.135   7.158
  461   2HG   GLU  64          1HG       GLU  64  -7.169  -7.606   8.023
  462    H    VAL  65           H        VAL  65  -6.339  -6.682   3.093
  463    HA   VAL  65           HA       VAL  65  -7.396  -4.186   2.285
  464    HB   VAL  65           HB       VAL  65  -5.492  -6.008   0.800
  465   1HG1  VAL  65          1HG1      VAL  65  -6.050  -3.066   0.444
  466   2HG1  VAL  65          2HG1      VAL  65  -6.497  -4.354  -0.674
  467   3HG1  VAL  65          3HG1      VAL  65  -4.796  -3.983  -0.390
  468   1HG2  VAL  65          1HG2      VAL  65  -3.815  -4.265   1.726
  469   2HG2  VAL  65          2HG2      VAL  65  -4.392  -5.543   2.789
  470   3HG2  VAL  65          3HG2      VAL  65  -5.076  -3.925   2.911
  471    H    ASP  66           H        ASP  66  -7.475  -7.414   0.827
  472    HA   ASP  66           HA       ASP  66  -9.143  -6.567  -1.356
  473   1HB   ASP  66          2HB       ASP  66  -8.151  -9.265  -0.432
  474   2HB   ASP  66          1HB       ASP  66  -9.213  -9.063  -1.824
  475    H    GLU  67           H        GLU  67 -11.103  -5.858  -0.657
  476    HA   GLU  67           HA       GLU  67 -12.628  -7.253   1.331
  477   1HB   GLU  67          2HB       GLU  67 -13.209  -4.942  -0.512
  478   2HB   GLU  67          1HB       GLU  67 -14.465  -5.649   0.504
  479   1HG   GLU  67          2HG       GLU  67 -13.759  -3.974   1.865
  480   2HG   GLU  67          1HG       GLU  67 -12.675  -5.265   2.397
  481    H    ASP  68           H        ASP  68 -12.329  -7.368  -2.116
  482    HA   ASP  68           HA       ASP  68 -14.821  -8.787  -2.508
  483   1HB   ASP  68          2HB       ASP  68 -14.179  -8.859  -4.859
  484   2HB   ASP  68          1HB       ASP  68 -13.973  -7.230  -4.226
  485    H    GLY  69           H        GLY  69 -11.433  -9.518  -2.104
  486   1HA   GLY  69          2HA       GLY  69 -10.684 -11.635  -1.326
  487   2HA   GLY  69          1HA       GLY  69 -12.114 -12.371  -2.036
  488    H    SER  70           H        SER  70  -9.599 -10.236  -3.367
  489    HA   SER  70           HA       SER  70  -9.206 -12.202  -5.520
  490   1HB   SER  70          2HB       SER  70  -8.037  -9.991  -6.515
  491   2HB   SER  70          1HB       SER  70  -9.761 -10.331  -6.709
  492    HG   SER  70           HG       SER  70  -8.537  -8.672  -4.757
  493    H    GLY  71           H        GLY  71  -7.669 -10.568  -2.903
  494   1HA   GLY  71          2HA       GLY  71  -5.592 -10.937  -1.961
  495   2HA   GLY  71          1HA       GLY  71  -5.301 -12.159  -3.198
  496    H    THR  72           H        THR  72  -6.242  -9.327  -4.695
  497    HA   THR  72           HA       THR  72  -3.440  -8.500  -5.066
  498    HB   THR  72           HB       THR  72  -4.059  -7.843  -7.362
  499    HG1  THR  72           1HG      THR  72  -6.051  -8.263  -8.158
  500   1HG2  THR  72          1HG2      THR  72  -3.856 -10.519  -6.431
  501   2HG2  THR  72          2HG2      THR  72  -3.374  -9.843  -7.987
  502   3HG2  THR  72          3HG2      THR  72  -5.010 -10.461  -7.764
  503    H    ILE  73           H        ILE  73  -2.969  -6.340  -5.065
  504    HA   ILE  73           HA       ILE  73  -5.082  -4.587  -4.041
  505    HB   ILE  73           HB       ILE  73  -2.121  -4.040  -4.171
  506   1HG1  ILE  73          2HG1      ILE  73  -3.697  -5.020  -1.780
  507   2HG1  ILE  73          1HG1      ILE  73  -2.730  -6.079  -2.811
  508   1HG2  ILE  73          1HG2      ILE  73  -2.732  -2.437  -2.316
  509   2HG2  ILE  73          2HG2      ILE  73  -4.419  -2.728  -2.738
  510   3HG2  ILE  73          3HG2      ILE  73  -3.324  -2.015  -3.923
  511   1HD1  ILE  73          1HD1      ILE  73  -1.530  -3.684  -1.472
  512   2HD1  ILE  73          2HD1      ILE  73  -0.728  -5.121  -2.109
  513   3HD1  ILE  73          3HD1      ILE  73  -1.695  -5.229  -0.638
  514    H    ASP  74           H        ASP  74  -6.066  -3.244  -5.394
  515    HA   ASP  74           HA       ASP  74  -5.121  -2.778  -8.045
  516   1HB   ASP  74          2HB       ASP  74  -7.310  -1.258  -6.623
  517   2HB   ASP  74          1HB       ASP  74  -7.109  -1.483  -8.362
  518    H    PHE  75           H        PHE  75  -5.645  -0.148  -8.576
  519    HA   PHE  75           HA       PHE  75  -3.230   1.108  -7.925
  520   1HB   PHE  75          2HB       PHE  75  -5.741   1.889  -9.286
  521   2HB   PHE  75          1HB       PHE  75  -4.765   3.215  -8.648
  522    HD1  PHE  75           1HD      PHE  75  -3.178   4.125 -10.027
  523    HD2  PHE  75           2HD      PHE  75  -4.333   0.072 -10.617
  524    HE1  PHE  75           1HE      PHE  75  -1.717   4.001 -12.003
  525    HE2  PHE  75           2HE      PHE  75  -2.873  -0.060 -12.593
  526    HZ   PHE  75           HZ       PHE  75  -1.563   1.906 -13.288
  527    H    GLU  76           H        GLU  76  -6.361   2.561  -7.098
  528    HA   GLU  76           HA       GLU  76  -5.327   4.050  -4.948
  529   1HB   GLU  76          2HB       GLU  76  -8.190   3.235  -5.473
  530   2HB   GLU  76          1HB       GLU  76  -7.672   4.502  -4.369
  531   1HG   GLU  76          2HG       GLU  76  -8.190   5.774  -6.166
  532   2HG   GLU  76          1HG       GLU  76  -6.505   5.428  -6.551
  533    H    GLU  77           H        GLU  77  -6.634   0.827  -5.145
  534    HA   GLU  77           HA       GLU  77  -7.380   0.323  -2.546
  535   1HB   GLU  77          2HB       GLU  77  -6.478  -1.283  -4.821
  536   2HB   GLU  77          1HB       GLU  77  -6.144  -2.027  -3.263
  537   1HG   GLU  77          2HG       GLU  77  -8.480  -1.848  -2.645
  538   2HG   GLU  77          1HG       GLU  77  -8.838  -1.038  -4.177
  539    H    PHE  78           H        PHE  78  -4.183   0.813  -3.803
  540    HA   PHE  78           HA       PHE  78  -2.699  -0.419  -1.735
  541   1HB   PHE  78          2HB       PHE  78  -1.928   0.511  -4.052
  542   2HB   PHE  78          1HB       PHE  78  -1.728   2.034  -3.181
  543    HD1  PHE  78           1HD      PHE  78  -0.987  -1.530  -2.345
  544    HD2  PHE  78           2HD      PHE  78   0.486   2.439  -2.764
  545    HE1  PHE  78           1HE      PHE  78   1.224  -2.273  -1.564
  546    HE2  PHE  78           2HE      PHE  78   2.700   1.704  -1.984
  547    HZ   PHE  78           HZ       PHE  78   3.071  -0.655  -1.382
  548    H    LEU  79           H        LEU  79  -4.672   2.341  -1.703
  549    HA   LEU  79           HA       LEU  79  -3.250   3.541   0.553
  550   1HB   LEU  79          2HB       LEU  79  -5.712   4.465  -0.942
  551   2HB   LEU  79          1HB       LEU  79  -4.930   5.346   0.356
  552    HG   LEU  79           HG       LEU  79  -2.870   4.934  -1.442
  553   1HD1  LEU  79          1HD1      LEU  79  -4.195   4.167  -3.222
  554   2HD1  LEU  79          2HD1      LEU  79  -3.896   5.871  -3.567
  555   3HD1  LEU  79          3HD1      LEU  79  -5.453   5.362  -2.910
  556   1HD2  LEU  79          1HD2      LEU  79  -2.717   7.177  -1.347
  557   2HD2  LEU  79          2HD2      LEU  79  -3.976   7.017  -0.124
  558   3HD2  LEU  79          3HD2      LEU  79  -4.408   7.418  -1.786
  559    H    VAL  80           H        VAL  80  -6.391   2.137  -0.297
  560    HA   VAL  80           HA       VAL  80  -7.596   2.358   2.229
  561    HB   VAL  80           HB       VAL  80  -8.095   0.154   0.229
  562   1HG1  VAL  80          1HG1      VAL  80 -10.450   0.441   1.223
  563   2HG1  VAL  80          2HG1      VAL  80  -9.634   1.280   2.542
  564   3HG1  VAL  80          3HG1      VAL  80  -9.235  -0.400   2.186
  565   1HG2  VAL  80          1HG2      VAL  80  -9.257   1.542  -1.104
  566   2HG2  VAL  80          2HG2      VAL  80  -8.235   2.785  -0.382
  567   3HG2  VAL  80          3HG2      VAL  80  -9.857   2.506   0.245
  568    H    MET  81           H        MET  81  -5.458  -0.056   0.842
  569    HA   MET  81           HA       MET  81  -5.706  -2.162   2.572
  570   1HB   MET  81          2HB       MET  81  -3.114  -2.331   2.261
  571   2HB   MET  81          1HB       MET  81  -4.170  -2.541   0.876
  572   1HG   MET  81          2HG       MET  81  -3.527  -0.615  -0.092
  573   2HG   MET  81          1HG       MET  81  -3.183   0.185   1.442
  574   1HE   MET  81          1HE       MET  81  -1.715  -1.137   3.013
  575   2HE   MET  81          2HE       MET  81  -0.089  -0.563   2.628
  576   3HE   MET  81          3HE       MET  81  -0.465  -2.286   2.536
  577    H    MET  82           H        MET  82  -3.977   0.845   3.033
  578    HA   MET  82           HA       MET  82  -3.181   0.091   5.724
  579   1HB   MET  82          2HB       MET  82  -2.324   2.071   3.738
  580   2HB   MET  82          1HB       MET  82  -2.308   2.642   5.410
  581   1HG   MET  82          2HG       MET  82  -1.156   0.188   5.656
  582   2HG   MET  82          1HG       MET  82  -0.586   0.696   4.067
  583   1HE   MET  82          1HE       MET  82   0.517   4.343   5.107
  584   2HE   MET  82          2HE       MET  82  -0.623   3.464   4.085
  585   3HE   MET  82          3HE       MET  82   1.114   3.215   3.890
  586    H    VAL  83           H        VAL  83  -5.404   2.244   4.066
  587    HA   VAL  83           HA       VAL  83  -6.096   3.938   6.174
  588    HB   VAL  83           HB       VAL  83  -7.936   2.895   4.012
  589   1HG1  VAL  83          1HG1      VAL  83  -8.132   5.472   5.555
  590   2HG1  VAL  83          2HG1      VAL  83  -9.037   4.013   5.960
  591   3HG1  VAL  83          3HG1      VAL  83  -9.297   4.813   4.408
  592   1HG2  VAL  83          1HG2      VAL  83  -6.978   5.560   3.569
  593   2HG2  VAL  83          2HG2      VAL  83  -6.837   4.139   2.536
  594   3HG2  VAL  83          3HG2      VAL  83  -5.612   4.460   3.766
  595    H    ARG  84           H        ARG  84  -7.021   0.643   5.479
  596    HA   ARG  84           HA       ARG  84  -9.145   0.558   7.410
  597   1HB   ARG  84          2HB       ARG  84  -7.686  -1.652   5.951
  598   2HB   ARG  84          1HB       ARG  84  -9.099  -1.892   6.970
  599   1HG   ARG  84          2HG       ARG  84 -10.078  -0.033   5.319
  600   2HG   ARG  84          1HG       ARG  84  -8.886  -0.777   4.244
  601   1HD   ARG  84          2HD       ARG  84 -10.013  -2.738   4.135
  602   2HD   ARG  84          1HD       ARG  84 -10.587  -2.624   5.799
  603    HE   ARG  84           HE       ARG  84 -11.929  -1.696   3.431
  604   1HH1  ARG  84          1HH1      ARG  84 -11.632  -1.321   6.887
  605   2HH1  ARG  84          2HH1      ARG  84 -13.219  -0.655   7.077
  606   1HH2  ARG  84          1HH2      ARG  84 -14.017  -0.821   3.678
  607   2HH2  ARG  84          2HH2      ARG  84 -14.573  -0.371   5.255
  608    H    GLN  85           H        GLN  85  -5.718   0.024   7.414
  609    HA   GLN  85           HA       GLN  85  -5.847  -1.125  10.114
  610   1HB   GLN  85          2HB       GLN  85  -3.326  -0.857   8.501
  611   2HB   GLN  85          1HB       GLN  85  -3.696  -1.999   9.793
  612   1HG   GLN  85          2HG       GLN  85  -4.754  -2.016   6.976
  613   2HG   GLN  85          1HG       GLN  85  -3.653  -3.180   7.721
  614   1HE2  GLN  85          1HE2      GLN  85  -6.316  -3.492   6.456
  615   2HE2  GLN  85          2HE2      GLN  85  -7.286  -4.300   7.635
  616    H    MET  86           H        MET  86  -6.031   1.795   9.027
  617    HA   MET  86           HA       MET  86  -4.017   2.934  10.848
  618   1HB   MET  86          2HB       MET  86  -5.001   3.743   8.171
  619   2HB   MET  86          1HB       MET  86  -4.725   5.048   9.326
  620   1HG   MET  86          2HG       MET  86  -2.429   3.836   9.671
  621   2HG   MET  86          1HG       MET  86  -2.785   3.171   8.072
  622   1HE   MET  86          1HE       MET  86  -1.487   5.722   5.791
  623   2HE   MET  86          2HE       MET  86  -2.925   4.699   5.817
  624   3HE   MET  86          3HE       MET  86  -1.381   4.068   6.391
  625    H    LYS  87           H        LYS  87  -7.320   3.293   9.603
  626    HA   LYS  87           HA       LYS  87  -8.106   4.401  12.202
  627   1HB   LYS  87          2HB       LYS  87  -9.577   6.042  11.048
  628   2HB   LYS  87          1HB       LYS  87  -7.859   6.333  10.776
  629   1HG   LYS  87          2HG       LYS  87  -9.441   4.733   8.809
  630   2HG   LYS  87          1HG       LYS  87  -9.516   6.499   8.796
  631   1HD   LYS  87          2HD       LYS  87  -6.807   5.360   8.946
  632   2HD   LYS  87          1HD       LYS  87  -7.677   5.030   7.446
  633   1HE   LYS  87          2HE       LYS  87  -6.681   7.030   6.929
  634   2HE   LYS  87          1HE       LYS  87  -8.223   7.593   7.573
  635   1HZ   LYS  87          1HZ       LYS  87  -6.202   8.768   8.425
  636   2HZ   LYS  87          2HZ       LYS  87  -5.778   7.342   9.230
  637   3HZ   LYS  87          3HZ       LYS  87  -7.218   8.138   9.623
  638    H    GLU  88           H        GLU  88  -8.603   1.924  12.034
  639    HA   GLU  88           HA       GLU  88 -10.940   1.195  10.549
  640   1HB   GLU  88          2HB       GLU  88  -8.939  -0.245  11.608
  641   2HB   GLU  88          1HB       GLU  88 -10.114  -0.412  12.906
  642   1HG   GLU  88          2HG       GLU  88 -11.479  -0.876  10.479
  643   2HG   GLU  88          1HG       GLU  88  -9.973  -1.791  10.420
  644    H    ASP  89           H        ASP  89 -12.875   0.247  11.677
  645    HA   ASP  89           HA       ASP  89 -14.732   0.539  12.955
  646   1HB   ASP  89          2HB       ASP  89 -12.666   0.182  14.718
  647   2HB   ASP  89          1HB       ASP  89 -13.351   1.712  15.274
  648    H    ALA  90           H        ALA  90 -16.155   2.156  13.914
  649    HA   ALA  90           HA       ALA  90 -15.294   4.932  13.621
  650   1HB   ALA  90          1HB       ALA  90 -16.376   3.953  11.464
  651   2HB   ALA  90          2HB       ALA  90 -16.858   5.549  12.040
  652   3HB   ALA  90          3HB       ALA  90 -17.885   4.150  12.357
  653   2H    ARG 115          HN2       ARG 115   2.260  -1.786   9.918
  654    H    ARG 115           H        ARG 115   1.235  -2.216  11.226
  655   3H    ARG 115          HN3       ARG 115   1.789  -3.421  10.140
  656    HA   ARG 115           HA       ARG 115   0.564  -2.499   8.376
  657   1HB   ARG 115          2HB       ARG 115  -1.640  -3.038   9.181
  658   2HB   ARG 115          1HB       ARG 115  -0.485  -4.088   9.988
  659   1HG   ARG 115          2HG       ARG 115  -0.558  -2.497  11.933
  660   2HG   ARG 115          1HG       ARG 115  -1.909  -1.698  11.126
  661   1HD   ARG 115          2HD       ARG 115  -3.078  -3.160  12.419
  662   2HD   ARG 115          1HD       ARG 115  -2.817  -4.186  11.008
  663    HE   ARG 115           HE       ARG 115  -0.752  -4.400  12.998
  664   1HH1  ARG 115          1HH1      ARG 115  -3.876  -5.574  11.976
  665   2HH1  ARG 115          2HH1      ARG 115  -3.717  -7.086  12.805
  666   1HH2  ARG 115          1HH2      ARG 115  -0.543  -6.388  14.088
  667   2HH2  ARG 115          2HH2      ARG 115  -1.825  -7.549  14.004
  668    H    MET 116           H        MET 116   0.089  -0.629  11.366
  669    HA   MET 116           HA       MET 116  -1.469   1.412  10.200
  670   1HB   MET 116          2HB       MET 116  -1.344   1.018  12.631
  671   2HB   MET 116          1HB       MET 116   0.330   1.558  12.627
  672   1HG   MET 116          2HG       MET 116  -0.899   3.670  11.458
  673   2HG   MET 116          1HG       MET 116  -2.158   3.105  12.556
  674   1HE   MET 116          1HE       MET 116  -1.476   5.774  12.879
  675   2HE   MET 116          2HE       MET 116   0.257   5.942  12.593
  676   3HE   MET 116          3HE       MET 116  -0.406   6.248  14.199
  677    H    SER 117           H        SER 117   1.929   1.622  11.284
  678    HA   SER 117           HA       SER 117   2.502   4.026   9.987
  679   1HB   SER 117          2HB       SER 117   4.879   3.407  10.267
  680   2HB   SER 117          1HB       SER 117   3.943   3.143  11.738
  681    HG   SER 117           HG       SER 117   3.775   0.905  11.021
  682    H    ALA 118           H        ALA 118   4.605   1.499   8.880
  683    HA   ALA 118           HA       ALA 118   5.107   0.705   6.813
  684   1HB   ALA 118          1HB       ALA 118   2.789   1.444   5.299
  685   2HB   ALA 118          2HB       ALA 118   2.309   0.757   6.852
  686   3HB   ALA 118          3HB       ALA 118   3.357  -0.158   5.768
  687    H    ASP 119           H        ASP 119   3.872   3.946   7.142
  688    HA   ASP 119           HA       ASP 119   4.356   5.098   4.714
  689   1HB   ASP 119          2HB       ASP 119   3.504   6.203   6.853
  690   2HB   ASP 119          1HB       ASP 119   5.195   6.399   7.305
  691    H    ALA 120           H        ALA 120   6.646   3.934   7.065
  692    HA   ALA 120           HA       ALA 120   8.975   5.220   6.279
  693   1HB   ALA 120          1HB       ALA 120   9.266   2.343   6.849
  694   2HB   ALA 120          2HB       ALA 120   8.409   3.281   8.072
  695   3HB   ALA 120          3HB       ALA 120  10.047   3.735   7.601
  696    H    MET 121           H        MET 121   7.651   2.158   5.017
  697    HA   MET 121           HA       MET 121   9.594   1.845   2.985
  698   1HB   MET 121          2HB       MET 121   8.254  -0.047   3.691
  699   2HB   MET 121          1HB       MET 121   6.775   0.773   3.211
  700   1HG   MET 121          2HG       MET 121   8.165   0.789   0.878
  701   2HG   MET 121          1HG       MET 121   8.713  -0.722   1.605
  702   1HE   MET 121          1HE       MET 121   4.810   0.668   2.089
  703   2HE   MET 121          2HE       MET 121   4.490   0.451   0.368
  704   3HE   MET 121          3HE       MET 121   5.800   1.509   0.896
  705    H    LEU 122           H        LEU 122   6.543   3.532   3.197
  706    HA   LEU 122           HA       LEU 122   6.204   4.082   0.449
  707   1HB   LEU 122          2HB       LEU 122   5.189   5.383   2.964
  708   2HB   LEU 122          1HB       LEU 122   4.817   6.044   1.386
  709    HG   LEU 122           HG       LEU 122   3.830   3.781   0.800
  710   1HD1  LEU 122          1HD1      LEU 122   3.921   3.388   3.785
  711   2HD1  LEU 122          2HD1      LEU 122   4.952   2.542   2.632
  712   3HD1  LEU 122          3HD1      LEU 122   3.204   2.305   2.590
  713   1HD2  LEU 122          1HD2      LEU 122   2.371   5.612   1.230
  714   2HD2  LEU 122          2HD2      LEU 122   2.633   5.490   2.970
  715   3HD2  LEU 122          3HD2      LEU 122   1.745   4.225   2.122
  716    H    ARG 123           H        ARG 123   7.864   5.764   3.075
  717    HA   ARG 123           HA       ARG 123   8.692   7.907   1.283
  718   1HB   ARG 123          2HB       ARG 123   7.981   8.207   3.738
  719   2HB   ARG 123          1HB       ARG 123   9.567   7.562   4.141
  720   1HG   ARG 123          2HG       ARG 123  10.581   9.382   2.780
  721   2HG   ARG 123          1HG       ARG 123   8.965  10.064   2.583
  722   1HD   ARG 123          2HD       ARG 123   8.992   9.804   5.240
  723   2HD   ARG 123          1HD       ARG 123  10.724   9.983   4.966
  724    HE   ARG 123           HE       ARG 123   9.130  11.967   3.629
  725   1HH1  ARG 123          1HH1      ARG 123  10.731  11.118   6.612
  726   2HH1  ARG 123          2HH1      ARG 123  10.886  12.759   7.141
  727   1HH2  ARG 123          1HH2      ARG 123   9.333  14.126   4.324
  728   2HH2  ARG 123          2HH2      ARG 123  10.091  14.467   5.843
  729    H    ALA 124           H        ALA 124   9.673   4.913   1.413
  730    HA   ALA 124           HA       ALA 124  12.481   5.162   1.929
  731   1HB   ALA 124          1HB       ALA 124  10.707   3.056   1.736
  732   2HB   ALA 124          2HB       ALA 124  12.457   2.933   1.906
  733   3HB   ALA 124          3HB       ALA 124  11.720   2.875   0.304
  734    H    LEU 125           H        LEU 125  10.945   4.017  -1.061
  735    HA   LEU 125           HA       LEU 125  13.145   4.929  -2.647
  736   1HB   LEU 125          2HB       LEU 125  10.457   3.951  -3.598
  737   2HB   LEU 125          1HB       LEU 125  11.954   3.992  -4.512
  738    HG   LEU 125           HG       LEU 125  11.822   2.369  -2.006
  739   1HD1  LEU 125          1HD1      LEU 125  11.247   0.487  -3.786
  740   2HD1  LEU 125          2HD1      LEU 125  10.396   1.831  -4.544
  741   3HD1  LEU 125          3HD1      LEU 125  10.000   1.356  -2.893
  742   1HD2  LEU 125          1HD2      LEU 125  13.851   2.886  -3.651
  743   2HD2  LEU 125          2HD2      LEU 125  13.163   1.502  -4.501
  744   3HD2  LEU 125          3HD2      LEU 125  13.673   1.341  -2.819
  745    H    LEU 126           H        LEU 126  10.095   6.242  -1.685
  746    HA   LEU 126           HA       LEU 126   9.047   8.214  -2.110
  747   1HB   LEU 126          2HB       LEU 126  11.914   8.817  -2.647
  748   2HB   LEU 126          1HB       LEU 126  10.718  10.012  -3.112
  749    HG   LEU 126           HG       LEU 126  10.945   8.896  -0.321
  750   1HD1  LEU 126          1HD1      LEU 126  12.996  10.018  -0.720
  751   2HD1  LEU 126          2HD1      LEU 126  11.974  11.130   0.191
  752   3HD1  LEU 126          3HD1      LEU 126  12.184  11.348  -1.546
  753   1HD2  LEU 126          1HD2      LEU 126   9.297  10.330   0.277
  754   2HD2  LEU 126          2HD2      LEU 126   8.832  10.118  -1.411
  755   3HD2  LEU 126          3HD2      LEU 126   9.760  11.536  -0.924
  756    H    GLY 127           H        GLY 127   8.791   9.984  -3.959
  757   1HA   GLY 127          2HA       GLY 127   9.320   9.294  -6.628
  758   2HA   GLY 127          1HA       GLY 127   7.749   8.637  -6.193
  759    H    SER 128           H        SER 128   8.045  10.532  -8.198
  760    HA   SER 128           HA       SER 128   6.388  12.661  -7.122
  761   1HB   SER 128          2HB       SER 128   8.643  13.594  -6.916
  762   2HB   SER 128          1HB       SER 128   8.958  13.241  -8.616
  763    HG   SER 128           HG       SER 128   7.724  15.368  -7.524
  764    H    LYS 129           H        LYS 129   4.736  11.737  -8.361
  765    HA   LYS 129           HA       LYS 129   4.539  12.710 -11.022
  766   1HB   LYS 129          2HB       LYS 129   4.305  10.524 -12.160
  767   2HB   LYS 129          1HB       LYS 129   5.933  10.806 -11.559
  768   1HG   LYS 129          2HG       LYS 129   5.360   9.414  -9.570
  769   2HG   LYS 129          1HG       LYS 129   3.831   9.022 -10.358
  770   1HD   LYS 129          2HD       LYS 129   6.580   8.466 -11.472
  771   2HD   LYS 129          1HD       LYS 129   5.514   7.276 -10.723
  772   1HE   LYS 129          2HE       LYS 129   3.864   8.320 -12.593
  773   2HE   LYS 129          1HE       LYS 129   5.419   8.492 -13.405
  774   1HZ   LYS 129          1HZ       LYS 129   4.527   5.942 -12.190
  775   2HZ   LYS 129          2HZ       LYS 129   5.797   6.187 -13.278
  776   3HZ   LYS 129          3HZ       LYS 129   4.196   6.348 -13.799
  777    H    HIS 130           H        HIS 130   2.490  13.314 -11.145
  778    HA   HIS 130           HA       HIS 130   0.434  11.586  -9.933
  779   1HB   HIS 130          2HB       HIS 130   0.820  14.548  -9.736
  780   2HB   HIS 130          1HB       HIS 130  -0.815  13.895  -9.703
  781    HD1  HIS 130           1HD      HIS 130   1.032  15.247  -7.332
  782    HD2  HIS 130           2HD      HIS 130  -0.184  11.296  -7.753
  783    HE1  HIS 130           1HE      HIS 130   1.117  14.267  -5.017
  784    HE2  HIS 130           2HE      HIS 130   0.458  11.854  -5.310
  785    H    LYS 131           H        LYS 131  -0.450  10.624 -11.668
  786    HA   LYS 131           HA       LYS 131  -1.253  12.332 -13.929
  787   1HB   LYS 131          2HB       LYS 131  -0.575   9.395 -13.809
  788   2HB   LYS 131          1HB       LYS 131  -1.375  10.129 -15.192
  789   1HG   LYS 131          2HG       LYS 131   1.293  11.021 -14.123
  790   2HG   LYS 131          1HG       LYS 131   1.085   9.862 -15.439
  791   1HD   LYS 131          2HD       LYS 131  -0.134  11.560 -16.725
  792   2HD   LYS 131          1HD       LYS 131   0.098  12.716 -15.412
  793   1HE   LYS 131          2HE       LYS 131   1.910  13.325 -16.599
  794   2HE   LYS 131          1HE       LYS 131   2.647  11.920 -15.831
  795   1HZ   LYS 131          1HZ       LYS 131   2.620  12.295 -18.454
  796   2HZ   LYS 131          2HZ       LYS 131   1.184  11.416 -18.293
  797   3HZ   LYS 131          3HZ       LYS 131   2.642  10.757 -17.745
  Start of MODEL   18
    1   2H    ALA   1          HN2       ALA   1 -20.205   2.211 -12.856
    2    H    ALA   1           H        ALA   1 -19.195   2.784 -11.593
    3   3H    ALA   1          HN3       ALA   1 -18.518   2.390 -13.116
    4    HA   ALA   1           HA       ALA   1 -19.387   0.098 -12.740
    5   1HB   ALA   1          1HB       ALA   1 -17.073   0.372 -12.700
    6   2HB   ALA   1          2HB       ALA   1 -17.433  -0.379 -11.146
    7   3HB   ALA   1          3HB       ALA   1 -17.119   1.354 -11.236
    8    H    SER   2           H        SER   2 -18.887   1.977  -9.747
    9    HA   SER   2           HA       SER   2 -19.844   1.843  -7.689
   10   1HB   SER   2          2HB       SER   2 -22.128   0.591  -9.236
   11   2HB   SER   2          1HB       SER   2 -22.224   1.186  -7.577
   12    HG   SER   2           HG       SER   2 -21.483   3.257  -8.544
   13    H    MET   3           H        MET   3 -18.674   0.486  -6.470
   14    HA   MET   3           HA       MET   3 -19.665  -2.143  -5.956
   15   1HB   MET   3          2HB       MET   3 -17.257  -1.778  -7.665
   16   2HB   MET   3          1HB       MET   3 -17.205  -3.051  -6.455
   17   1HG   MET   3          2HG       MET   3 -18.232  -4.358  -7.912
   18   2HG   MET   3          1HG       MET   3 -19.671  -3.367  -7.685
   19   1HE   MET   3          1HE       MET   3 -16.452  -1.722  -9.601
   20   2HE   MET   3          2HE       MET   3 -16.534  -2.813 -10.984
   21   3HE   MET   3          3HE       MET   3 -16.278  -3.460  -9.365
   22    H    THR   4           H        THR   4 -16.913   0.065  -5.647
   23    HA   THR   4           HA       THR   4 -17.052   0.002  -2.797
   24    HB   THR   4           HB       THR   4 -15.894  -2.086  -3.006
   25    HG1  THR   4           1HG      THR   4 -14.757  -1.321  -1.428
   26   1HG2  THR   4          1HG2      THR   4 -15.025  -1.493  -5.377
   27   2HG2  THR   4          2HG2      THR   4 -14.086  -2.562  -4.335
   28   3HG2  THR   4          3HG2      THR   4 -13.628  -0.866  -4.503
   29    H    ASP   5           H        ASP   5 -16.562   1.994  -2.188
   30    HA   ASP   5           HA       ASP   5 -14.755   3.580  -3.883
   31   1HB   ASP   5          2HB       ASP   5 -15.864   5.551  -2.714
   32   2HB   ASP   5          1HB       ASP   5 -16.878   4.626  -3.826
   33    H    GLN   6           H        GLN   6 -14.643   1.852  -1.106
   34    HA   GLN   6           HA       GLN   6 -13.546   3.510   0.829
   35   1HB   GLN   6          2HB       GLN   6 -12.564   1.517   1.797
   36   2HB   GLN   6          1HB       GLN   6 -14.176   1.149   1.199
   37   1HG   GLN   6          2HG       GLN   6 -13.077   0.254  -0.880
   38   2HG   GLN   6          1HG       GLN   6 -11.539   0.408  -0.033
   39   1HE2  GLN   6          1HE2      GLN   6 -11.025  -1.021   1.575
   40   2HE2  GLN   6          2HE2      GLN   6 -11.957  -2.433   1.924
   41    H    GLN   7           H        GLN   7 -12.172   2.362  -2.130
   42    HA   GLN   7           HA       GLN   7  -9.438   2.875  -1.403
   43   1HB   GLN   7          2HB       GLN   7 -10.623   2.507  -4.154
   44   2HB   GLN   7          1HB       GLN   7  -8.925   2.388  -3.721
   45   1HG   GLN   7          2HG       GLN   7  -9.490   0.184  -3.809
   46   2HG   GLN   7          1HG       GLN   7  -9.776   0.519  -2.103
   47   1HE2  GLN   7          1HE2      GLN   7 -11.200  -1.256  -2.031
   48   2HE2  GLN   7          2HE2      GLN   7 -12.804  -1.141  -2.660
   49    H    ALA   8           H        ALA   8 -12.068   4.734  -2.568
   50    HA   ALA   8           HA       ALA   8 -10.433   6.794  -3.751
   51   1HB   ALA   8          1HB       ALA   8 -12.404   6.850  -4.862
   52   2HB   ALA   8          2HB       ALA   8 -12.848   7.958  -3.563
   53   3HB   ALA   8          3HB       ALA   8 -13.326   6.263  -3.477
   54    H    GLU   9           H        GLU   9 -12.524   6.500  -0.880
   55    HA   GLU   9           HA       GLU   9 -12.068   9.032   0.194
   56   1HB   GLU   9          2HB       GLU   9 -12.462   6.476   1.763
   57   2HB   GLU   9          1HB       GLU   9 -12.794   8.112   2.317
   58   1HG   GLU   9          2HG       GLU   9 -14.194   7.309  -0.139
   59   2HG   GLU   9          1HG       GLU   9 -14.653   6.431   1.325
   60    H    ALA  10           H        ALA  10 -10.230   6.051   0.451
   61    HA   ALA  10           HA       ALA  10  -8.417   6.515   2.409
   62   1HB   ALA  10          1HB       ALA  10  -6.809   5.436   0.507
   63   2HB   ALA  10          2HB       ALA  10  -8.409   5.049  -0.133
   64   3HB   ALA  10          3HB       ALA  10  -7.951   4.520   1.489
   65    H    ARG  11           H        ARG  11  -7.909   7.477  -0.989
   66    HA   ARG  11           HA       ARG  11  -5.550   8.881  -0.657
   67   1HB   ARG  11          2HB       ARG  11  -7.581   8.620  -2.692
   68   2HB   ARG  11          1HB       ARG  11  -7.006  10.281  -2.617
   69   1HG   ARG  11          2HG       ARG  11  -4.689   9.449  -2.830
   70   2HG   ARG  11          1HG       ARG  11  -5.327   7.814  -3.019
   71   1HD   ARG  11          2HD       ARG  11  -4.817   8.827  -5.183
   72   2HD   ARG  11          1HD       ARG  11  -6.542   8.507  -5.015
   73    HE   ARG  11           HE       ARG  11  -6.943  10.762  -5.113
   74   1HH1  ARG  11          1HH1      ARG  11  -3.533  10.231  -4.591
   75   2HH1  ARG  11          2HH1      ARG  11  -3.109  11.892  -4.838
   76   1HH2  ARG  11          1HH2      ARG  11  -6.386  12.947  -5.437
   77   2HH2  ARG  11          2HH2      ARG  11  -4.729  13.434  -5.318
   78    H    ALA  12           H        ALA  12  -8.774   9.777   0.224
   79    HA   ALA  12           HA       ALA  12  -7.996  12.559   0.682
   80   1HB   ALA  12          1HB       ALA  12 -10.365  12.965   1.092
   81   2HB   ALA  12          2HB       ALA  12 -10.697  11.240   0.936
   82   3HB   ALA  12          3HB       ALA  12 -10.120  12.157  -0.456
   83    H    PHE  13           H        PHE  13  -8.414   9.593   2.369
   84    HA   PHE  13           HA       PHE  13  -8.958  10.762   4.938
   85   1HB   PHE  13          2HB       PHE  13  -9.071   8.185   3.830
   86   2HB   PHE  13          1HB       PHE  13  -7.836   8.100   5.088
   87    HD1  PHE  13           1HD      PHE  13  -8.419   8.668   7.423
   88    HD2  PHE  13           2HD      PHE  13 -11.366   8.397   4.366
   89    HE1  PHE  13           1HE      PHE  13 -10.175   8.499   9.138
   90    HE2  PHE  13           2HE      PHE  13 -13.128   8.228   6.075
   91    HZ   PHE  13           HZ       PHE  13 -12.534   8.279   8.465
   92    H    LEU  14           H        LEU  14  -6.135  10.020   3.082
   93    HA   LEU  14           HA       LEU  14  -4.426  10.477   5.429
   94   1HB   LEU  14          2HB       LEU  14  -3.646   9.387   2.723
   95   2HB   LEU  14          1HB       LEU  14  -2.624   9.473   4.154
   96    HG   LEU  14           HG       LEU  14  -5.162   7.856   4.115
   97   1HD1  LEU  14          1HD1      LEU  14  -2.395   6.869   3.443
   98   2HD1  LEU  14          2HD1      LEU  14  -3.690   7.121   2.271
   99   3HD1  LEU  14          3HD1      LEU  14  -3.870   5.908   3.539
  100   1HD2  LEU  14          1HD2      LEU  14  -4.209   6.748   5.993
  101   2HD2  LEU  14          2HD2      LEU  14  -4.059   8.481   6.277
  102   3HD2  LEU  14          3HD2      LEU  14  -2.655   7.548   5.756
  103    H    SER  15           H        SER  15  -2.452  11.761   5.063
  104    HA   SER  15           HA       SER  15  -3.112  14.238   3.749
  105   1HB   SER  15          2HB       SER  15  -1.673  13.680   5.970
  106   2HB   SER  15          1HB       SER  15  -0.360  13.825   4.790
  107    HG   SER  15           HG       SER  15  -0.659  15.900   4.782
  108    H    GLU  16           H        GLU  16  -1.565  15.322   2.273
  109    HA   GLU  16           HA       GLU  16  -1.099  13.905  -0.048
  110   1HB   GLU  16          2HB       GLU  16  -0.079  16.466   1.068
  111   2HB   GLU  16          1HB       GLU  16   0.794  15.789  -0.302
  112   1HG   GLU  16          2HG       GLU  16  -1.205  15.805  -1.642
  113   2HG   GLU  16          1HG       GLU  16  -2.164  16.340  -0.263
  114    H    GLU  17           H        GLU  17   0.807  14.104   2.834
  115    HA   GLU  17           HA       GLU  17   3.293  13.241   1.874
  116   1HB   GLU  17          2HB       GLU  17   1.920  13.376   4.496
  117   2HB   GLU  17          1HB       GLU  17   3.252  12.231   4.385
  118   1HG   GLU  17          2HG       GLU  17   4.446  14.031   5.018
  119   2HG   GLU  17          1HG       GLU  17   4.436  14.354   3.286
  120    H    MET  18           H        MET  18   0.688  11.361   3.420
  121    HA   MET  18           HA       MET  18   1.852   8.842   3.060
  122   1HB   MET  18          2HB       MET  18  -0.450   9.825   4.241
  123   2HB   MET  18          1HB       MET  18  -1.067   8.820   2.930
  124   1HG   MET  18          2HG       MET  18  -0.953   7.367   4.728
  125   2HG   MET  18          1HG       MET  18   0.522   7.020   3.829
  126   1HE   MET  18          1HE       MET  18  -0.338   6.773   7.392
  127   2HE   MET  18          2HE       MET  18   1.388   6.497   7.640
  128   3HE   MET  18          3HE       MET  18   0.567   5.768   6.260
  129    H    ILE  19           H        ILE  19   0.327  10.935   0.798
  130    HA   ILE  19           HA       ILE  19  -0.313   8.822  -1.087
  131    HB   ILE  19           HB       ILE  19  -0.554  11.822  -1.202
  132   1HG1  ILE  19          2HG1      ILE  19  -2.613   9.614  -1.426
  133   2HG1  ILE  19          1HG1      ILE  19  -2.258  10.515   0.050
  134   1HG2  ILE  19          1HG2      ILE  19  -0.451   9.906  -3.426
  135   2HG2  ILE  19          2HG2      ILE  19  -0.201  11.653  -3.414
  136   3HG2  ILE  19          3HG2      ILE  19  -1.839  10.996  -3.445
  137   1HD1  ILE  19          1HD1      ILE  19  -3.637  12.133  -0.552
  138   2HD1  ILE  19          2HD1      ILE  19  -4.120  11.143  -1.930
  139   3HD1  ILE  19          3HD1      ILE  19  -2.821  12.323  -2.104
  140    H    ALA  20           H        ALA  20   1.679  11.779  -1.320
  141    HA   ALA  20           HA       ALA  20   3.080  11.169  -3.598
  142   1HB   ALA  20          1HB       ALA  20   3.176  13.327  -2.417
  143   2HB   ALA  20          2HB       ALA  20   4.777  12.720  -2.846
  144   3HB   ALA  20          3HB       ALA  20   4.199  12.587  -1.184
  145    H    GLU  21           H        GLU  21   3.433   9.807  -0.437
  146    HA   GLU  21           HA       GLU  21   5.970   8.543  -1.052
  147   1HB   GLU  21          2HB       GLU  21   4.202   8.257   1.386
  148   2HB   GLU  21          1HB       GLU  21   5.853   7.681   1.228
  149   1HG   GLU  21          2HG       GLU  21   6.748   9.815   1.323
  150   2HG   GLU  21          1HG       GLU  21   5.220  10.579   0.887
  151    H    PHE  22           H        PHE  22   2.561   7.815  -0.888
  152    HA   PHE  22           HA       PHE  22   2.672   5.011  -0.871
  153   1HB   PHE  22          2HB       PHE  22   0.462   5.378  -0.714
  154   2HB   PHE  22          1HB       PHE  22   0.674   7.049  -1.213
  155    HD1  PHE  22           1HD      PHE  22   0.856   7.468  -3.768
  156    HD2  PHE  22           2HD      PHE  22  -0.737   3.921  -2.044
  157    HE1  PHE  22           1HE      PHE  22  -0.334   6.987  -5.866
  158    HE2  PHE  22           2HE      PHE  22  -1.929   3.432  -4.139
  159    HZ   PHE  22           HZ       PHE  22  -1.729   4.967  -6.054
  160    H    LYS  23           H        LYS  23   2.990   7.372  -3.419
  161    HA   LYS  23           HA       LYS  23   2.889   5.513  -5.581
  162   1HB   LYS  23          2HB       LYS  23   2.394   7.985  -5.724
  163   2HB   LYS  23          1HB       LYS  23   4.131   8.265  -5.581
  164   1HG   LYS  23          2HG       LYS  23   3.392   6.347  -7.661
  165   2HG   LYS  23          1HG       LYS  23   2.775   7.978  -7.920
  166   1HD   LYS  23          2HD       LYS  23   5.432   8.293  -7.080
  167   2HD   LYS  23          1HD       LYS  23   5.450   6.956  -8.239
  168   1HE   LYS  23          2HE       LYS  23   4.614   8.281  -9.961
  169   2HE   LYS  23          1HE       LYS  23   3.983   9.497  -8.850
  170   1HZ   LYS  23          1HZ       LYS  23   5.862  10.481  -9.750
  171   2HZ   LYS  23          2HZ       LYS  23   6.772   9.056  -9.705
  172   3HZ   LYS  23          3HZ       LYS  23   6.429   9.883  -8.271
  173    H    ALA  24           H        ALA  24   5.259   6.383  -3.298
  174    HA   ALA  24           HA       ALA  24   7.676   6.264  -4.536
  175   1HB   ALA  24          1HB       ALA  24   6.932   4.945  -1.930
  176   2HB   ALA  24          2HB       ALA  24   7.455   6.613  -2.156
  177   3HB   ALA  24          3HB       ALA  24   8.577   5.287  -2.465
  178    H    ALA  25           H        ALA  25   6.583   3.317  -2.896
  179    HA   ALA  25           HA       ALA  25   8.167   1.668  -4.598
  180   1HB   ALA  25          1HB       ALA  25   7.135  -0.197  -3.306
  181   2HB   ALA  25          2HB       ALA  25   6.151   1.001  -2.466
  182   3HB   ALA  25          3HB       ALA  25   7.908   1.039  -2.312
  183    H    PHE  26           H        PHE  26   5.239   3.091  -5.202
  184    HA   PHE  26           HA       PHE  26   3.585   1.143  -6.232
  185   1HB   PHE  26          2HB       PHE  26   3.249   3.701  -6.066
  186   2HB   PHE  26          1HB       PHE  26   3.975   3.755  -7.667
  187    HD1  PHE  26           1HD      PHE  26   1.142   2.405  -5.718
  188    HD2  PHE  26           2HD      PHE  26   2.734   3.194  -9.585
  189    HE1  PHE  26           1HE      PHE  26  -1.046   1.896  -6.717
  190    HE2  PHE  26           2HE      PHE  26   0.546   2.688 -10.593
  191    HZ   PHE  26           HZ       PHE  26  -1.347   2.039  -9.159
  192    H    ASP  27           H        ASP  27   6.591   2.322  -7.509
  193    HA   ASP  27           HA       ASP  27   6.162   1.176 -10.132
  194   1HB   ASP  27          2HB       ASP  27   7.506   3.270  -9.738
  195   2HB   ASP  27          1HB       ASP  27   8.734   2.263  -8.976
  196    H    MET  28           H        MET  28   8.613   0.655  -7.587
  197    HA   MET  28           HA       MET  28   9.648  -1.717  -8.627
  198   1HB   MET  28          2HB       MET  28   9.696  -0.359  -5.992
  199   2HB   MET  28          1HB       MET  28  10.100  -2.070  -5.997
  200   1HG   MET  28          2HG       MET  28  12.173  -1.289  -6.353
  201   2HG   MET  28          1HG       MET  28  11.632  -1.249  -8.035
  202   1HE   MET  28          1HE       MET  28  13.881   0.107  -6.346
  203   2HE   MET  28          2HE       MET  28  13.840   1.870  -6.352
  204   3HE   MET  28          3HE       MET  28  14.035   0.987  -7.867
  205    H    PHE  29           H        PHE  29   6.753  -1.125  -6.811
  206    HA   PHE  29           HA       PHE  29   6.254  -3.623  -5.705
  207   1HB   PHE  29          2HB       PHE  29   4.600  -1.308  -6.541
  208   2HB   PHE  29          1HB       PHE  29   3.749  -2.842  -6.341
  209    HD1  PHE  29           1HD      PHE  29   4.134   0.027  -4.734
  210    HD2  PHE  29           2HD      PHE  29   5.013  -4.084  -4.087
  211    HE1  PHE  29           1HE      PHE  29   4.053   0.397  -2.305
  212    HE2  PHE  29           2HE      PHE  29   4.933  -3.719  -1.656
  213    HZ   PHE  29           HZ       PHE  29   4.453  -1.481  -0.763
  214    H    ASP  30           H        ASP  30   4.747  -2.426  -8.709
  215    HA   ASP  30           HA       ASP  30   3.813  -4.903  -9.571
  216   1HB   ASP  30          2HB       ASP  30   4.406  -2.321 -10.985
  217   2HB   ASP  30          1HB       ASP  30   3.899  -3.746 -11.898
  218    H    ALA  31           H        ALA  31   4.846  -6.637 -10.215
  219    HA   ALA  31           HA       ALA  31   7.637  -6.451 -11.054
  220   1HB   ALA  31          1HB       ALA  31   7.706  -8.858 -10.740
  221   2HB   ALA  31          2HB       ALA  31   5.965  -8.889 -10.457
  222   3HB   ALA  31          3HB       ALA  31   7.030  -8.074  -9.312
  223    H    ASP  32           H        ASP  32   4.563  -7.829 -12.177
  224    HA   ASP  32           HA       ASP  32   5.714  -8.324 -14.811
  225   1HB   ASP  32          2HB       ASP  32   3.547  -9.432 -15.291
  226   2HB   ASP  32          1HB       ASP  32   4.350 -10.103 -13.868
  227    H    GLY  33           H        GLY  33   3.648  -6.088 -13.164
  228   1HA   GLY  33          2HA       GLY  33   2.718  -4.105 -13.855
  229   2HA   GLY  33          1HA       GLY  33   3.688  -4.245 -15.314
  230    H    GLY  34           H        GLY  34   0.845  -5.827 -13.844
  231   1HA   GLY  34          2HA       GLY  34  -0.764  -5.196 -16.152
  232   2HA   GLY  34          1HA       GLY  34  -0.343  -6.905 -16.040
  233    H    GLY  35           H        GLY  35  -0.447  -7.233 -13.261
  234   1HA   GLY  35          2HA       GLY  35  -3.353  -7.120 -12.886
  235   2HA   GLY  35          1HA       GLY  35  -2.235  -8.163 -12.010
  236    H    ASP  36           H        ASP  36  -1.510  -7.532 -10.063
  237    HA   ASP  36           HA       ASP  36  -1.477  -4.765  -9.267
  238   1HB   ASP  36          2HB       ASP  36  -3.607  -6.640  -8.325
  239   2HB   ASP  36          1HB       ASP  36  -2.970  -5.438  -7.197
  240    H    ILE  37           H        ILE  37  -1.213  -4.877  -6.629
  241    HA   ILE  37           HA       ILE  37   1.254  -6.340  -6.291
  242    HB   ILE  37           HB       ILE  37  -0.208  -4.513  -4.382
  243   1HG1  ILE  37          2HG1      ILE  37   2.139  -4.015  -6.226
  244   2HG1  ILE  37          1HG1      ILE  37   0.510  -3.354  -6.406
  245   1HG2  ILE  37          1HG2      ILE  37   1.284  -5.005  -2.818
  246   2HG2  ILE  37          2HG2      ILE  37   2.623  -4.741  -3.934
  247   3HG2  ILE  37          3HG2      ILE  37   1.851  -6.322  -3.842
  248   1HD1  ILE  37          1HD1      ILE  37   2.224  -1.790  -5.466
  249   2HD1  ILE  37          2HD1      ILE  37   2.259  -2.807  -4.025
  250   3HD1  ILE  37          3HD1      ILE  37   0.769  -1.988  -4.491
  251    H    SER  38           H        SER  38   1.293  -8.365  -5.604
  252    HA   SER  38           HA       SER  38  -0.932  -9.394  -4.004
  253   1HB   SER  38          2HB       SER  38  -0.252 -11.581  -4.663
  254   2HB   SER  38          1HB       SER  38  -0.129 -10.576  -6.113
  255    HG   SER  38           HG       SER  38   1.949 -10.894  -6.137
  256    H    THR  39           H        THR  39   0.351 -11.525  -2.757
  257    HA   THR  39           HA       THR  39   1.396 -10.258  -0.448
  258    HB   THR  39           HB       THR  39   1.934 -12.657   0.234
  259    HG1  THR  39           1HG      THR  39   2.022 -13.346  -2.043
  260   1HG2  THR  39          1HG2      THR  39  -0.847 -11.876  -0.571
  261   2HG2  THR  39          2HG2      THR  39  -0.109 -11.813   1.030
  262   3HG2  THR  39          3HG2      THR  39  -0.481 -13.371   0.291
  263    H    LYS  40           H        LYS  40   2.863 -11.672  -3.274
  264    HA   LYS  40           HA       LYS  40   5.505 -11.782  -2.117
  265   1HB   LYS  40          2HB       LYS  40   4.372 -12.309  -4.850
  266   2HB   LYS  40          1HB       LYS  40   6.116 -12.196  -4.606
  267   1HG   LYS  40          2HG       LYS  40   5.547 -13.931  -2.665
  268   2HG   LYS  40          1HG       LYS  40   4.205 -14.292  -3.760
  269   1HD   LYS  40          2HD       LYS  40   7.073 -14.175  -4.671
  270   2HD   LYS  40          1HD       LYS  40   6.319 -15.656  -4.079
  271   1HE   LYS  40          2HE       LYS  40   4.830 -15.757  -5.868
  272   2HE   LYS  40          1HE       LYS  40   5.047 -14.053  -6.266
  273   1HZ   LYS  40          1HZ       LYS  40   6.301 -15.010  -7.884
  274   2HZ   LYS  40          2HZ       LYS  40   6.728 -16.351  -6.945
  275   3HZ   LYS  40          3HZ       LYS  40   7.492 -14.864  -6.692
  276    H    GLU  41           H        GLU  41   3.792  -9.735  -4.451
  277    HA   GLU  41           HA       GLU  41   5.906  -8.090  -5.207
  278   1HB   GLU  41          2HB       GLU  41   2.954  -7.517  -4.957
  279   2HB   GLU  41          1HB       GLU  41   4.095  -6.374  -5.652
  280   1HG   GLU  41          2HG       GLU  41   4.657  -8.652  -7.044
  281   2HG   GLU  41          1HG       GLU  41   2.918  -8.790  -6.792
  282    H    LEU  42           H        LEU  42   4.184  -8.234  -2.219
  283    HA   LEU  42           HA       LEU  42   4.889  -5.578  -1.373
  284   1HB   LEU  42          2HB       LEU  42   3.020  -7.453  -0.574
  285   2HB   LEU  42          1HB       LEU  42   4.181  -7.446   0.749
  286    HG   LEU  42           HG       LEU  42   2.403  -5.890   1.235
  287   1HD1  LEU  42          1HD1      LEU  42   4.539  -5.217   2.054
  288   2HD1  LEU  42          2HD1      LEU  42   3.728  -3.781   1.431
  289   3HD1  LEU  42          3HD1      LEU  42   4.997  -4.557   0.483
  290   1HD2  LEU  42          1HD2      LEU  42   2.189  -3.843  -0.262
  291   2HD2  LEU  42          2HD2      LEU  42   1.498  -5.350  -0.863
  292   3HD2  LEU  42          3HD2      LEU  42   3.050  -4.782  -1.480
  293    H    GLY  43           H        GLY  43   5.805  -8.829  -0.204
  294   1HA   GLY  43          2HA       GLY  43   7.779  -8.098   1.576
  295   2HA   GLY  43          1HA       GLY  43   7.793  -9.603   0.658
  296    H    THR  44           H        THR  44   7.911  -8.047  -1.895
  297    HA   THR  44           HA       THR  44  10.664  -8.129  -2.319
  298    HB   THR  44           HB       THR  44   8.320  -7.030  -3.797
  299    HG1  THR  44           1HG      THR  44  10.379  -8.892  -4.313
  300   1HG2  THR  44          1HG2      THR  44  10.020  -6.508  -5.689
  301   2HG2  THR  44          2HG2      THR  44  11.134  -6.217  -4.353
  302   3HG2  THR  44          3HG2      THR  44   9.643  -5.281  -4.478
  303    H    VAL  45           H        VAL  45   8.831  -5.121  -2.661
  304    HA   VAL  45           HA       VAL  45  11.033  -3.444  -2.233
  305    HB   VAL  45           HB       VAL  45   9.052  -2.699  -3.425
  306   1HG1  VAL  45          1HG1      VAL  45   7.233  -3.704  -2.414
  307   2HG1  VAL  45          2HG1      VAL  45   7.057  -2.018  -1.924
  308   3HG1  VAL  45          3HG1      VAL  45   7.720  -3.199  -0.795
  309   1HG2  VAL  45          1HG2      VAL  45   8.810  -0.781  -1.266
  310   2HG2  VAL  45          2HG2      VAL  45   9.480  -0.582  -2.885
  311   3HG2  VAL  45          3HG2      VAL  45  10.492  -1.208  -1.583
  312    H    MET  46           H        MET  46   8.791  -4.906   0.004
  313    HA   MET  46           HA       MET  46   9.347  -3.162   2.192
  314   1HB   MET  46          2HB       MET  46   7.891  -5.725   1.808
  315   2HB   MET  46          1HB       MET  46   8.423  -5.338   3.444
  316   1HG   MET  46          2HG       MET  46   6.688  -3.603   1.696
  317   2HG   MET  46          1HG       MET  46   6.135  -4.611   3.037
  318   1HE   MET  46          1HE       MET  46   5.670  -2.843   5.562
  319   2HE   MET  46          2HE       MET  46   4.920  -3.028   3.977
  320   3HE   MET  46          3HE       MET  46   5.373  -1.425   4.556
  321    H    ARG  47           H        ARG  47  10.795  -6.095   0.959
  322    HA   ARG  47           HA       ARG  47  12.412  -6.484   3.331
  323   1HB   ARG  47          2HB       ARG  47  12.222  -7.923   0.694
  324   2HB   ARG  47          1HB       ARG  47  13.459  -8.310   1.880
  325   1HG   ARG  47          2HG       ARG  47  11.855  -9.025   3.462
  326   2HG   ARG  47          1HG       ARG  47  10.524  -8.346   2.521
  327   1HD   ARG  47          2HD       ARG  47  10.886  -9.971   0.767
  328   2HD   ARG  47          1HD       ARG  47  12.306 -10.604   1.609
  329    HE   ARG  47           HE       ARG  47   9.573 -11.247   2.126
  330   1HH1  ARG  47          1HH1      ARG  47  12.705 -10.909   3.627
  331   2HH1  ARG  47          2HH1      ARG  47  12.348 -12.014   4.911
  332   1HH2  ARG  47          1HH2      ARG  47   9.101 -12.700   3.814
  333   2HH2  ARG  47          2HH2      ARG  47  10.301 -13.031   5.019
  334    H    MET  48           H        MET  48  12.755  -5.076   0.147
  335    HA   MET  48           HA       MET  48  15.638  -4.822   0.452
  336   1HB   MET  48          2HB       MET  48  15.595  -3.848  -1.791
  337   2HB   MET  48          1HB       MET  48  14.745  -5.393  -1.750
  338   1HG   MET  48          2HG       MET  48  12.869  -4.468  -2.471
  339   2HG   MET  48          1HG       MET  48  12.936  -3.214  -1.235
  340   1HE   MET  48          1HE       MET  48  12.383  -1.029  -2.170
  341   2HE   MET  48          2HE       MET  48  11.583  -1.949  -3.443
  342   3HE   MET  48          3HE       MET  48  12.601  -0.569  -3.858
  343    H    LEU  49           H        LEU  49  13.299  -3.276   1.925
  344    HA   LEU  49           HA       LEU  49  14.542  -0.625   1.607
  345   1HB   LEU  49          2HB       LEU  49  11.694  -1.433   2.019
  346   2HB   LEU  49          1HB       LEU  49  12.246   0.118   2.624
  347    HG   LEU  49           HG       LEU  49  12.337  -0.798  -0.248
  348   1HD1  LEU  49          1HD1      LEU  49  10.121  -0.278   0.155
  349   2HD1  LEU  49          2HD1      LEU  49  10.775   1.250  -0.428
  350   3HD1  LEU  49          3HD1      LEU  49  10.518   1.000   1.300
  351   1HD2  LEU  49          1HD2      LEU  49  12.861   1.750  -0.492
  352   2HD2  LEU  49          2HD2      LEU  49  14.155   0.608  -0.131
  353   3HD2  LEU  49          3HD2      LEU  49  13.454   1.583   1.160
  354    H    GLY  50           H        GLY  50  13.143  -2.950   3.868
  355   1HA   GLY  50          2HA       GLY  50  14.912  -2.733   5.900
  356   2HA   GLY  50          1HA       GLY  50  13.854  -1.351   6.174
  357    H    GLN  51           H        GLN  51  11.455  -2.654   5.234
  358    HA   GLN  51           HA       GLN  51  10.644  -3.874   7.660
  359   1HB   GLN  51          2HB       GLN  51   9.340  -2.679   5.586
  360   2HB   GLN  51          1HB       GLN  51   8.972  -4.378   5.283
  361   1HG   GLN  51          2HG       GLN  51   7.210  -3.592   6.602
  362   2HG   GLN  51          1HG       GLN  51   8.243  -4.493   7.712
  363   1HE2  GLN  51          1HE2      GLN  51   6.390  -1.902   7.590
  364   2HE2  GLN  51          2HE2      GLN  51   7.230  -0.835   8.657
  365    H    ASN  52           H        ASN  52   9.687  -6.034   7.857
  366    HA   ASN  52           HA       ASN  52  10.710  -8.031   5.991
  367   1HB   ASN  52          2HB       ASN  52  12.361  -7.603   7.918
  368   2HB   ASN  52          1HB       ASN  52  11.163  -8.396   8.943
  369   1HD2  ASN  52          1HD2      ASN  52  11.109 -10.550   9.008
  370   2HD2  ASN  52          2HD2      ASN  52  12.045 -11.597   8.003
  371    HA   PRO  53           HA       PRO  53   6.473  -8.830   7.966
  372   1HB   PRO  53          2HB       PRO  53   4.926  -8.394   5.790
  373   2HB   PRO  53          1HB       PRO  53   5.368  -7.104   6.914
  374   1HG   PRO  53          2HG       PRO  53   6.576  -7.800   4.263
  375   2HG   PRO  53          1HG       PRO  53   6.161  -6.205   4.917
  376   1HD   PRO  53          2HD       PRO  53   8.690  -7.180   4.938
  377   2HD   PRO  53          1HD       PRO  53   8.071  -6.093   6.203
  378    H    THR  54           H        THR  54   6.523 -10.992   8.130
  379    HA   THR  54           HA       THR  54   7.380 -12.804   6.204
  380    HB   THR  54           HB       THR  54   6.074 -14.499   7.560
  381    HG1  THR  54           1HG      THR  54   4.473 -13.590   8.585
  382   1HG2  THR  54          1HG2      THR  54   8.390 -13.145   8.233
  383   2HG2  THR  54          2HG2      THR  54   7.798 -14.649   8.938
  384   3HG2  THR  54          3HG2      THR  54   7.413 -13.106   9.700
  385    H    LYS  55           H        LYS  55   5.849 -14.663   5.431
  386    HA   LYS  55           HA       LYS  55   4.208 -13.633   3.421
  387   1HB   LYS  55          2HB       LYS  55   5.272 -15.902   3.447
  388   2HB   LYS  55          1HB       LYS  55   4.045 -16.408   4.609
  389   1HG   LYS  55          2HG       LYS  55   3.037 -17.130   2.720
  390   2HG   LYS  55          1HG       LYS  55   2.434 -15.471   2.710
  391   1HD   LYS  55          2HD       LYS  55   5.045 -15.800   1.424
  392   2HD   LYS  55          1HD       LYS  55   3.739 -16.693   0.638
  393   1HE   LYS  55          2HE       LYS  55   2.413 -14.523   0.740
  394   2HE   LYS  55          1HE       LYS  55   3.937 -13.737   1.151
  395   1HZ   LYS  55          1HZ       LYS  55   3.814 -13.526  -1.136
  396   2HZ   LYS  55          2HZ       LYS  55   3.166 -15.071  -1.364
  397   3HZ   LYS  55          3HZ       LYS  55   4.798 -14.892  -0.955
  398    H    CYS  56           H        CYS  56   3.319 -15.137   6.519
  399    HA   CYS  56           HA       CYS  56   0.539 -14.922   6.212
  400   1HB   CYS  56          2HB       CYS  56   2.399 -15.314   8.503
  401   2HB   CYS  56          1HB       CYS  56   0.746 -14.819   8.875
  402    HG   CYS  56           HG       CYS  56   0.614 -17.339   8.870
  403    H    GLU  57           H        GLU  57   2.945 -12.662   7.426
  404    HA   GLU  57           HA       GLU  57   1.254 -10.768   8.581
  405   1HB   GLU  57          2HB       GLU  57   3.981 -10.999   8.100
  406   2HB   GLU  57          1HB       GLU  57   3.513  -9.567   7.182
  407   1HG   GLU  57          2HG       GLU  57   2.582  -8.557   9.165
  408   2HG   GLU  57          1HG       GLU  57   2.910 -10.014  10.098
  409    H    LEU  58           H        LEU  58   2.703 -10.651   5.323
  410    HA   LEU  58           HA       LEU  58   1.114  -8.488   4.445
  411   1HB   LEU  58          2HB       LEU  58   2.387 -10.577   2.682
  412   2HB   LEU  58          1HB       LEU  58   1.997  -8.913   2.266
  413    HG   LEU  58           HG       LEU  58   3.947  -9.434   4.473
  414   1HD1  LEU  58          1HD1      LEU  58   4.481  -9.729   1.530
  415   2HD1  LEU  58          2HD1      LEU  58   4.874 -10.848   2.835
  416   3HD1  LEU  58          3HD1      LEU  58   5.746  -9.321   2.690
  417   1HD2  LEU  58          1HD2      LEU  58   4.933  -7.356   3.242
  418   2HD2  LEU  58          2HD2      LEU  58   3.525  -7.177   4.290
  419   3HD2  LEU  58          3HD2      LEU  58   3.318  -7.247   2.540
  420    H    ASP  59           H        ASP  59   0.651 -11.951   4.438
  421    HA   ASP  59           HA       ASP  59  -1.558 -11.972   2.632
  422   1HB   ASP  59          2HB       ASP  59  -0.173 -13.975   3.076
  423   2HB   ASP  59          1HB       ASP  59  -0.785 -14.011   4.731
  424    H    ALA  60           H        ALA  60  -1.180 -11.324   6.006
  425    HA   ALA  60           HA       ALA  60  -3.931 -11.764   6.676
  426   1HB   ALA  60          1HB       ALA  60  -3.382 -11.090   8.844
  427   2HB   ALA  60          2HB       ALA  60  -2.037 -10.092   8.293
  428   3HB   ALA  60          3HB       ALA  60  -1.905 -11.850   8.254
  429    H    ILE  61           H        ILE  61  -1.981  -9.087   5.580
  430    HA   ILE  61           HA       ILE  61  -3.978  -7.092   6.135
  431    HB   ILE  61           HB       ILE  61  -1.332  -7.071   4.710
  432   1HG1  ILE  61          2HG1      ILE  61  -1.291  -5.052   6.515
  433   2HG1  ILE  61          1HG1      ILE  61  -2.446  -6.140   7.289
  434   1HG2  ILE  61          1HG2      ILE  61  -2.349  -5.580   3.306
  435   2HG2  ILE  61          2HG2      ILE  61  -1.838  -4.500   4.603
  436   3HG2  ILE  61          3HG2      ILE  61  -3.511  -5.053   4.525
  437   1HD1  ILE  61          1HD1      ILE  61  -0.878  -7.777   7.625
  438   2HD1  ILE  61          2HD1      ILE  61   0.096  -6.318   7.810
  439   3HD1  ILE  61          3HD1      ILE  61   0.144  -7.225   6.298
  440    H    ILE  62           H        ILE  62  -2.529  -8.327   3.107
  441    HA   ILE  62           HA       ILE  62  -4.179  -7.184   1.257
  442    HB   ILE  62           HB       ILE  62  -3.074  -9.992   1.213
  443   1HG1  ILE  62          2HG1      ILE  62  -2.068  -7.366   0.098
  444   2HG1  ILE  62          1HG1      ILE  62  -1.344  -8.305   1.406
  445   1HG2  ILE  62          1HG2      ILE  62  -4.206 -10.343  -0.664
  446   2HG2  ILE  62          2HG2      ILE  62  -3.365  -8.980  -1.402
  447   3HG2  ILE  62          3HG2      ILE  62  -4.904  -8.725  -0.584
  448   1HD1  ILE  62          1HD1      ILE  62  -0.514  -9.901  -0.036
  449   2HD1  ILE  62          2HD1      ILE  62  -0.322  -8.412  -0.959
  450   3HD1  ILE  62          3HD1      ILE  62  -1.663  -9.500  -1.311
  451    H    CYS  63           H        CYS  63  -4.813 -10.137   3.118
  452    HA   CYS  63           HA       CYS  63  -7.209 -10.889   1.903
  453   1HB   CYS  63          2HB       CYS  63  -5.789 -12.137   3.665
  454   2HB   CYS  63          1HB       CYS  63  -6.712 -11.216   4.857
  455    HG   CYS  63           HG       CYS  63  -7.847 -13.466   3.065
  456    H    GLU  64           H        GLU  64  -6.519  -8.481   4.345
  457    HA   GLU  64           HA       GLU  64  -9.326  -7.936   4.832
  458   1HB   GLU  64          2HB       GLU  64  -7.434  -7.770   6.567
  459   2HB   GLU  64          1HB       GLU  64  -7.006  -6.259   5.774
  460   1HG   GLU  64          2HG       GLU  64  -8.873  -5.177   6.518
  461   2HG   GLU  64          1HG       GLU  64  -9.823  -6.659   6.630
  462    H    VAL  65           H        VAL  65  -6.606  -6.562   3.089
  463    HA   VAL  65           HA       VAL  65  -7.801  -4.093   2.401
  464    HB   VAL  65           HB       VAL  65  -5.693  -5.637   0.874
  465   1HG1  VAL  65          1HG1      VAL  65  -6.825  -3.829  -0.401
  466   2HG1  VAL  65          2HG1      VAL  65  -5.104  -3.543  -0.145
  467   3HG1  VAL  65          3HG1      VAL  65  -6.294  -2.683   0.830
  468   1HG2  VAL  65          1HG2      VAL  65  -4.878  -5.295   3.083
  469   2HG2  VAL  65          2HG2      VAL  65  -5.460  -3.634   3.113
  470   3HG2  VAL  65          3HG2      VAL  65  -4.114  -4.077   2.065
  471    H    ASP  66           H        ASP  66  -7.498  -7.159   0.630
  472    HA   ASP  66           HA       ASP  66  -9.027  -6.304  -1.605
  473   1HB   ASP  66          2HB       ASP  66  -8.077  -8.981  -0.616
  474   2HB   ASP  66          1HB       ASP  66  -9.151  -8.859  -2.007
  475    H    GLU  67           H        GLU  67 -11.110  -5.791  -1.466
  476    HA   GLU  67           HA       GLU  67 -12.836  -7.287   0.373
  477   1HB   GLU  67          2HB       GLU  67 -13.000  -4.577  -0.896
  478   2HB   GLU  67          1HB       GLU  67 -14.477  -5.375  -0.356
  479   1HG   GLU  67          2HG       GLU  67 -12.133  -5.069   1.482
  480   2HG   GLU  67          1HG       GLU  67 -13.284  -3.750   1.238
  481    H    ASP  68           H        ASP  68 -11.907  -8.372  -2.166
  482    HA   ASP  68           HA       ASP  68 -14.532  -8.910  -3.352
  483   1HB   ASP  68          2HB       ASP  68 -13.624  -8.769  -5.614
  484   2HB   ASP  68          1HB       ASP  68 -13.417  -7.233  -4.779
  485    H    GLY  69           H        GLY  69 -11.109  -9.845  -3.193
  486   1HA   GLY  69          2HA       GLY  69 -10.705 -12.147  -2.366
  487   2HA   GLY  69          1HA       GLY  69 -11.975 -12.658  -3.468
  488    H    SER  70           H        SER  70  -9.316 -10.384  -4.018
  489    HA   SER  70           HA       SER  70  -8.429 -12.103  -6.236
  490   1HB   SER  70          2HB       SER  70  -7.234  -9.765  -6.806
  491   2HB   SER  70          1HB       SER  70  -8.882 -10.141  -7.326
  492    HG   SER  70           HG       SER  70  -7.989  -8.432  -5.300
  493    H    GLY  71           H        GLY  71  -7.466 -10.582  -3.274
  494   1HA   GLY  71          2HA       GLY  71  -5.570 -10.903  -2.001
  495   2HA   GLY  71          1HA       GLY  71  -5.044 -12.099  -3.184
  496    H    THR  72           H        THR  72  -5.812  -9.171  -4.663
  497    HA   THR  72           HA       THR  72  -2.984  -8.349  -4.629
  498    HB   THR  72           HB       THR  72  -3.087  -7.792  -6.922
  499    HG1  THR  72           1HG      THR  72  -5.095  -6.817  -7.028
  500   1HG2  THR  72          1HG2      THR  72  -4.509 -10.380  -6.425
  501   2HG2  THR  72          2HG2      THR  72  -2.824 -10.110  -6.872
  502   3HG2  THR  72          3HG2      THR  72  -4.106  -9.825  -8.049
  503    H    ILE  73           H        ILE  73  -2.718  -6.005  -5.327
  504    HA   ILE  73           HA       ILE  73  -4.848  -4.378  -4.094
  505    HB   ILE  73           HB       ILE  73  -1.900  -3.766  -4.100
  506   1HG1  ILE  73          2HG1      ILE  73  -3.609  -4.852  -1.845
  507   2HG1  ILE  73          1HG1      ILE  73  -2.413  -5.780  -2.754
  508   1HG2  ILE  73          1HG2      ILE  73  -3.762  -2.536  -2.162
  509   2HG2  ILE  73          2HG2      ILE  73  -3.897  -2.003  -3.837
  510   3HG2  ILE  73          3HG2      ILE  73  -2.361  -1.850  -2.984
  511   1HD1  ILE  73          1HD1      ILE  73  -1.727  -4.884  -0.481
  512   2HD1  ILE  73          2HD1      ILE  73  -1.678  -3.295  -1.247
  513   3HD1  ILE  73          3HD1      ILE  73  -0.628  -4.589  -1.829
  514    H    ASP  74           H        ASP  74  -5.806  -3.016  -5.447
  515    HA   ASP  74           HA       ASP  74  -4.837  -2.511  -8.074
  516   1HB   ASP  74          2HB       ASP  74  -7.289  -2.383  -6.903
  517   2HB   ASP  74          1HB       ASP  74  -6.875  -0.669  -6.988
  518    H    PHE  75           H        PHE  75  -5.379   0.181  -8.499
  519    HA   PHE  75           HA       PHE  75  -2.910   1.362  -7.865
  520   1HB   PHE  75          2HB       PHE  75  -4.338   1.962  -9.825
  521   2HB   PHE  75          1HB       PHE  75  -5.438   2.788  -8.720
  522    HD1  PHE  75           1HD      PHE  75  -2.640   3.150 -10.820
  523    HD2  PHE  75           2HD      PHE  75  -4.345   4.613  -7.205
  524    HE1  PHE  75           1HE      PHE  75  -1.281   5.193 -11.009
  525    HE2  PHE  75           2HE      PHE  75  -2.990   6.658  -7.389
  526    HZ   PHE  75           HZ       PHE  75  -1.456   6.950  -9.293
  527    H    GLU  76           H        GLU  76  -6.067   2.717  -6.906
  528    HA   GLU  76           HA       GLU  76  -4.923   4.130  -4.716
  529   1HB   GLU  76          2HB       GLU  76  -7.378   4.515  -4.106
  530   2HB   GLU  76          1HB       GLU  76  -6.821   5.145  -5.651
  531   1HG   GLU  76          2HG       GLU  76  -7.897   2.430  -5.783
  532   2HG   GLU  76          1HG       GLU  76  -9.062   3.651  -5.274
  533    H    GLU  77           H        GLU  77  -6.215   0.962  -5.104
  534    HA   GLU  77           HA       GLU  77  -7.167   0.345  -2.587
  535   1HB   GLU  77          2HB       GLU  77  -6.111  -1.140  -4.871
  536   2HB   GLU  77          1HB       GLU  77  -5.820  -1.953  -3.340
  537   1HG   GLU  77          2HG       GLU  77  -8.309  -1.541  -2.878
  538   2HG   GLU  77          1HG       GLU  77  -8.425  -1.212  -4.611
  539    H    PHE  78           H        PHE  78  -3.879   0.875  -3.609
  540    HA   PHE  78           HA       PHE  78  -2.632  -0.412  -1.393
  541   1HB   PHE  78          2HB       PHE  78  -1.519   0.182  -3.596
  542   2HB   PHE  78          1HB       PHE  78  -1.453   1.848  -3.014
  543    HD1  PHE  78           1HD      PHE  78  -0.075   2.420  -1.059
  544    HD2  PHE  78           2HD      PHE  78  -0.043  -1.482  -2.756
  545    HE1  PHE  78           1HE      PHE  78   2.012   1.921   0.142
  546    HE2  PHE  78           2HE      PHE  78   2.044  -1.990  -1.556
  547    HZ   PHE  78           HZ       PHE  78   3.073  -0.287  -0.104
  548    H    LEU  79           H        LEU  79  -4.446   2.418  -1.615
  549    HA   LEU  79           HA       LEU  79  -3.076   3.717   0.612
  550   1HB   LEU  79          2HB       LEU  79  -5.375   4.573  -1.145
  551   2HB   LEU  79          1HB       LEU  79  -4.827   5.499   0.240
  552    HG   LEU  79           HG       LEU  79  -2.533   5.014  -1.317
  553   1HD1  LEU  79          1HD1      LEU  79  -4.953   5.657  -2.959
  554   2HD1  LEU  79          2HD1      LEU  79  -3.667   4.493  -3.277
  555   3HD1  LEU  79          3HD1      LEU  79  -3.349   6.221  -3.431
  556   1HD2  LEU  79          1HD2      LEU  79  -2.596   6.995  -0.137
  557   2HD2  LEU  79          2HD2      LEU  79  -4.240   7.372  -0.651
  558   3HD2  LEU  79          3HD2      LEU  79  -2.900   7.548  -1.785
  559    H    VAL  80           H        VAL  80  -6.216   2.321  -0.246
  560    HA   VAL  80           HA       VAL  80  -7.467   2.769   2.241
  561    HB   VAL  80           HB       VAL  80  -8.585   2.135   0.042
  562   1HG1  VAL  80          1HG1      VAL  80  -7.855  -0.641   0.963
  563   2HG1  VAL  80          2HG1      VAL  80  -7.264   0.167  -0.488
  564   3HG1  VAL  80          3HG1      VAL  80  -8.971  -0.252  -0.346
  565   1HG2  VAL  80          1HG2      VAL  80  -9.667   0.373   2.167
  566   2HG2  VAL  80          2HG2      VAL  80 -10.481   1.580   1.171
  567   3HG2  VAL  80          3HG2      VAL  80  -9.488   2.089   2.537
  568    H    MET  81           H        MET  81  -5.376   0.229   1.057
  569    HA   MET  81           HA       MET  81  -5.824  -1.799   2.863
  570   1HB   MET  81          2HB       MET  81  -3.247  -2.148   2.623
  571   2HB   MET  81          1HB       MET  81  -4.282  -2.345   1.221
  572   1HG   MET  81          2HG       MET  81  -3.499  -0.498   0.195
  573   2HG   MET  81          1HG       MET  81  -3.134   0.335   1.705
  574   1HE   MET  81          1HE       MET  81  -0.059  -0.766   2.994
  575   2HE   MET  81          2HE       MET  81  -0.734  -2.396   2.902
  576   3HE   MET  81          3HE       MET  81  -1.765  -1.040   3.358
  577    H    MET  82           H        MET  82  -3.880   1.098   3.230
  578    HA   MET  82           HA       MET  82  -2.969   0.444   5.865
  579   1HB   MET  82          2HB       MET  82  -2.288   2.296   3.867
  580   2HB   MET  82          1HB       MET  82  -2.832   3.261   5.236
  581   1HG   MET  82          2HG       MET  82  -1.219   2.185   6.677
  582   2HG   MET  82          1HG       MET  82  -0.718   1.124   5.362
  583   1HE   MET  82          1HE       MET  82   1.208   2.694   3.066
  584   2HE   MET  82          2HE       MET  82  -0.061   3.884   2.777
  585   3HE   MET  82          3HE       MET  82  -0.483   2.199   3.081
  586    H    VAL  83           H        VAL  83  -5.535   2.418   4.472
  587    HA   VAL  83           HA       VAL  83  -6.351   3.806   6.745
  588    HB   VAL  83           HB       VAL  83  -8.125   2.762   4.529
  589   1HG1  VAL  83          1HG1      VAL  83  -8.559   5.167   6.287
  590   2HG1  VAL  83          2HG1      VAL  83  -9.272   3.586   6.606
  591   3HG1  VAL  83          3HG1      VAL  83  -9.682   4.457   5.128
  592   1HG2  VAL  83          1HG2      VAL  83  -7.790   5.218   3.747
  593   2HG2  VAL  83          2HG2      VAL  83  -6.552   4.016   3.392
  594   3HG2  VAL  83          3HG2      VAL  83  -6.325   5.142   4.728
  595    H    ARG  84           H        ARG  84  -7.013   0.517   5.716
  596    HA   ARG  84           HA       ARG  84  -9.047   0.008   7.650
  597   1HB   ARG  84          2HB       ARG  84  -7.304  -1.955   6.153
  598   2HB   ARG  84          1HB       ARG  84  -8.793  -2.336   7.007
  599   1HG   ARG  84          2HG       ARG  84  -9.552  -0.332   5.273
  600   2HG   ARG  84          1HG       ARG  84  -8.391  -1.278   4.332
  601   1HD   ARG  84          2HD       ARG  84  -9.876  -2.909   4.043
  602   2HD   ARG  84          1HD       ARG  84 -10.161  -3.025   5.778
  603    HE   ARG  84           HE       ARG  84 -11.807  -1.701   3.838
  604   1HH1  ARG  84          1HH1      ARG  84 -10.880  -1.781   7.201
  605   2HH1  ARG  84          2HH1      ARG  84 -12.349  -1.049   7.752
  606   1HH2  ARG  84          1HH2      ARG  84 -13.740  -0.738   4.561
  607   2HH2  ARG  84          2HH2      ARG  84 -13.973  -0.456   6.253
  608    H    GLN  85           H        GLN  85  -5.657   0.243   7.844
  609    HA   GLN  85           HA       GLN  85  -5.618  -1.298  10.350
  610   1HB   GLN  85          2HB       GLN  85  -3.187  -0.378   8.823
  611   2HB   GLN  85          1HB       GLN  85  -3.289  -1.629  10.061
  612   1HG   GLN  85          2HG       GLN  85  -4.326  -1.747   7.238
  613   2HG   GLN  85          1HG       GLN  85  -3.017  -2.697   7.955
  614   1HE2  GLN  85          1HE2      GLN  85  -5.736  -3.296   6.695
  615   2HE2  GLN  85          2HE2      GLN  85  -6.461  -4.404   7.805
  616    H    MET  86           H        MET  86  -5.147   1.823   8.919
  617    HA   MET  86           HA       MET  86  -3.794   3.025  11.121
  618   1HB   MET  86          2HB       MET  86  -5.106   3.987   8.619
  619   2HB   MET  86          1HB       MET  86  -4.794   5.159   9.901
  620   1HG   MET  86          2HG       MET  86  -2.398   4.322   9.871
  621   2HG   MET  86          1HG       MET  86  -2.820   3.501   8.364
  622   1HE   MET  86          1HE       MET  86  -1.772   4.252   6.646
  623   2HE   MET  86          2HE       MET  86  -1.542   5.891   6.038
  624   3HE   MET  86          3HE       MET  86  -3.110   5.099   5.869
  625    H    LYS  87           H        LYS  87  -7.146   3.265   9.931
  626    HA   LYS  87           HA       LYS  87  -8.073   4.741  12.168
  627   1HB   LYS  87          2HB       LYS  87  -9.391   3.261   9.918
  628   2HB   LYS  87          1HB       LYS  87 -10.362   3.847  11.268
  629   1HG   LYS  87          2HG       LYS  87 -10.542   5.623   9.862
  630   2HG   LYS  87          1HG       LYS  87  -9.089   6.100  10.750
  631   1HD   LYS  87          2HD       LYS  87  -8.609   4.412   8.391
  632   2HD   LYS  87          1HD       LYS  87  -9.283   6.004   8.041
  633   1HE   LYS  87          2HE       LYS  87  -6.745   5.365   9.531
  634   2HE   LYS  87          1HE       LYS  87  -6.905   6.191   7.981
  635   1HZ   LYS  87          1HZ       LYS  87  -7.418   7.201  10.688
  636   2HZ   LYS  87          2HZ       LYS  87  -8.309   7.845   9.402
  637   3HZ   LYS  87          3HZ       LYS  87  -6.621   7.946   9.395
  638    H    GLU  88           H        GLU  88  -7.723   1.340  11.498
  639    HA   GLU  88           HA       GLU  88  -8.317   0.720  14.260
  640   1HB   GLU  88          2HB       GLU  88 -10.077  -0.112  11.993
  641   2HB   GLU  88          1HB       GLU  88  -9.831  -1.232  13.326
  642   1HG   GLU  88          2HG       GLU  88 -10.396   1.157  14.584
  643   2HG   GLU  88          1HG       GLU  88 -11.461   1.160  13.179
  644    H    ASP  89           H        ASP  89  -6.622  -0.453  14.842
  645    HA   ASP  89           HA       ASP  89  -5.491  -2.361  12.905
  646   1HB   ASP  89          2HB       ASP  89  -4.160  -0.346  14.083
  647   2HB   ASP  89          1HB       ASP  89  -3.932  -1.593  15.313
  648    H    ALA  90           H        ALA  90  -4.138  -4.101  14.286
  649    HA   ALA  90           HA       ALA  90  -4.264  -5.997  15.538
  650   1HB   ALA  90          1HB       ALA  90  -5.545  -3.957  17.271
  651   2HB   ALA  90          2HB       ALA  90  -4.111  -4.944  17.550
  652   3HB   ALA  90          3HB       ALA  90  -5.716  -5.652  17.727
  653   2H    ARG 115          HN2       ARG 115   2.482  -2.449  10.610
  654    H    ARG 115           H        ARG 115   1.357  -3.535  11.316
  655   3H    ARG 115          HN3       ARG 115   2.091  -3.919   9.816
  656    HA   ARG 115           HA       ARG 115   0.859  -2.468   8.652
  657   1HB   ARG 115          2HB       ARG 115  -0.963  -3.130  10.973
  658   2HB   ARG 115          1HB       ARG 115  -1.435  -2.854   9.302
  659   1HG   ARG 115          2HG       ARG 115  -1.219  -5.008   8.864
  660   2HG   ARG 115          1HG       ARG 115   0.477  -4.956   9.347
  661   1HD   ARG 115          2HD       ARG 115  -0.551  -6.599  10.704
  662   2HD   ARG 115          1HD       ARG 115  -0.319  -5.184  11.730
  663    HE   ARG 115           HE       ARG 115  -2.591  -4.998  11.928
  664   1HH1  ARG 115          1HH1      ARG 115  -1.861  -7.129   9.263
  665   2HH1  ARG 115          2HH1      ARG 115  -3.508  -7.617   9.039
  666   1HH2  ARG 115          1HH2      ARG 115  -4.757  -5.638  11.634
  667   2HH2  ARG 115          2HH2      ARG 115  -5.152  -6.771  10.384
  668    H    MET 116           H        MET 116  -1.316  -0.902   9.302
  669    HA   MET 116           HA       MET 116  -1.913   1.218   9.852
  670   1HB   MET 116          2HB       MET 116  -1.749   0.549  12.157
  671   2HB   MET 116          1HB       MET 116   0.001   0.716  12.135
  672   1HG   MET 116          2HG       MET 116  -0.318   3.157  11.703
  673   2HG   MET 116          1HG       MET 116  -2.043   2.914  11.965
  674   1HE   MET 116          1HE       MET 116   1.264   2.527  15.140
  675   2HE   MET 116          2HE       MET 116   1.496   2.853  13.422
  676   3HE   MET 116          3HE       MET 116   1.037   1.237  13.960
  677    H    SER 117           H        SER 117   1.450   1.420  10.982
  678    HA   SER 117           HA       SER 117   2.027   3.869   9.880
  679   1HB   SER 117          2HB       SER 117   3.870   1.529  10.391
  680   2HB   SER 117          1HB       SER 117   4.438   3.141   9.953
  681    HG   SER 117           HG       SER 117   3.128   2.293  12.296
  682    H    ALA 118           H        ALA 118   3.920   1.271   8.453
  683    HA   ALA 118           HA       ALA 118   4.321   0.672   6.294
  684   1HB   ALA 118          1HB       ALA 118   2.368   0.142   5.380
  685   2HB   ALA 118          2HB       ALA 118   2.288   1.786   4.747
  686   3HB   ALA 118          3HB       ALA 118   1.530   1.397   6.292
  687    H    ASP 119           H        ASP 119   3.200   4.006   6.718
  688    HA   ASP 119           HA       ASP 119   4.061   5.302   4.532
  689   1HB   ASP 119          2HB       ASP 119   3.024   6.420   6.434
  690   2HB   ASP 119          1HB       ASP 119   4.492   6.203   7.383
  691    H    ALA 120           H        ALA 120   6.111   3.830   6.954
  692    HA   ALA 120           HA       ALA 120   8.533   5.090   6.430
  693   1HB   ALA 120          1HB       ALA 120   8.484   2.142   6.908
  694   2HB   ALA 120          2HB       ALA 120   7.888   3.233   8.160
  695   3HB   ALA 120          3HB       ALA 120   9.550   3.373   7.587
  696    H    MET 121           H        MET 121   7.456   1.976   5.028
  697    HA   MET 121           HA       MET 121   9.462   1.882   3.059
  698   1HB   MET 121          2HB       MET 121   8.177  -0.104   3.648
  699   2HB   MET 121          1HB       MET 121   6.699   0.645   3.060
  700   1HG   MET 121          2HG       MET 121   8.162   0.815   0.833
  701   2HG   MET 121          1HG       MET 121   8.929  -0.592   1.570
  702   1HE   MET 121          1HE       MET 121   5.612   1.013   1.473
  703   2HE   MET 121          2HE       MET 121   4.452  -0.309   1.341
  704   3HE   MET 121          3HE       MET 121   5.130   0.420  -0.115
  705    H    LEU 122           H        LEU 122   6.383   3.479   3.238
  706    HA   LEU 122           HA       LEU 122   6.034   4.086   0.503
  707   1HB   LEU 122          2HB       LEU 122   5.028   5.255   3.070
  708   2HB   LEU 122          1HB       LEU 122   4.734   6.100   1.570
  709    HG   LEU 122           HG       LEU 122   3.347   4.377   0.742
  710   1HD1  LEU 122          1HD1      LEU 122   4.235   2.326   1.111
  711   2HD1  LEU 122          2HD1      LEU 122   3.025   2.322   2.394
  712   3HD1  LEU 122          3HD1      LEU 122   4.706   2.699   2.767
  713   1HD2  LEU 122          1HD2      LEU 122   2.441   4.152   3.536
  714   2HD2  LEU 122          2HD2      LEU 122   1.577   4.698   2.101
  715   3HD2  LEU 122          3HD2      LEU 122   2.681   5.791   2.933
  716    H    ARG 123           H        ARG 123   7.658   5.764   3.167
  717    HA   ARG 123           HA       ARG 123   8.530   7.889   1.376
  718   1HB   ARG 123          2HB       ARG 123   7.763   8.202   3.814
  719   2HB   ARG 123          1HB       ARG 123   9.345   7.573   4.254
  720   1HG   ARG 123          2HG       ARG 123   9.636   9.634   2.283
  721   2HG   ARG 123          1HG       ARG 123   8.652  10.216   3.627
  722   1HD   ARG 123          2HD       ARG 123  10.936   8.701   4.559
  723   2HD   ARG 123          1HD       ARG 123  11.428  10.047   3.531
  724    HE   ARG 123           HE       ARG 123   9.503  10.787   5.525
  725   1HH1  ARG 123          1HH1      ARG 123  12.899  10.290   4.897
  726   2HH1  ARG 123          2HH1      ARG 123  13.417  11.352   6.162
  727   1HH2  ARG 123          1HH2      ARG 123  10.182  12.185   7.190
  728   2HH2  ARG 123          2HH2      ARG 123  11.875  12.427   7.465
  729    H    ALA 124           H        ALA 124   9.496   4.910   1.518
  730    HA   ALA 124           HA       ALA 124  12.290   5.131   2.116
  731   1HB   ALA 124          1HB       ALA 124  12.262   2.897   2.046
  732   2HB   ALA 124          2HB       ALA 124  11.514   2.870   0.447
  733   3HB   ALA 124          3HB       ALA 124  10.512   3.047   1.887
  734    H    LEU 125           H        LEU 125  10.770   4.075  -0.915
  735    HA   LEU 125           HA       LEU 125  13.042   4.855  -2.452
  736   1HB   LEU 125          2HB       LEU 125  10.303   4.056  -3.424
  737   2HB   LEU 125          1HB       LEU 125  11.791   4.053  -4.356
  738    HG   LEU 125           HG       LEU 125  11.606   2.381  -1.885
  739   1HD1  LEU 125          1HD1      LEU 125  10.977   0.587  -3.779
  740   2HD1  LEU 125          2HD1      LEU 125  10.104   1.995  -4.386
  741   3HD1  LEU 125          3HD1      LEU 125   9.787   1.394  -2.758
  742   1HD2  LEU 125          1HD2      LEU 125  12.900   1.404  -4.329
  743   2HD2  LEU 125          2HD2      LEU 125  13.472   1.408  -2.661
  744   3HD2  LEU 125          3HD2      LEU 125  13.614   2.865  -3.645
  745    H    LEU 126           H        LEU 126  10.005   6.375  -1.631
  746    HA   LEU 126           HA       LEU 126  10.926   8.840  -2.762
  747   1HB   LEU 126          2HB       LEU 126   9.386   7.191  -4.405
  748   2HB   LEU 126          1HB       LEU 126   8.269   8.409  -3.821
  749    HG   LEU 126           HG       LEU 126  10.890   9.014  -5.191
  750   1HD1  LEU 126          1HD1      LEU 126   9.515   8.021  -6.827
  751   2HD1  LEU 126          2HD1      LEU 126   9.351   9.762  -7.052
  752   3HD1  LEU 126          3HD1      LEU 126   8.077   8.854  -6.237
  753   1HD2  LEU 126          1HD2      LEU 126   8.691  10.679  -4.050
  754   2HD2  LEU 126          2HD2      LEU 126   9.591  11.260  -5.451
  755   3HD2  LEU 126          3HD2      LEU 126  10.437  10.899  -3.946
  756    H    GLY 127           H        GLY 127   9.696  10.669  -2.104
  757   1HA   GLY 127          2HA       GLY 127   7.292  10.726  -0.778
  758   2HA   GLY 127          1HA       GLY 127   8.470  10.320   0.460
  759    H    SER 128           H        SER 128   7.545  12.420   1.294
  760    HA   SER 128           HA       SER 128   8.755  14.765   0.019
  761   1HB   SER 128          2HB       SER 128   6.448  14.328   1.837
  762   2HB   SER 128          1HB       SER 128   7.347  15.831   2.050
  763    HG   SER 128           HG       SER 128   6.292  14.907  -0.418
  764    H    LYS 129           H        LYS 129  10.557  15.639   0.790
  765    HA   LYS 129           HA       LYS 129  12.021  14.531   2.901
  766   1HB   LYS 129          2HB       LYS 129  12.659  16.179   0.900
  767   2HB   LYS 129          1HB       LYS 129  12.491  17.379   2.174
  768   1HG   LYS 129          2HG       LYS 129  14.694  16.908   2.413
  769   2HG   LYS 129          1HG       LYS 129  14.034  15.667   3.480
  770   1HD   LYS 129          2HD       LYS 129  14.211  14.009   1.746
  771   2HD   LYS 129          1HD       LYS 129  14.695  15.232   0.569
  772   1HE   LYS 129          2HE       LYS 129  16.673  15.694   2.101
  773   2HE   LYS 129          1HE       LYS 129  16.239  14.203   2.934
  774   1HZ   LYS 129          1HZ       LYS 129  17.938  13.843   1.242
  775   2HZ   LYS 129          2HZ       LYS 129  16.892  14.423   0.045
  776   3HZ   LYS 129          3HZ       LYS 129  16.521  12.995   0.873
  777    H    HIS 130           H        HIS 130  12.157  14.943   5.036
  778    HA   HIS 130           HA       HIS 130  10.620  17.207   6.114
  779   1HB   HIS 130          2HB       HIS 130   9.397  15.006   6.334
  780   2HB   HIS 130          1HB       HIS 130  10.699  14.471   7.393
  781    HD1  HIS 130           1HD      HIS 130   8.709  14.256   9.185
  782    HD2  HIS 130           2HD      HIS 130   9.731  18.115   8.030
  783    HE1  HIS 130           1HE      HIS 130   7.715  15.767  10.933
  784    HE2  HIS 130           2HE      HIS 130   8.272  18.101  10.166
  785    H    LYS 131           H        LYS 131  13.080  14.740   6.800
  786    HA   LYS 131           HA       LYS 131  14.214  16.418   8.901
  787   1HB   LYS 131          2HB       LYS 131  15.711  14.488   9.308
  788   2HB   LYS 131          1HB       LYS 131  14.009  14.059   9.402
  789   1HG   LYS 131          2HG       LYS 131  14.093  13.065   7.206
  790   2HG   LYS 131          1HG       LYS 131  15.766  13.588   7.003
  791   1HD   LYS 131          2HD       LYS 131  16.176  11.468   7.705
  792   2HD   LYS 131          1HD       LYS 131  16.026  12.230   9.290
  793   1HE   LYS 131          2HE       LYS 131  13.472  11.378   8.159
  794   2HE   LYS 131          1HE       LYS 131  14.604  10.050   8.415
  795   1HZ   LYS 131          1HZ       LYS 131  14.892  11.219  10.720
  796   2HZ   LYS 131          2HZ       LYS 131  13.604  10.157  10.446
  797   3HZ   LYS 131          3HZ       LYS 131  13.350  11.828  10.378
  Start of MODEL   19
    1   2H    ALA   1          HN2       ALA   1 -24.740   2.984  -9.710
    2    H    ALA   1           H        ALA   1 -25.879   1.838 -10.289
    3   3H    ALA   1          HN3       ALA   1 -25.526   1.923  -8.614
    4    HA   ALA   1           HA       ALA   1 -24.427   0.074  -9.453
    5   1HB   ALA   1          1HB       ALA   1 -24.525   0.720 -11.818
    6   2HB   ALA   1          2HB       ALA   1 -22.910   0.191 -11.346
    7   3HB   ALA   1          3HB       ALA   1 -23.253   1.910 -11.538
    8    H    SER   2           H        SER   2 -22.663  -0.506  -8.317
    9    HA   SER   2           HA       SER   2 -20.410   1.197  -7.924
   10   1HB   SER   2          2HB       SER   2 -22.429   1.916  -6.293
   11   2HB   SER   2          1HB       SER   2 -21.702   0.645  -5.310
   12    HG   SER   2           HG       SER   2 -20.883   3.126  -5.572
   13    H    MET   3           H        MET   3 -18.980   0.225  -6.080
   14    HA   MET   3           HA       MET   3 -19.346  -2.620  -5.685
   15   1HB   MET   3          2HB       MET   3 -17.038  -3.092  -6.635
   16   2HB   MET   3          1HB       MET   3 -18.311  -2.778  -7.806
   17   1HG   MET   3          2HG       MET   3 -17.450  -0.328  -7.680
   18   2HG   MET   3          1HG       MET   3 -15.991  -1.076  -7.030
   19   1HE   MET   3          1HE       MET   3 -16.572   0.105 -10.931
   20   2HE   MET   3          2HE       MET   3 -14.997   0.170 -10.140
   21   3HE   MET   3          3HE       MET   3 -16.433   0.747  -9.294
   22    H    THR   4           H        THR   4 -17.048   0.082  -5.459
   23    HA   THR   4           HA       THR   4 -16.857  -0.010  -2.665
   24    HB   THR   4           HB       THR   4 -15.694  -2.103  -2.925
   25    HG1  THR   4           1HG      THR   4 -13.673  -1.511  -2.023
   26   1HG2  THR   4          1HG2      THR   4 -13.934  -2.554  -4.324
   27   2HG2  THR   4          2HG2      THR   4 -13.516  -0.853  -4.526
   28   3HG2  THR   4          3HG2      THR   4 -14.936  -1.515  -5.335
   29    H    ASP   5           H        ASP   5 -16.405   2.022  -2.185
   30    HA   ASP   5           HA       ASP   5 -14.650   3.546  -3.992
   31   1HB   ASP   5          2HB       ASP   5 -15.797   5.562  -2.926
   32   2HB   ASP   5          1HB       ASP   5 -16.783   4.567  -4.003
   33    H    GLN   6           H        GLN   6 -14.495   1.967  -1.149
   34    HA   GLN   6           HA       GLN   6 -13.469   3.705   0.739
   35   1HB   GLN   6          2HB       GLN   6 -12.190   1.706   1.583
   36   2HB   GLN   6          1HB       GLN   6 -13.916   1.452   1.363
   37   1HG   GLN   6          2HG       GLN   6 -13.040   0.634  -1.032
   38   2HG   GLN   6          1HG       GLN   6 -11.624   0.256  -0.054
   39   1HE2  GLN   6          1HE2      GLN   6 -15.156  -0.062   0.064
   40   2HE2  GLN   6          2HE2      GLN   6 -15.163  -1.658   0.723
   41    H    GLN   7           H        GLN   7 -11.956   2.418  -2.131
   42    HA   GLN   7           HA       GLN   7  -9.283   3.131  -1.426
   43   1HB   GLN   7          2HB       GLN   7 -10.153   2.902  -4.278
   44   2HB   GLN   7          1HB       GLN   7  -8.660   2.365  -3.523
   45   1HG   GLN   7          2HG       GLN   7  -9.570   0.336  -3.720
   46   2HG   GLN   7          1HG       GLN   7 -10.441   0.785  -2.256
   47   1HE2  GLN   7          1HE2      GLN   7 -10.639   0.618  -5.756
   48   2HE2  GLN   7          2HE2      GLN   7 -12.363   0.542  -5.843
   49    H    ALA   8           H        ALA   8 -11.982   4.831  -2.716
   50    HA   ALA   8           HA       ALA   8 -10.471   6.984  -3.877
   51   1HB   ALA   8          1HB       ALA   8 -12.937   8.026  -3.626
   52   2HB   ALA   8          2HB       ALA   8 -13.326   6.308  -3.546
   53   3HB   ALA   8          3HB       ALA   8 -12.465   6.954  -4.944
   54    H    GLU   9           H        GLU   9 -12.520   6.623  -0.979
   55    HA   GLU   9           HA       GLU   9 -12.096   9.174   0.076
   56   1HB   GLU   9          2HB       GLU   9 -12.487   6.616   1.644
   57   2HB   GLU   9          1HB       GLU   9 -12.792   8.252   2.215
   58   1HG   GLU   9          2HG       GLU   9 -14.735   8.456   1.038
   59   2HG   GLU   9          1HG       GLU   9 -14.223   7.319  -0.216
   60    H    ALA  10           H        ALA  10 -10.271   6.176   0.457
   61    HA   ALA  10           HA       ALA  10  -8.447   6.739   2.378
   62   1HB   ALA  10          1HB       ALA  10  -6.858   5.540   0.524
   63   2HB   ALA  10          2HB       ALA  10  -8.469   5.119  -0.064
   64   3HB   ALA  10          3HB       ALA  10  -7.988   4.693   1.579
   65    H    ARG  11           H        ARG  11  -7.908   7.468  -1.077
   66    HA   ARG  11           HA       ARG  11  -5.557   8.906  -0.803
   67   1HB   ARG  11          2HB       ARG  11  -7.178   8.208  -2.895
   68   2HB   ARG  11          1HB       ARG  11  -7.395   9.952  -2.851
   69   1HG   ARG  11          2HG       ARG  11  -5.433  10.281  -3.821
   70   2HG   ARG  11          1HG       ARG  11  -4.611   9.315  -2.595
   71   1HD   ARG  11          2HD       ARG  11  -4.227   7.768  -4.142
   72   2HD   ARG  11          1HD       ARG  11  -5.965   7.490  -4.246
   73    HE   ARG  11           HE       ARG  11  -5.509   9.662  -5.844
   74   1HH1  ARG  11          1HH1      ARG  11  -4.287   6.396  -5.708
   75   2HH1  ARG  11          2HH1      ARG  11  -4.002   6.299  -7.413
   76   1HH2  ARG  11          1HH2      ARG  11  -5.136   9.535  -8.086
   77   2HH2  ARG  11          2HH2      ARG  11  -4.483   8.081  -8.763
   78    H    ALA  12           H        ALA  12  -8.818   9.843  -0.105
   79    HA   ALA  12           HA       ALA  12  -8.098  12.660   0.157
   80   1HB   ALA  12          1HB       ALA  12 -10.207  12.109  -0.950
   81   2HB   ALA  12          2HB       ALA  12 -10.481  13.035   0.527
   82   3HB   ALA  12          3HB       ALA  12 -10.764  11.293   0.512
   83    H    PHE  13           H        PHE  13  -8.448   9.834   2.073
   84    HA   PHE  13           HA       PHE  13  -9.024  11.196   4.541
   85   1HB   PHE  13          2HB       PHE  13  -8.936   8.483   3.604
   86   2HB   PHE  13          1HB       PHE  13  -7.970   8.623   5.073
   87    HD1  PHE  13           1HD      PHE  13  -9.279  10.355   6.820
   88    HD2  PHE  13           2HD      PHE  13 -11.040   7.696   4.002
   89    HE1  PHE  13           1HE      PHE  13 -11.333  10.287   8.173
   90    HE2  PHE  13           2HE      PHE  13 -13.097   7.625   5.349
   91    HZ   PHE  13           HZ       PHE  13 -13.245   8.921   7.438
   92    H    LEU  14           H        LEU  14  -6.172   9.864   2.949
   93    HA   LEU  14           HA       LEU  14  -4.471  10.592   5.192
   94   1HB   LEU  14          2HB       LEU  14  -3.629   9.498   2.511
   95   2HB   LEU  14          1HB       LEU  14  -2.692   9.515   3.999
   96    HG   LEU  14           HG       LEU  14  -5.169   8.095   4.408
   97   1HD1  LEU  14          1HD1      LEU  14  -3.802   7.613   1.867
   98   2HD1  LEU  14          2HD1      LEU  14  -5.421   7.153   2.395
   99   3HD1  LEU  14          3HD1      LEU  14  -4.031   6.168   2.852
  100   1HD2  LEU  14          1HD2      LEU  14  -2.463   6.834   4.354
  101   2HD2  LEU  14          2HD2      LEU  14  -3.805   6.574   5.469
  102   3HD2  LEU  14          3HD2      LEU  14  -2.838   8.045   5.581
  103    H    SER  15           H        SER  15  -2.598  11.960   4.919
  104    HA   SER  15           HA       SER  15  -3.235  14.371   3.505
  105   1HB   SER  15          2HB       SER  15  -0.492  14.081   4.567
  106   2HB   SER  15          1HB       SER  15  -1.690  15.352   4.851
  107    HG   SER  15           HG       SER  15  -1.982  14.419   6.703
  108    H    GLU  16           H        GLU  16  -1.887  15.405   1.914
  109    HA   GLU  16           HA       GLU  16  -1.254  13.877  -0.290
  110   1HB   GLU  16          2HB       GLU  16  -0.786  16.625   0.569
  111   2HB   GLU  16          1HB       GLU  16   0.500  16.028  -0.471
  112   1HG   GLU  16          2HG       GLU  16  -0.787  16.082  -2.290
  113   2HG   GLU  16          1HG       GLU  16  -2.172  15.390  -1.447
  114    H    GLU  17           H        GLU  17   0.626  14.526   2.548
  115    HA   GLU  17           HA       GLU  17   3.188  13.855   1.625
  116   1HB   GLU  17          2HB       GLU  17   1.829  14.045   4.255
  117   2HB   GLU  17          1HB       GLU  17   3.296  13.074   4.204
  118   1HG   GLU  17          2HG       GLU  17   4.046  15.186   4.798
  119   2HG   GLU  17          1HG       GLU  17   4.373  15.096   3.068
  120    H    MET  18           H        MET  18   0.656  11.873   3.127
  121    HA   MET  18           HA       MET  18   2.110   9.448   3.071
  122   1HB   MET  18          2HB       MET  18  -0.207  10.239   4.232
  123   2HB   MET  18          1HB       MET  18  -0.839   9.297   2.883
  124   1HG   MET  18          2HG       MET  18  -0.694   7.738   4.571
  125   2HG   MET  18          1HG       MET  18   0.805   7.478   3.681
  126   1HE   MET  18          1HE       MET  18   1.290   6.977   7.699
  127   2HE   MET  18          2HE       MET  18   0.761   6.140   6.239
  128   3HE   MET  18          3HE       MET  18  -0.359   7.188   7.109
  129    H    ILE  19           H        ILE  19   0.175  11.123   0.706
  130    HA   ILE  19           HA       ILE  19  -0.229   8.907  -1.042
  131    HB   ILE  19           HB       ILE  19  -0.466  11.884  -1.381
  132   1HG1  ILE  19          2HG1      ILE  19  -2.444   9.598  -1.547
  133   2HG1  ILE  19          1HG1      ILE  19  -2.254  10.711  -0.190
  134   1HG2  ILE  19          1HG2      ILE  19  -1.413  11.375  -3.669
  135   2HG2  ILE  19          2HG2      ILE  19  -0.658   9.786  -3.532
  136   3HG2  ILE  19          3HG2      ILE  19   0.340  11.242  -3.511
  137   1HD1  ILE  19          1HD1      ILE  19  -3.189  12.484  -1.362
  138   2HD1  ILE  19          2HD1      ILE  19  -4.175  11.100  -1.834
  139   3HD1  ILE  19          3HD1      ILE  19  -2.934  11.711  -2.927
  140    H    ALA  20           H        ALA  20   1.857  11.779  -1.368
  141    HA   ALA  20           HA       ALA  20   3.306  11.047  -3.575
  142   1HB   ALA  20          1HB       ALA  20   3.809  12.776  -1.236
  143   2HB   ALA  20          2HB       ALA  20   3.848  13.152  -2.959
  144   3HB   ALA  20          3HB       ALA  20   5.215  12.328  -2.205
  145    H    GLU  21           H        GLU  21   3.538   9.804  -0.342
  146    HA   GLU  21           HA       GLU  21   6.023   8.397  -0.861
  147   1HB   GLU  21          2HB       GLU  21   4.213   8.194   1.552
  148   2HB   GLU  21          1HB       GLU  21   5.888   7.675   1.437
  149   1HG   GLU  21          2HG       GLU  21   5.266  10.530   0.919
  150   2HG   GLU  21          1HG       GLU  21   5.215   9.946   2.582
  151    H    PHE  22           H        PHE  22   2.585   7.822  -0.711
  152    HA   PHE  22           HA       PHE  22   2.535   5.028  -0.580
  153   1HB   PHE  22          2HB       PHE  22   0.686   7.170  -1.411
  154   2HB   PHE  22          1HB       PHE  22   0.390   5.617  -2.182
  155    HD1  PHE  22           1HD      PHE  22  -0.717   7.562   0.341
  156    HD2  PHE  22           2HD      PHE  22   0.747   3.614  -0.270
  157    HE1  PHE  22           1HE      PHE  22  -1.931   6.808   2.341
  158    HE2  PHE  22           2HE      PHE  22  -0.465   2.851   1.730
  159    HZ   PHE  22           HZ       PHE  22  -1.807   4.449   3.039
  160    H    LYS  23           H        LYS  23   3.053   7.241  -3.241
  161    HA   LYS  23           HA       LYS  23   2.965   5.208  -5.270
  162   1HB   LYS  23          2HB       LYS  23   2.316   7.534  -5.741
  163   2HB   LYS  23          1HB       LYS  23   3.966   8.057  -5.400
  164   1HG   LYS  23          2HG       LYS  23   3.659   5.954  -7.446
  165   2HG   LYS  23          1HG       LYS  23   3.050   7.556  -7.864
  166   1HD   LYS  23          2HD       LYS  23   5.477   8.132  -6.730
  167   2HD   LYS  23          1HD       LYS  23   5.801   6.605  -7.563
  168   1HE   LYS  23          2HE       LYS  23   5.121   7.502  -9.652
  169   2HE   LYS  23          1HE       LYS  23   4.441   8.939  -8.889
  170   1HZ   LYS  23          1HZ       LYS  23   7.299   8.375  -8.539
  171   2HZ   LYS  23          2HZ       LYS  23   6.493   9.861  -8.584
  172   3HZ   LYS  23          3HZ       LYS  23   6.775   9.010 -10.018
  173    H    ALA  24           H        ALA  24   5.280   6.219  -3.021
  174    HA   ALA  24           HA       ALA  24   7.710   6.193  -4.242
  175   1HB   ALA  24          1HB       ALA  24   7.414   6.520  -1.846
  176   2HB   ALA  24          2HB       ALA  24   8.647   5.301  -2.170
  177   3HB   ALA  24          3HB       ALA  24   7.035   4.808  -1.648
  178    H    ALA  25           H        ALA  25   6.532   3.213  -2.697
  179    HA   ALA  25           HA       ALA  25   8.250   1.601  -4.325
  180   1HB   ALA  25          1HB       ALA  25   7.957   0.866  -2.112
  181   2HB   ALA  25          2HB       ALA  25   7.072  -0.288  -3.109
  182   3HB   ALA  25          3HB       ALA  25   6.201   0.965  -2.226
  183    H    PHE  26           H        PHE  26   5.354   3.014  -5.048
  184    HA   PHE  26           HA       PHE  26   3.739   1.080  -6.159
  185   1HB   PHE  26          2HB       PHE  26   3.133   3.458  -6.017
  186   2HB   PHE  26          1HB       PHE  26   4.294   3.830  -7.287
  187    HD1  PHE  26           1HD      PHE  26   0.943   2.940  -6.551
  188    HD2  PHE  26           2HD      PHE  26   3.944   2.670  -9.557
  189    HE1  PHE  26           1HE      PHE  26  -0.795   2.534  -8.245
  190    HE2  PHE  26           2HE      PHE  26   2.212   2.265 -11.256
  191    HZ   PHE  26           HZ       PHE  26  -0.162   2.198 -10.602
  192    H    ASP  27           H        ASP  27   6.804   2.242  -7.305
  193    HA   ASP  27           HA       ASP  27   6.477   1.096  -9.944
  194   1HB   ASP  27          2HB       ASP  27   8.892   2.330  -8.603
  195   2HB   ASP  27          1HB       ASP  27   8.817   1.832 -10.290
  196    H    MET  28           H        MET  28   8.361   0.418  -7.015
  197    HA   MET  28           HA       MET  28   9.672  -1.869  -8.064
  198   1HB   MET  28          2HB       MET  28   9.136  -1.124  -5.182
  199   2HB   MET  28          1HB       MET  28  10.289  -2.333  -5.732
  200   1HG   MET  28          2HG       MET  28  10.407   0.621  -6.306
  201   2HG   MET  28          1HG       MET  28  11.402  -0.260  -5.141
  202   1HE   MET  28          1HE       MET  28  13.112   1.330  -8.147
  203   2HE   MET  28          2HE       MET  28  14.179   0.415  -7.081
  204   3HE   MET  28          3HE       MET  28  12.848   1.353  -6.403
  205    H    PHE  29           H        PHE  29   6.596  -1.353  -6.502
  206    HA   PHE  29           HA       PHE  29   6.017  -3.962  -5.683
  207   1HB   PHE  29          2HB       PHE  29   4.321  -1.617  -6.485
  208   2HB   PHE  29          1HB       PHE  29   3.571  -3.177  -6.142
  209    HD1  PHE  29           1HD      PHE  29   4.274  -0.129  -4.769
  210    HD2  PHE  29           2HD      PHE  29   4.625  -4.269  -3.867
  211    HE1  PHE  29           1HE      PHE  29   4.304   0.403  -2.371
  212    HE2  PHE  29           2HE      PHE  29   4.654  -3.744  -1.463
  213    HZ   PHE  29           HZ       PHE  29   4.493  -1.406  -0.713
  214    H    ASP  30           H        ASP  30   4.418  -2.450  -8.470
  215    HA   ASP  30           HA       ASP  30   3.637  -4.812  -9.688
  216   1HB   ASP  30          2HB       ASP  30   4.074  -2.028 -10.722
  217   2HB   ASP  30          1HB       ASP  30   3.623  -3.333 -11.824
  218    H    ALA  31           H        ALA  31   4.750  -6.382 -10.566
  219    HA   ALA  31           HA       ALA  31   7.502  -5.924 -11.433
  220   1HB   ALA  31          1HB       ALA  31   5.985  -8.511 -11.104
  221   2HB   ALA  31          2HB       ALA  31   7.058  -7.790  -9.904
  222   3HB   ALA  31          3HB       ALA  31   7.708  -8.349 -11.445
  223    H    ASP  32           H        ASP  32   4.468  -7.307 -12.645
  224    HA   ASP  32           HA       ASP  32   5.552  -7.306 -15.365
  225   1HB   ASP  32          2HB       ASP  32   3.513  -8.616 -15.928
  226   2HB   ASP  32          1HB       ASP  32   4.501  -9.384 -14.682
  227    H    GLY  33           H        GLY  33   3.191  -5.763 -13.321
  228   1HA   GLY  33          2HA       GLY  33   2.095  -3.753 -13.646
  229   2HA   GLY  33          1HA       GLY  33   2.848  -3.640 -15.230
  230    H    GLY  34           H        GLY  34   0.737  -6.169 -13.895
  231   1HA   GLY  34          2HA       GLY  34  -1.519  -5.302 -15.461
  232   2HA   GLY  34          1HA       GLY  34  -0.717  -6.721 -16.132
  233    H    GLY  35           H        GLY  35  -0.839  -6.155 -12.687
  234   1HA   GLY  35          2HA       GLY  35  -3.200  -7.731 -12.249
  235   2HA   GLY  35          1HA       GLY  35  -1.720  -8.640 -11.955
  236    H    ASP  36           H        ASP  36  -1.906  -5.209 -11.338
  237    HA   ASP  36           HA       ASP  36  -1.598  -4.005  -9.429
  238   1HB   ASP  36          2HB       ASP  36  -3.338  -6.102  -8.130
  239   2HB   ASP  36          1HB       ASP  36  -3.156  -4.412  -7.653
  240    H    ILE  37           H        ILE  37  -1.493  -4.745  -6.736
  241    HA   ILE  37           HA       ILE  37   1.126  -6.003  -6.661
  242    HB   ILE  37           HB       ILE  37  -0.439  -4.640  -4.474
  243   1HG1  ILE  37          2HG1      ILE  37   1.714  -3.649  -6.346
  244   2HG1  ILE  37          1HG1      ILE  37   0.064  -3.042  -6.187
  245   1HG2  ILE  37          1HG2      ILE  37   1.155  -6.180  -3.547
  246   2HG2  ILE  37          2HG2      ILE  37   1.731  -4.530  -3.315
  247   3HG2  ILE  37          3HG2      ILE  37   2.431  -5.538  -4.582
  248   1HD1  ILE  37          1HD1      ILE  37   1.833  -1.611  -5.168
  249   2HD1  ILE  37          2HD1      ILE  37   2.109  -2.895  -3.991
  250   3HD1  ILE  37          3HD1      ILE  37   0.541  -2.089  -4.068
  251    H    SER  38           H        SER  38   1.510  -7.988  -5.913
  252    HA   SER  38           HA       SER  38  -0.729  -9.477  -4.725
  253   1HB   SER  38          2HB       SER  38   0.234 -10.371  -6.846
  254   2HB   SER  38          1HB       SER  38   1.783 -10.574  -6.018
  255    HG   SER  38           HG       SER  38   1.001 -12.449  -5.484
  256    H    THR  39           H        THR  39   0.741 -11.590  -3.633
  257    HA   THR  39           HA       THR  39   1.493 -10.460  -1.131
  258    HB   THR  39           HB       THR  39   2.216 -12.886  -0.664
  259    HG1  THR  39           1HG      THR  39   1.350 -14.372  -2.187
  260   1HG2  THR  39          1HG2      THR  39  -0.238 -13.710  -0.910
  261   2HG2  THR  39          2HG2      THR  39  -0.557 -12.024  -1.314
  262   3HG2  THR  39          3HG2      THR  39   0.161 -12.437   0.243
  263    H    LYS  40           H        LYS  40   3.287 -11.858  -3.834
  264    HA   LYS  40           HA       LYS  40   5.827 -11.733  -2.542
  265   1HB   LYS  40          2HB       LYS  40   4.840 -12.322  -5.287
  266   2HB   LYS  40          1HB       LYS  40   6.530 -11.846  -5.118
  267   1HG   LYS  40          2HG       LYS  40   6.709 -13.664  -3.354
  268   2HG   LYS  40          1HG       LYS  40   5.134 -14.226  -3.931
  269   1HD   LYS  40          2HD       LYS  40   6.186 -14.253  -6.255
  270   2HD   LYS  40          1HD       LYS  40   7.737 -14.084  -5.432
  271   1HE   LYS  40          2HE       LYS  40   7.703 -16.332  -5.410
  272   2HE   LYS  40          1HE       LYS  40   6.630 -16.118  -4.027
  273   1HZ   LYS  40          1HZ       LYS  40   6.002 -17.572  -6.156
  274   2HZ   LYS  40          2HZ       LYS  40   5.359 -16.085  -6.637
  275   3HZ   LYS  40          3HZ       LYS  40   4.847 -16.799  -5.192
  276    H    GLU  41           H        GLU  41   4.056  -9.614  -4.734
  277    HA   GLU  41           HA       GLU  41   6.095  -7.813  -5.353
  278   1HB   GLU  41          2HB       GLU  41   3.132  -7.310  -5.044
  279   2HB   GLU  41          1HB       GLU  41   4.261  -6.195  -5.801
  280   1HG   GLU  41          2HG       GLU  41   4.815  -8.062  -7.413
  281   2HG   GLU  41          1HG       GLU  41   3.420  -8.914  -6.755
  282    H    LEU  42           H        LEU  42   4.289  -8.231  -2.425
  283    HA   LEU  42           HA       LEU  42   4.907  -5.625  -1.378
  284   1HB   LEU  42          2HB       LEU  42   3.164  -7.760  -0.700
  285   2HB   LEU  42          1HB       LEU  42   4.193  -7.456   0.694
  286    HG   LEU  42           HG       LEU  42   2.170  -6.167   0.905
  287   1HD1  LEU  42          1HD1      LEU  42   4.669  -4.629   0.294
  288   2HD1  LEU  42          2HD1      LEU  42   3.946  -5.006   1.859
  289   3HD1  LEU  42          3HD1      LEU  42   3.191  -3.809   0.805
  290   1HD2  LEU  42          1HD2      LEU  42   1.320  -4.709  -0.703
  291   2HD2  LEU  42          2HD2      LEU  42   1.818  -6.122  -1.635
  292   3HD2  LEU  42          3HD2      LEU  42   2.832  -4.678  -1.611
  293    H    GLY  43           H        GLY  43   5.835  -8.926  -0.365
  294   1HA   GLY  43          2HA       GLY  43   7.734  -8.273   1.519
  295   2HA   GLY  43          1HA       GLY  43   7.808  -9.719   0.515
  296    H    THR  44           H        THR  44   8.032  -8.130  -1.958
  297    HA   THR  44           HA       THR  44  10.805  -8.083  -2.220
  298    HB   THR  44           HB       THR  44   8.501  -7.098  -3.822
  299    HG1  THR  44           1HG      THR  44   9.419  -9.226  -3.982
  300   1HG2  THR  44          1HG2      THR  44  11.275  -6.072  -4.191
  301   2HG2  THR  44          2HG2      THR  44   9.729  -5.243  -4.391
  302   3HG2  THR  44          3HG2      THR  44  10.266  -6.413  -5.598
  303    H    VAL  45           H        VAL  45   8.845  -5.158  -2.606
  304    HA   VAL  45           HA       VAL  45  10.937  -3.380  -2.061
  305    HB   VAL  45           HB       VAL  45   8.976  -2.699  -3.311
  306   1HG1  VAL  45          1HG1      VAL  45   7.122  -3.745  -2.498
  307   2HG1  VAL  45          2HG1      VAL  45   6.907  -2.156  -1.762
  308   3HG1  VAL  45          3HG1      VAL  45   7.572  -3.486  -0.811
  309   1HG2  VAL  45          1HG2      VAL  45  10.232  -1.195  -1.338
  310   2HG2  VAL  45          2HG2      VAL  45   8.513  -0.863  -1.123
  311   3HG2  VAL  45          3HG2      VAL  45   9.277  -0.581  -2.687
  312    H    MET  46           H        MET  46   8.719  -5.017   0.069
  313    HA   MET  46           HA       MET  46   9.148  -3.268   2.297
  314   1HB   MET  46          2HB       MET  46   7.777  -5.896   1.891
  315   2HB   MET  46          1HB       MET  46   8.123  -5.346   3.531
  316   1HG   MET  46          2HG       MET  46   6.987  -3.161   2.183
  317   2HG   MET  46          1HG       MET  46   6.017  -4.572   1.755
  318   1HE   MET  46          1HE       MET  46   7.419  -2.354   4.651
  319   2HE   MET  46          2HE       MET  46   5.938  -2.242   5.602
  320   3HE   MET  46          3HE       MET  46   5.953  -1.692   3.925
  321    H    ARG  47           H        ARG  47  10.640  -6.205   1.105
  322    HA   ARG  47           HA       ARG  47  12.188  -6.563   3.533
  323   1HB   ARG  47          2HB       ARG  47  12.121  -8.049   0.910
  324   2HB   ARG  47          1HB       ARG  47  13.253  -8.434   2.197
  325   1HG   ARG  47          2HG       ARG  47  11.499  -9.063   3.668
  326   2HG   ARG  47          1HG       ARG  47  10.271  -8.429   2.573
  327   1HD   ARG  47          2HD       ARG  47  10.288 -10.802   2.344
  328   2HD   ARG  47          1HD       ARG  47  11.017 -10.119   0.888
  329    HE   ARG  47           HE       ARG  47  12.358 -11.649   2.974
  330   1HH1  ARG  47          1HH1      ARG  47  12.646  -9.746   0.055
  331   2HH1  ARG  47          2HH1      ARG  47  14.227 -10.341  -0.320
  332   1HH2  ARG  47          1HH2      ARG  47  14.436 -12.425   2.474
  333   2HH2  ARG  47          2HH2      ARG  47  15.243 -11.859   1.051
  334    H    MET  48           H        MET  48  12.571  -5.147   0.378
  335    HA   MET  48           HA       MET  48  15.457  -4.908   0.710
  336   1HB   MET  48          2HB       MET  48  15.477  -4.017  -1.544
  337   2HB   MET  48          1HB       MET  48  14.538  -5.507  -1.500
  338   1HG   MET  48          2HG       MET  48  12.754  -4.478  -2.302
  339   2HG   MET  48          1HG       MET  48  12.828  -3.251  -1.039
  340   1HE   MET  48          1HE       MET  48  11.757  -1.723  -3.707
  341   2HE   MET  48          2HE       MET  48  12.832  -0.404  -3.234
  342   3HE   MET  48          3HE       MET  48  12.071  -1.409  -2.001
  343    H    LEU  49           H        LEU  49  13.090  -3.343   2.125
  344    HA   LEU  49           HA       LEU  49  14.340  -0.697   1.790
  345   1HB   LEU  49          2HB       LEU  49  11.480  -1.481   2.212
  346   2HB   LEU  49          1HB       LEU  49  12.047   0.098   2.721
  347    HG   LEU  49           HG       LEU  49  12.061  -0.999  -0.089
  348   1HD1  LEU  49          1HD1      LEU  49  10.600   1.076  -0.405
  349   2HD1  LEU  49          2HD1      LEU  49  10.428   1.063   1.349
  350   3HD1  LEU  49          3HD1      LEU  49   9.882  -0.317   0.402
  351   1HD2  LEU  49          1HD2      LEU  49  13.601   1.147   1.146
  352   2HD2  LEU  49          2HD2      LEU  49  12.657   1.674  -0.248
  353   3HD2  LEU  49          3HD2      LEU  49  13.809   0.350  -0.414
  354    H    GLY  50           H        GLY  50  12.836  -2.950   4.067
  355   1HA   GLY  50          2HA       GLY  50  14.596  -2.688   6.129
  356   2HA   GLY  50          1HA       GLY  50  13.490  -1.335   6.363
  357    H    GLN  51           H        GLN  51  11.144  -2.690   5.405
  358    HA   GLN  51           HA       GLN  51  10.328  -3.935   7.817
  359   1HB   GLN  51          2HB       GLN  51   8.991  -2.718   5.835
  360   2HB   GLN  51          1HB       GLN  51   8.752  -4.394   5.340
  361   1HG   GLN  51          2HG       GLN  51   6.891  -3.760   6.664
  362   2HG   GLN  51          1HG       GLN  51   7.875  -4.864   7.626
  363   1HE2  GLN  51          1HE2      GLN  51   6.335  -1.889   7.539
  364   2HE2  GLN  51          2HE2      GLN  51   7.023  -1.199   8.966
  365    H    ASN  52           H        ASN  52   9.406  -6.123   7.982
  366    HA   ASN  52           HA       ASN  52  10.509  -8.076   6.116
  367   1HB   ASN  52          2HB       ASN  52  11.349  -9.447   8.062
  368   2HB   ASN  52          1HB       ASN  52  12.273  -7.983   7.710
  369   1HD2  ASN  52          1HD2      ASN  52  12.461  -6.449   9.234
  370   2HD2  ASN  52          2HD2      ASN  52  11.739  -6.530  10.802
  371    HA   PRO  53           HA       PRO  53   6.252  -9.046   7.864
  372   1HB   PRO  53          2HB       PRO  53   4.826  -8.771   5.598
  373   2HB   PRO  53          1HB       PRO  53   5.194  -7.394   6.643
  374   1HG   PRO  53          2HG       PRO  53   6.555  -8.270   4.120
  375   2HG   PRO  53          1HG       PRO  53   6.065  -6.640   4.614
  376   1HD   PRO  53          2HD       PRO  53   8.613  -7.551   4.863
  377   2HD   PRO  53          1HD       PRO  53   7.901  -6.363   5.979
  378    H    THR  54           H        THR  54   6.541 -11.206   8.142
  379    HA   THR  54           HA       THR  54   7.501 -13.033   6.280
  380    HB   THR  54           HB       THR  54   6.325 -14.755   7.724
  381    HG1  THR  54           1HG      THR  54   5.070 -14.111   9.314
  382   1HG2  THR  54          1HG2      THR  54   8.628 -13.592   8.199
  383   2HG2  THR  54          2HG2      THR  54   7.878 -14.662   9.383
  384   3HG2  THR  54          3HG2      THR  54   7.744 -12.913   9.566
  385    H    LYS  55           H        LYS  55   6.009 -15.066   5.722
  386    HA   LYS  55           HA       LYS  55   4.362 -14.289   3.615
  387   1HB   LYS  55          2HB       LYS  55   5.470 -16.576   4.126
  388   2HB   LYS  55          1HB       LYS  55   3.996 -16.914   5.033
  389   1HG   LYS  55          2HG       LYS  55   3.686 -17.840   2.891
  390   2HG   LYS  55          1HG       LYS  55   2.720 -16.364   2.928
  391   1HD   LYS  55          2HD       LYS  55   5.455 -15.940   1.997
  392   2HD   LYS  55          1HD       LYS  55   4.534 -17.049   0.980
  393   1HE   LYS  55          2HE       LYS  55   2.711 -15.086   1.382
  394   2HE   LYS  55          1HE       LYS  55   4.208 -14.156   1.415
  395   1HZ   LYS  55          1HZ       LYS  55   4.690 -15.564  -0.724
  396   2HZ   LYS  55          2HZ       LYS  55   3.763 -14.152  -0.805
  397   3HZ   LYS  55          3HZ       LYS  55   3.002 -15.662  -0.788
  398    H    CYS  56           H        CYS  56   3.521 -15.255   6.917
  399    HA   CYS  56           HA       CYS  56   0.704 -15.054   6.508
  400   1HB   CYS  56          2HB       CYS  56   2.247 -14.986   9.111
  401   2HB   CYS  56          1HB       CYS  56   0.523 -15.323   8.921
  402    HG   CYS  56           HG       CYS  56   2.245 -17.480   9.140
  403    H    GLU  57           H        GLU  57   3.227 -12.851   7.476
  404    HA   GLU  57           HA       GLU  57   1.731 -10.840   8.687
  405   1HB   GLU  57          2HB       GLU  57   4.374 -11.198   7.977
  406   2HB   GLU  57          1HB       GLU  57   3.879  -9.840   6.968
  407   1HG   GLU  57          2HG       GLU  57   3.080  -9.703   9.800
  408   2HG   GLU  57          1HG       GLU  57   4.809  -9.592   9.474
  409    H    LEU  58           H        LEU  58   2.803 -10.965   5.287
  410    HA   LEU  58           HA       LEU  58   1.158  -8.793   4.485
  411   1HB   LEU  58          2HB       LEU  58   2.266 -10.928   2.671
  412   2HB   LEU  58          1HB       LEU  58   1.870  -9.263   2.264
  413    HG   LEU  58           HG       LEU  58   4.046  -9.919   4.235
  414   1HD1  LEU  58          1HD1      LEU  58   5.575  -9.506   2.228
  415   2HD1  LEU  58          2HD1      LEU  58   4.165  -9.892   1.240
  416   3HD1  LEU  58          3HD1      LEU  58   4.807 -11.089   2.365
  417   1HD2  LEU  58          1HD2      LEU  58   4.830  -7.679   3.087
  418   2HD2  LEU  58          2HD2      LEU  58   3.663  -7.672   4.410
  419   3HD2  LEU  58          3HD2      LEU  58   3.107  -7.524   2.743
  420    H    ASP  59           H        ASP  59   0.729 -12.258   4.620
  421    HA   ASP  59           HA       ASP  59  -1.568 -12.418   2.971
  422   1HB   ASP  59          2HB       ASP  59  -0.206 -14.193   4.926
  423   2HB   ASP  59          1HB       ASP  59  -1.900 -14.544   4.578
  424    H    ALA  60           H        ALA  60  -1.088 -11.335   6.203
  425    HA   ALA  60           HA       ALA  60  -3.842 -11.707   6.986
  426   1HB   ALA  60          1HB       ALA  60  -2.876 -10.071   8.886
  427   2HB   ALA  60          2HB       ALA  60  -1.367 -10.758   8.285
  428   3HB   ALA  60          3HB       ALA  60  -2.637 -11.818   8.897
  429    H    ILE  61           H        ILE  61  -1.819  -9.166   5.698
  430    HA   ILE  61           HA       ILE  61  -3.786  -7.100   6.122
  431    HB   ILE  61           HB       ILE  61  -1.109  -7.183   4.750
  432   1HG1  ILE  61          2HG1      ILE  61  -0.988  -5.166   6.527
  433   2HG1  ILE  61          1HG1      ILE  61  -2.229  -6.156   7.300
  434   1HG2  ILE  61          1HG2      ILE  61  -2.319  -5.736   3.339
  435   2HG2  ILE  61          2HG2      ILE  61  -1.412  -4.695   4.437
  436   3HG2  ILE  61          3HG2      ILE  61  -3.135  -4.966   4.700
  437   1HD1  ILE  61          1HD1      ILE  61   0.300  -7.437   6.390
  438   2HD1  ILE  61          2HD1      ILE  61  -0.777  -7.880   7.714
  439   3HD1  ILE  61          3HD1      ILE  61   0.290  -6.486   7.875
  440    H    ILE  62           H        ILE  62  -2.289  -8.569   3.225
  441    HA   ILE  62           HA       ILE  62  -3.804  -7.459   1.247
  442    HB   ILE  62           HB       ILE  62  -2.850 -10.317   1.420
  443   1HG1  ILE  62          2HG1      ILE  62  -1.675  -7.826   0.167
  444   2HG1  ILE  62          1HG1      ILE  62  -1.050  -8.694   1.571
  445   1HG2  ILE  62          1HG2      ILE  62  -2.980  -9.529  -1.262
  446   2HG2  ILE  62          2HG2      ILE  62  -4.515  -9.036  -0.549
  447   3HG2  ILE  62          3HG2      ILE  62  -3.995 -10.717  -0.444
  448   1HD1  ILE  62          1HD1      ILE  62  -0.318 -10.487   0.268
  449   2HD1  ILE  62          2HD1      ILE  62   0.113  -9.051  -0.660
  450   3HD1  ILE  62          3HD1      ILE  62  -1.302 -10.001  -1.112
  451    H    CYS  63           H        CYS  63  -4.675 -10.274   3.231
  452    HA   CYS  63           HA       CYS  63  -7.085 -10.904   1.954
  453   1HB   CYS  63          2HB       CYS  63  -5.659 -11.826   4.192
  454   2HB   CYS  63          1HB       CYS  63  -7.244 -11.359   4.810
  455    HG   CYS  63           HG       CYS  63  -8.187 -13.014   2.848
  456    H    GLU  64           H        GLU  64  -6.343  -8.629   4.546
  457    HA   GLU  64           HA       GLU  64  -9.086  -7.880   4.956
  458   1HB   GLU  64          2HB       GLU  64  -6.444  -7.049   6.028
  459   2HB   GLU  64          1HB       GLU  64  -7.732  -5.855   6.095
  460   1HG   GLU  64          2HG       GLU  64  -8.407  -6.799   7.975
  461   2HG   GLU  64          1HG       GLU  64  -8.892  -8.205   7.028
  462    H    VAL  65           H        VAL  65  -6.379  -6.741   3.059
  463    HA   VAL  65           HA       VAL  65  -7.457  -4.227   2.327
  464    HB   VAL  65           HB       VAL  65  -5.422  -5.969   0.925
  465   1HG1  VAL  65          1HG1      VAL  65  -6.347  -4.505  -0.722
  466   2HG1  VAL  65          2HG1      VAL  65  -4.776  -3.858  -0.247
  467   3HG1  VAL  65          3HG1      VAL  65  -6.255  -3.126   0.375
  468   1HG2  VAL  65          1HG2      VAL  65  -5.202  -3.690   2.872
  469   2HG2  VAL  65          2HG2      VAL  65  -3.859  -4.186   1.843
  470   3HG2  VAL  65          3HG2      VAL  65  -4.541  -5.318   3.009
  471    H    ASP  66           H        ASP  66  -7.251  -7.294   0.529
  472    HA   ASP  66           HA       ASP  66  -8.877  -6.430  -1.618
  473   1HB   ASP  66          2HB       ASP  66  -7.904  -9.106  -0.665
  474   2HB   ASP  66          1HB       ASP  66  -9.070  -8.999  -1.982
  475    H    GLU  67           H        GLU  67 -10.984  -6.070  -1.616
  476    HA   GLU  67           HA       GLU  67 -12.645  -7.365   0.428
  477   1HB   GLU  67          2HB       GLU  67 -12.743  -4.764  -0.988
  478   2HB   GLU  67          1HB       GLU  67 -14.298  -5.527  -0.652
  479   1HG   GLU  67          2HG       GLU  67 -12.206  -5.083   1.461
  480   2HG   GLU  67          1HG       GLU  67 -13.451  -3.891   1.068
  481    H    ASP  68           H        ASP  68 -11.743  -8.668  -2.055
  482    HA   ASP  68           HA       ASP  68 -14.322  -9.652  -2.897
  483   1HB   ASP  68          2HB       ASP  68 -13.838  -9.306  -5.324
  484   2HB   ASP  68          1HB       ASP  68 -14.124  -7.812  -4.438
  485    H    GLY  69           H        GLY  69 -11.812 -10.600  -1.593
  486   1HA   GLY  69          2HA       GLY  69 -10.369 -12.394  -1.665
  487   2HA   GLY  69          1HA       GLY  69 -11.703 -13.188  -2.487
  488    H    SER  70           H        SER  70  -9.358 -10.651  -3.372
  489    HA   SER  70           HA       SER  70  -8.767 -12.203  -5.808
  490   1HB   SER  70          2HB       SER  70  -7.988  -9.801  -6.597
  491   2HB   SER  70          1HB       SER  70  -9.691 -10.273  -6.679
  492    HG   SER  70           HG       SER  70  -9.955  -9.229  -4.629
  493    H    GLY  71           H        GLY  71  -7.454 -10.571  -3.039
  494   1HA   GLY  71          2HA       GLY  71  -5.327 -10.601  -2.155
  495   2HA   GLY  71          1HA       GLY  71  -4.920 -11.824  -3.357
  496    H    THR  72           H        THR  72  -6.226  -9.045  -4.771
  497    HA   THR  72           HA       THR  72  -3.528  -8.109  -5.476
  498    HB   THR  72           HB       THR  72  -4.690  -7.178  -7.527
  499    HG1  THR  72           1HG      THR  72  -6.794  -7.220  -7.196
  500   1HG2  THR  72          1HG2      THR  72  -3.458  -9.075  -8.007
  501   2HG2  THR  72          2HG2      THR  72  -5.079  -9.496  -8.563
  502   3HG2  THR  72          3HG2      THR  72  -4.487 -10.113  -7.020
  503    H    ILE  73           H        ILE  73  -3.027  -5.970  -5.326
  504    HA   ILE  73           HA       ILE  73  -4.997  -4.278  -3.944
  505    HB   ILE  73           HB       ILE  73  -2.024  -3.825  -4.133
  506   1HG1  ILE  73          2HG1      ILE  73  -3.535  -5.053  -1.813
  507   2HG1  ILE  73          1HG1      ILE  73  -2.631  -5.995  -3.002
  508   1HG2  ILE  73          1HG2      ILE  73  -2.489  -2.429  -2.093
  509   2HG2  ILE  73          2HG2      ILE  73  -4.208  -2.644  -2.427
  510   3HG2  ILE  73          3HG2      ILE  73  -3.179  -1.817  -3.597
  511   1HD1  ILE  73          1HD1      ILE  73  -1.629  -5.105  -0.657
  512   2HD1  ILE  73          2HD1      ILE  73  -1.117  -3.820  -1.752
  513   3HD1  ILE  73          3HD1      ILE  73  -0.658  -5.492  -2.076
  514    H    ASP  74           H        ASP  74  -6.113  -3.323  -5.614
  515    HA   ASP  74           HA       ASP  74  -5.129  -2.431  -8.041
  516   1HB   ASP  74          2HB       ASP  74  -7.575  -2.440  -6.890
  517   2HB   ASP  74          1HB       ASP  74  -7.195  -0.719  -6.780
  518    H    PHE  75           H        PHE  75  -5.361   0.112  -8.564
  519    HA   PHE  75           HA       PHE  75  -3.026   1.319  -7.724
  520   1HB   PHE  75          2HB       PHE  75  -5.575   2.547  -8.783
  521   2HB   PHE  75          1HB       PHE  75  -4.096   3.474  -8.524
  522    HD1  PHE  75           1HD      PHE  75  -5.678   0.823 -10.513
  523    HD2  PHE  75           2HD      PHE  75  -2.229   3.263 -10.000
  524    HE1  PHE  75           1HE      PHE  75  -4.879   0.157 -12.743
  525    HE2  PHE  75           2HE      PHE  75  -1.425   2.602 -12.230
  526    HZ   PHE  75           HZ       PHE  75  -2.750   1.047 -13.605
  527    H    GLU  76           H        GLU  76  -6.150   2.777  -6.870
  528    HA   GLU  76           HA       GLU  76  -5.156   4.150  -4.635
  529   1HB   GLU  76          2HB       GLU  76  -7.966   3.353  -5.397
  530   2HB   GLU  76          1HB       GLU  76  -7.597   4.376  -4.017
  531   1HG   GLU  76          2HG       GLU  76  -8.126   5.893  -5.670
  532   2HG   GLU  76          1HG       GLU  76  -6.363   5.859  -5.715
  533    H    GLU  77           H        GLU  77  -6.373   0.918  -5.013
  534    HA   GLU  77           HA       GLU  77  -7.144   0.270  -2.445
  535   1HB   GLU  77          2HB       GLU  77  -6.265  -1.183  -4.818
  536   2HB   GLU  77          1HB       GLU  77  -5.858  -2.019  -3.326
  537   1HG   GLU  77          2HG       GLU  77  -8.274  -1.677  -2.645
  538   2HG   GLU  77          1HG       GLU  77  -8.567  -1.201  -4.322
  539    H    PHE  78           H        PHE  78  -3.949   0.908  -3.627
  540    HA   PHE  78           HA       PHE  78  -2.541  -0.465  -1.553
  541   1HB   PHE  78          2HB       PHE  78  -1.497   0.105  -3.726
  542   2HB   PHE  78          1HB       PHE  78  -1.592   1.818  -3.306
  543    HD1  PHE  78           1HD      PHE  78   0.314   2.784  -2.488
  544    HD2  PHE  78           2HD      PHE  78  -0.342  -1.365  -1.806
  545    HE1  PHE  78           1HE      PHE  78   2.491   2.630  -1.351
  546    HE2  PHE  78           2HE      PHE  78   1.833  -1.525  -0.668
  547    HZ   PHE  78           HZ       PHE  78   3.251   0.474  -0.440
  548    H    LEU  79           H        LEU  79  -4.315   2.434  -1.615
  549    HA   LEU  79           HA       LEU  79  -2.847   3.557   0.657
  550   1HB   LEU  79          2HB       LEU  79  -5.206   4.657  -0.886
  551   2HB   LEU  79          1HB       LEU  79  -4.359   5.491   0.403
  552    HG   LEU  79           HG       LEU  79  -2.332   4.889  -1.375
  553   1HD1  LEU  79          1HD1      LEU  79  -4.870   5.465  -2.866
  554   2HD1  LEU  79          2HD1      LEU  79  -3.681   4.196  -3.158
  555   3HD1  LEU  79          3HD1      LEU  79  -3.285   5.875  -3.521
  556   1HD2  LEU  79          1HD2      LEU  79  -3.002   7.024  -0.070
  557   2HD2  LEU  79          2HD2      LEU  79  -3.851   7.460  -1.553
  558   3HD2  LEU  79          3HD2      LEU  79  -2.109   7.186  -1.582
  559    H    VAL  80           H        VAL  80  -6.110   2.497  -0.247
  560    HA   VAL  80           HA       VAL  80  -7.318   2.815   2.250
  561    HB   VAL  80           HB       VAL  80  -8.470   2.299   0.051
  562   1HG1  VAL  80          1HG1      VAL  80  -7.051   0.309  -0.465
  563   2HG1  VAL  80          2HG1      VAL  80  -8.786   0.034  -0.620
  564   3HG1  VAL  80          3HG1      VAL  80  -7.920  -0.565   0.796
  565   1HG2  VAL  80          1HG2      VAL  80  -9.294   0.633   2.425
  566   2HG2  VAL  80          2HG2      VAL  80 -10.338   1.196   1.121
  567   3HG2  VAL  80          3HG2      VAL  80  -9.617   2.357   2.235
  568    H    MET  81           H        MET  81  -5.357   0.211   0.943
  569    HA   MET  81           HA       MET  81  -5.851  -1.850   2.678
  570   1HB   MET  81          2HB       MET  81  -3.289  -2.277   2.439
  571   2HB   MET  81          1HB       MET  81  -4.319  -2.381   1.020
  572   1HG   MET  81          2HG       MET  81  -3.443  -0.539   0.074
  573   2HG   MET  81          1HG       MET  81  -3.086   0.235   1.616
  574   1HE   MET  81          1HE       MET  81  -0.184  -0.533   2.887
  575   2HE   MET  81          2HE       MET  81  -0.467  -2.276   2.869
  576   3HE   MET  81          3HE       MET  81  -1.788  -1.171   3.254
  577    H    MET  82           H        MET  82  -3.823   0.976   3.186
  578    HA   MET  82           HA       MET  82  -3.094   0.141   5.855
  579   1HB   MET  82          2HB       MET  82  -2.134   2.055   3.923
  580   2HB   MET  82          1HB       MET  82  -2.371   2.830   5.493
  581   1HG   MET  82          2HG       MET  82  -1.116   0.626   6.313
  582   2HG   MET  82          1HG       MET  82  -0.453   0.728   4.682
  583   1HE   MET  82          1HE       MET  82  -0.462   3.248   3.893
  584   2HE   MET  82          2HE       MET  82   1.181   3.793   4.242
  585   3HE   MET  82          3HE       MET  82  -0.198   4.619   4.972
  586    H    VAL  83           H        VAL  83  -5.325   2.351   4.309
  587    HA   VAL  83           HA       VAL  83  -6.028   3.946   6.482
  588    HB   VAL  83           HB       VAL  83  -7.706   3.003   4.150
  589   1HG1  VAL  83          1HG1      VAL  83  -8.591   4.327   6.515
  590   2HG1  VAL  83          2HG1      VAL  83  -9.512   3.888   5.078
  591   3HG1  VAL  83          3HG1      VAL  83  -8.699   5.449   5.160
  592   1HG2  VAL  83          1HG2      VAL  83  -5.853   4.332   3.437
  593   2HG2  VAL  83          2HG2      VAL  83  -6.178   5.543   4.675
  594   3HG2  VAL  83          3HG2      VAL  83  -7.307   5.325   3.335
  595    H    ARG  84           H        ARG  84  -6.934   0.672   5.675
  596    HA   ARG  84           HA       ARG  84  -9.056   0.578   7.618
  597   1HB   ARG  84          2HB       ARG  84  -7.778  -1.704   6.111
  598   2HB   ARG  84          1HB       ARG  84  -9.321  -1.735   6.952
  599   1HG   ARG  84          2HG       ARG  84  -9.902   0.228   5.309
  600   2HG   ARG  84          1HG       ARG  84  -8.602  -0.489   4.347
  601   1HD   ARG  84          2HD       ARG  84  -9.862  -2.715   4.794
  602   2HD   ARG  84          1HD       ARG  84 -11.227  -1.663   5.166
  603    HE   ARG  84           HE       ARG  84 -11.498  -1.370   2.928
  604   1HH1  ARG  84          1HH1      ARG  84  -8.167  -2.233   3.503
  605   2HH1  ARG  84          2HH1      ARG  84  -7.760  -2.288   1.821
  606   1HH2  ARG  84          1HH2      ARG  84 -10.967  -1.447   0.716
  607   2HH2  ARG  84          2HH2      ARG  84  -9.350  -1.842   0.237
  608    H    GLN  85           H        GLN  85  -5.654   0.006   7.633
  609    HA   GLN  85           HA       GLN  85  -5.899  -1.354  10.238
  610   1HB   GLN  85          2HB       GLN  85  -3.306  -1.349   8.771
  611   2HB   GLN  85          1HB       GLN  85  -4.001  -2.580   9.825
  612   1HG   GLN  85          2HG       GLN  85  -4.700  -2.003   6.959
  613   2HG   GLN  85          1HG       GLN  85  -3.929  -3.452   7.615
  614   1HE2  GLN  85          1HE2      GLN  85  -6.252  -3.436   6.018
  615   2HE2  GLN  85          2HE2      GLN  85  -7.560  -4.047   6.969
  616    H    MET  86           H        MET  86  -5.427   1.610   8.994
  617    HA   MET  86           HA       MET  86  -3.522   2.361  11.100
  618   1HB   MET  86          2HB       MET  86  -2.521   3.903   9.719
  619   2HB   MET  86          1HB       MET  86  -2.980   2.666   8.553
  620   1HG   MET  86          2HG       MET  86  -4.500   3.975   7.539
  621   2HG   MET  86          1HG       MET  86  -4.921   4.849   9.016
  622   1HE   MET  86          1HE       MET  86  -2.828   4.861   5.744
  623   2HE   MET  86          2HE       MET  86  -1.705   4.139   6.894
  624   3HE   MET  86          3HE       MET  86  -1.372   5.735   6.221
  625    H    LYS  87           H        LYS  87  -6.651   2.916   9.699
  626    HA   LYS  87           HA       LYS  87  -7.150   5.022  11.702
  627   1HB   LYS  87          2HB       LYS  87  -8.535   4.525   9.060
  628   2HB   LYS  87          1HB       LYS  87  -9.019   5.745  10.238
  629   1HG   LYS  87          2HG       LYS  87  -7.638   7.173   9.278
  630   2HG   LYS  87          1HG       LYS  87  -6.279   6.148   9.753
  631   1HD   LYS  87          2HD       LYS  87  -5.883   5.844   7.584
  632   2HD   LYS  87          1HD       LYS  87  -7.367   4.893   7.521
  633   1HE   LYS  87          2HE       LYS  87  -7.300   6.676   5.814
  634   2HE   LYS  87          1HE       LYS  87  -8.642   6.867   6.940
  635   1HZ   LYS  87          1HZ       LYS  87  -6.493   8.642   6.394
  636   2HZ   LYS  87          2HZ       LYS  87  -6.544   8.272   8.042
  637   3HZ   LYS  87          3HZ       LYS  87  -7.908   8.919   7.279
  638    H    GLU  88           H        GLU  88  -7.867   3.840  13.418
  639    HA   GLU  88           HA       GLU  88  -9.299   2.627  14.714
  640   1HB   GLU  88          2HB       GLU  88 -10.887   4.120  13.076
  641   2HB   GLU  88          1HB       GLU  88 -11.458   2.497  12.712
  642   1HG   GLU  88          2HG       GLU  88 -11.489   2.312  15.350
  643   2HG   GLU  88          1HG       GLU  88 -11.647   4.063  15.221
  644    H    ASP  89           H        ASP  89 -11.127   0.682  14.272
  645    HA   ASP  89           HA       ASP  89  -9.531  -1.376  12.911
  646   1HB   ASP  89          2HB       ASP  89 -11.237  -1.358  15.337
  647   2HB   ASP  89          1HB       ASP  89 -11.303  -2.818  14.345
  648    H    ALA  90           H        ALA  90 -10.699  -3.093  11.786
  649    HA   ALA  90           HA       ALA  90 -12.917  -1.981  10.252
  650   1HB   ALA  90          1HB       ALA  90 -11.525  -2.855   8.696
  651   2HB   ALA  90          2HB       ALA  90 -12.445  -4.320   9.035
  652   3HB   ALA  90          3HB       ALA  90 -10.875  -4.069   9.797
  653   2H    ARG 115          HN2       ARG 115   2.748  -1.115  10.113
  654    H    ARG 115           H        ARG 115   1.831  -2.093  11.186
  655   3H    ARG 115          HN3       ARG 115   2.727  -2.820   9.918
  656    HA   ARG 115           HA       ARG 115   1.308  -2.151   8.315
  657   1HB   ARG 115          2HB       ARG 115  -0.398  -2.514  10.789
  658   2HB   ARG 115          1HB       ARG 115  -0.928  -2.760   9.132
  659   1HG   ARG 115          2HG       ARG 115   0.212  -4.733   8.911
  660   2HG   ARG 115          1HG       ARG 115   1.415  -4.300  10.128
  661   1HD   ARG 115          2HD       ARG 115  -0.832  -4.346  11.633
  662   2HD   ARG 115          1HD       ARG 115  -1.219  -5.578  10.433
  663    HE   ARG 115           HE       ARG 115   0.364  -6.945  11.367
  664   1HH1  ARG 115          1HH1      ARG 115   0.813  -3.699  12.567
  665   2HH1  ARG 115          2HH1      ARG 115   1.988  -4.165  13.751
  666   1HH2  ARG 115          1HH2      ARG 115   1.909  -7.561  12.924
  667   2HH2  ARG 115          2HH2      ARG 115   2.610  -6.358  13.954
  668    H    MET 116           H        MET 116   0.285  -0.428  11.274
  669    HA   MET 116           HA       MET 116  -1.236   1.530   9.953
  670   1HB   MET 116          2HB       MET 116  -1.534   1.151  12.316
  671   2HB   MET 116          1HB       MET 116   0.140   1.580  12.643
  672   1HG   MET 116          2HG       MET 116  -0.293   3.874  11.985
  673   2HG   MET 116          1HG       MET 116  -1.957   3.461  11.578
  674   1HE   MET 116          1HE       MET 116  -2.892   5.422  13.145
  675   2HE   MET 116          2HE       MET 116  -1.214   5.863  13.461
  676   3HE   MET 116          3HE       MET 116  -2.340   5.664  14.803
  677    H    SER 117           H        SER 117   1.815   2.184  11.668
  678    HA   SER 117           HA       SER 117   2.315   4.480  10.010
  679   1HB   SER 117          2HB       SER 117   4.521   4.474  11.369
  680   2HB   SER 117          1HB       SER 117   3.011   4.798  12.220
  681    HG   SER 117           HG       SER 117   4.324   2.284  12.070
  682    H    ALA 118           H        ALA 118   2.201   2.751   8.143
  683    HA   ALA 118           HA       ALA 118   4.723   1.434   7.635
  684   1HB   ALA 118          1HB       ALA 118   3.660   0.313   5.976
  685   2HB   ALA 118          2HB       ALA 118   2.739   1.726   5.461
  686   3HB   ALA 118          3HB       ALA 118   2.233   0.814   6.883
  687    H    ASP 119           H        ASP 119   3.808   4.564   7.526
  688    HA   ASP 119           HA       ASP 119   4.421   5.651   5.104
  689   1HB   ASP 119          2HB       ASP 119   3.725   6.874   7.199
  690   2HB   ASP 119          1HB       ASP 119   5.405   6.792   7.722
  691    H    ALA 120           H        ALA 120   6.602   4.166   7.376
  692    HA   ALA 120           HA       ALA 120   9.049   5.193   6.606
  693   1HB   ALA 120          1HB       ALA 120   8.418   2.345   7.373
  694   2HB   ALA 120          2HB       ALA 120   8.799   3.663   8.481
  695   3HB   ALA 120          3HB       ALA 120  10.025   3.071   7.360
  696    H    MET 121           H        MET 121   7.865   2.035   5.421
  697    HA   MET 121           HA       MET 121   9.633   1.841   3.282
  698   1HB   MET 121          2HB       MET 121   8.374  -0.088   3.983
  699   2HB   MET 121          1HB       MET 121   6.851   0.710   3.620
  700   1HG   MET 121          2HG       MET 121   8.153   0.792   1.206
  701   2HG   MET 121          1HG       MET 121   8.668  -0.755   1.874
  702   1HE   MET 121          1HE       MET 121   5.022   0.707   2.814
  703   2HE   MET 121          2HE       MET 121   4.284   0.477   1.229
  704   3HE   MET 121          3HE       MET 121   5.661   1.563   1.411
  705    H    LEU 122           H        LEU 122   6.584   3.508   3.584
  706    HA   LEU 122           HA       LEU 122   6.147   4.037   0.845
  707   1HB   LEU 122          2HB       LEU 122   5.181   5.244   3.408
  708   2HB   LEU 122          1HB       LEU 122   4.833   6.047   1.891
  709    HG   LEU 122           HG       LEU 122   3.812   3.831   1.127
  710   1HD1  LEU 122          1HD1      LEU 122   3.504   3.244   4.042
  711   2HD1  LEU 122          2HD1      LEU 122   4.909   2.647   3.162
  712   3HD1  LEU 122          3HD1      LEU 122   3.288   2.177   2.654
  713   1HD2  LEU 122          1HD2      LEU 122   2.394   5.679   1.587
  714   2HD2  LEU 122          2HD2      LEU 122   2.604   5.493   3.328
  715   3HD2  LEU 122          3HD2      LEU 122   1.702   4.284   2.415
  716    H    ARG 123           H        ARG 123   7.998   5.652   3.362
  717    HA   ARG 123           HA       ARG 123   8.668   7.862   1.586
  718   1HB   ARG 123          2HB       ARG 123   8.205   8.335   3.948
  719   2HB   ARG 123          1HB       ARG 123   9.530   7.284   4.426
  720   1HG   ARG 123          2HG       ARG 123  10.328   9.365   2.546
  721   2HG   ARG 123          1HG       ARG 123   9.684   9.991   4.065
  722   1HD   ARG 123          2HD       ARG 123  11.424   9.207   5.279
  723   2HD   ARG 123          1HD       ARG 123  11.592   7.753   4.294
  724    HE   ARG 123           HE       ARG 123  12.429   9.806   2.683
  725   1HH1  ARG 123          1HH1      ARG 123  13.352   8.561   5.810
  726   2HH1  ARG 123          2HH1      ARG 123  15.009   9.038   5.650
  727   1HH2  ARG 123          1HH2      ARG 123  14.607  10.435   2.470
  728   2HH2  ARG 123          2HH2      ARG 123  15.722  10.103   3.753
  729    H    ALA 124           H        ALA 124   9.789   4.772   2.112
  730    HA   ALA 124           HA       ALA 124  12.562   5.014   2.180
  731   1HB   ALA 124          1HB       ALA 124  10.986   2.929   2.328
  732   2HB   ALA 124          2HB       ALA 124  12.641   2.763   1.743
  733   3HB   ALA 124          3HB       ALA 124  11.303   2.825   0.597
  734    H    LEU 125           H        LEU 125  10.762   4.055  -0.734
  735    HA   LEU 125           HA       LEU 125  12.899   4.953  -2.425
  736   1HB   LEU 125          2HB       LEU 125  10.152   4.002  -3.224
  737   2HB   LEU 125          1HB       LEU 125  11.582   4.073  -4.239
  738    HG   LEU 125           HG       LEU 125  11.592   2.382  -1.769
  739   1HD1  LEU 125          1HD1      LEU 125  10.926   0.491  -3.355
  740   2HD1  LEU 125          2HD1      LEU 125  10.265   1.765  -4.381
  741   3HD1  LEU 125          3HD1      LEU 125   9.654   1.545  -2.742
  742   1HD2  LEU 125          1HD2      LEU 125  13.504   2.986  -3.619
  743   2HD2  LEU 125          2HD2      LEU 125  12.861   1.466  -4.240
  744   3HD2  LEU 125          3HD2      LEU 125  13.496   1.549  -2.597
  745    H    LEU 126           H        LEU 126  10.045   6.359  -1.154
  746    HA   LEU 126           HA       LEU 126   9.107   8.414  -1.378
  747   1HB   LEU 126          2HB       LEU 126  11.587   9.015  -2.993
  748   2HB   LEU 126          1HB       LEU 126  10.436  10.210  -2.429
  749    HG   LEU 126           HG       LEU 126  11.920   8.418  -0.522
  750   1HD1  LEU 126          1HD1      LEU 126  12.763  11.130  -1.536
  751   2HD1  LEU 126          2HD1      LEU 126  13.585   9.599  -1.842
  752   3HD1  LEU 126          3HD1      LEU 126  13.513  10.249  -0.205
  753   1HD2  LEU 126          1HD2      LEU 126  11.474  10.456   0.953
  754   2HD2  LEU 126          2HD2      LEU 126  10.097   9.432   0.545
  755   3HD2  LEU 126          3HD2      LEU 126  10.339  10.961  -0.299
  756    H    GLY 127           H        GLY 127  10.725   8.118  -4.543
  757   1HA   GLY 127          2HA       GLY 127   9.194   7.197  -6.354
  758   2HA   GLY 127          1HA       GLY 127   8.068   8.425  -5.791
  759    H    SER 128           H        SER 128   8.085  10.305  -6.829
  760    HA   SER 128           HA       SER 128  10.564  11.285  -8.016
  761   1HB   SER 128          2HB       SER 128   8.023  10.786  -9.578
  762   2HB   SER 128          1HB       SER 128   9.341  11.803 -10.160
  763    HG   SER 128           HG       SER 128  10.086   9.980 -10.900
  764    H    LYS 129           H        LYS 129  10.684  13.088  -6.790
  765    HA   LYS 129           HA       LYS 129   8.571  15.077  -7.165
  766   1HB   LYS 129          2HB       LYS 129   9.217  13.752  -4.665
  767   2HB   LYS 129          1HB       LYS 129   9.437  15.491  -4.541
  768   1HG   LYS 129          2HG       LYS 129   7.196  15.931  -5.016
  769   2HG   LYS 129          1HG       LYS 129   6.929  14.318  -5.683
  770   1HD   LYS 129          2HD       LYS 129   6.018  13.909  -3.661
  771   2HD   LYS 129          1HD       LYS 129   7.698  13.696  -3.165
  772   1HE   LYS 129          2HE       LYS 129   7.318  15.283  -1.646
  773   2HE   LYS 129          1HE       LYS 129   7.300  16.427  -2.987
  774   1HZ   LYS 129          1HZ       LYS 129   4.897  14.996  -1.992
  775   2HZ   LYS 129          2HZ       LYS 129   4.939  16.240  -3.136
  776   3HZ   LYS 129          3HZ       LYS 129   5.330  16.563  -1.523
  777    H    HIS 130           H        HIS 130  11.244  14.715  -8.283
  778    HA   HIS 130           HA       HIS 130  12.866  16.768  -7.025
  779   1HB   HIS 130          2HB       HIS 130  13.268  14.776  -9.210
  780   2HB   HIS 130          1HB       HIS 130  14.285  16.213  -9.197
  781    HD1  HIS 130           1HD      HIS 130  14.740  16.452  -6.148
  782    HD2  HIS 130           2HD      HIS 130  15.038  12.911  -8.302
  783    HE1  HIS 130           1HE      HIS 130  16.231  14.958  -4.781
  784    HE2  HIS 130           2HE      HIS 130  16.471  12.854  -6.149
  785    H    LYS 131           H        LYS 131  12.092  18.775  -7.346
  786    HA   LYS 131           HA       LYS 131  11.109  19.537  -9.989
  787   1HB   LYS 131          2HB       LYS 131  10.890  20.693  -7.243
  788   2HB   LYS 131          1HB       LYS 131  10.722  21.768  -8.625
  789   1HG   LYS 131          2HG       LYS 131   8.542  21.108  -8.037
  790   2HG   LYS 131          1HG       LYS 131   8.954  20.188  -9.485
  791   1HD   LYS 131          2HD       LYS 131   8.809  18.228  -8.409
  792   2HD   LYS 131          1HD       LYS 131   9.699  18.833  -7.011
  793   1HE   LYS 131          2HE       LYS 131   7.821  19.330  -5.873
  794   2HE   LYS 131          1HE       LYS 131   6.987  19.917  -7.311
  795   1HZ   LYS 131          1HZ       LYS 131   6.080  17.914  -7.706
  796   2HZ   LYS 131          2HZ       LYS 131   6.358  17.656  -6.058
  797   3HZ   LYS 131          3HZ       LYS 131   7.448  17.053  -7.202
  Start of MODEL   20
    1   2H    ALA   1          HN2       ALA   1 -18.468  -1.575 -12.581
    2    H    ALA   1           H        ALA   1 -17.639  -2.946 -13.197
    3   3H    ALA   1          HN3       ALA   1 -17.899  -2.790 -11.510
    4    HA   ALA   1           HA       ALA   1 -15.632  -2.266 -12.432
    5   1HB   ALA   1          1HB       ALA   1 -16.727   0.452 -12.933
    6   2HB   ALA   1          2HB       ALA   1 -16.892  -0.764 -14.200
    7   3HB   ALA   1          3HB       ALA   1 -15.293  -0.332 -13.596
    8    H    SER   2           H        SER   2 -18.256  -0.641 -10.767
    9    HA   SER   2           HA       SER   2 -16.369   0.223  -8.680
   10   1HB   SER   2          2HB       SER   2 -19.163   1.220  -9.289
   11   2HB   SER   2          1HB       SER   2 -18.143   1.799  -7.971
   12    HG   SER   2           HG       SER   2 -17.309   1.863 -10.673
   13    H    MET   3           H        MET   3 -16.527  -0.570  -6.661
   14    HA   MET   3           HA       MET   3 -18.932  -2.004  -5.852
   15   1HB   MET   3          2HB       MET   3 -16.178  -3.211  -6.030
   16   2HB   MET   3          1HB       MET   3 -17.402  -3.855  -4.943
   17   1HG   MET   3          2HG       MET   3 -18.199  -3.472  -7.761
   18   2HG   MET   3          1HG       MET   3 -17.031  -4.749  -7.427
   19   1HE   MET   3          1HE       MET   3 -20.606  -3.377  -6.093
   20   2HE   MET   3          2HE       MET   3 -19.460  -3.587  -4.769
   21   3HE   MET   3          3HE       MET   3 -20.857  -4.655  -4.905
   22    H    THR   4           H        THR   4 -15.589  -1.473  -4.722
   23    HA   THR   4           HA       THR   4 -16.700  -0.569  -2.152
   24    HB   THR   4           HB       THR   4 -14.409  -1.095  -1.252
   25    HG1  THR   4           1HG      THR   4 -13.058  -1.220  -2.904
   26   1HG2  THR   4          1HG2      THR   4 -14.970  -3.708  -2.240
   27   2HG2  THR   4          2HG2      THR   4 -16.483  -2.888  -1.851
   28   3HG2  THR   4          3HG2      THR   4 -15.225  -3.046  -0.626
   29    H    ASP   5           H        ASP   5 -16.836   1.586  -2.153
   30    HA   ASP   5           HA       ASP   5 -15.052   3.251  -3.650
   31   1HB   ASP   5          2HB       ASP   5 -16.264   5.117  -2.438
   32   2HB   ASP   5          1HB       ASP   5 -17.278   4.048  -3.412
   33    H    GLN   6           H        GLN   6 -14.655   1.664  -0.752
   34    HA   GLN   6           HA       GLN   6 -13.559   3.428   1.031
   35   1HB   GLN   6          2HB       GLN   6 -12.283   1.590   1.927
   36   2HB   GLN   6          1HB       GLN   6 -13.846   0.985   1.401
   37   1HG   GLN   6          2HG       GLN   6 -12.892   0.009  -0.553
   38   2HG   GLN   6          1HG       GLN   6 -11.341   0.786  -0.249
   39   1HE2  GLN   6          1HE2      GLN   6 -13.572  -1.015   1.835
   40   2HE2  GLN   6          2HE2      GLN   6 -12.417  -2.193   2.347
   41    H    GLN   7           H        GLN   7 -12.215   2.313  -1.978
   42    HA   GLN   7           HA       GLN   7  -9.530   3.081  -1.576
   43   1HB   GLN   7          2HB       GLN   7  -9.618   3.348  -4.175
   44   2HB   GLN   7          1HB       GLN   7  -9.741   1.749  -3.451
   45   1HG   GLN   7          2HG       GLN   7 -11.943   1.517  -4.026
   46   2HG   GLN   7          1HG       GLN   7 -12.244   3.256  -4.005
   47   1HE2  GLN   7          1HE2      GLN   7 -10.330   0.845  -5.765
   48   2HE2  GLN   7          2HE2      GLN   7 -10.571   1.543  -7.328
   49    H    ALA   8           H        ALA   8 -12.377   4.830  -2.568
   50    HA   ALA   8           HA       ALA   8 -11.008   7.145  -3.473
   51   1HB   ALA   8          1HB       ALA   8 -13.683   6.224  -3.407
   52   2HB   ALA   8          2HB       ALA   8 -13.030   7.624  -4.259
   53   3HB   ALA   8          3HB       ALA   8 -13.650   7.801  -2.617
   54    H    GLU   9           H        GLU   9 -12.839   6.446  -0.489
   55    HA   GLU   9           HA       GLU   9 -12.392   8.846   0.833
   56   1HB   GLU   9          2HB       GLU   9 -12.503   6.102   2.102
   57   2HB   GLU   9          1HB       GLU   9 -12.820   7.634   2.904
   58   1HG   GLU   9          2HG       GLU   9 -14.457   6.976   0.524
   59   2HG   GLU   9          1HG       GLU   9 -14.756   6.062   2.007
   60    H    ALA  10           H        ALA  10 -10.388   5.973   0.588
   61    HA   ALA  10           HA       ALA  10  -8.401   6.328   2.387
   62   1HB   ALA  10          1HB       ALA  10  -7.895   4.498   1.201
   63   2HB   ALA  10          2HB       ALA  10  -6.982   5.594   0.167
   64   3HB   ALA  10          3HB       ALA  10  -8.629   5.134  -0.271
   65    H    ARG  11           H        ARG  11  -8.225   7.637  -0.930
   66    HA   ARG  11           HA       ARG  11  -5.945   9.167  -0.632
   67   1HB   ARG  11          2HB       ARG  11  -8.187   9.050  -2.500
   68   2HB   ARG  11          1HB       ARG  11  -7.507  10.666  -2.360
   69   1HG   ARG  11          2HG       ARG  11  -5.246   9.610  -2.763
   70   2HG   ARG  11          1HG       ARG  11  -6.119   8.139  -3.200
   71   1HD   ARG  11          2HD       ARG  11  -5.531   9.504  -5.162
   72   2HD   ARG  11          1HD       ARG  11  -7.274   9.309  -4.974
   73    HE   ARG  11           HE       ARG  11  -6.461  11.683  -3.704
   74   1HH1  ARG  11          1HH1      ARG  11  -6.829  10.336  -6.903
   75   2HH1  ARG  11          2HH1      ARG  11  -7.125  11.870  -7.650
   76   1HH2  ARG  11          1HH2      ARG  11  -6.848  13.701  -4.685
   77   2HH2  ARG  11          2HH2      ARG  11  -7.135  13.781  -6.392
   78    H    ALA  12           H        ALA  12  -9.153   9.777   0.529
   79    HA   ALA  12           HA       ALA  12  -8.526  12.554   1.178
   80   1HB   ALA  12          1HB       ALA  12 -11.082  11.003   1.576
   81   2HB   ALA  12          2HB       ALA  12 -10.720  12.065   0.216
   82   3HB   ALA  12          3HB       ALA  12 -10.865  12.733   1.842
   83    H    PHE  13           H        PHE  13  -8.547   9.442   2.637
   84    HA   PHE  13           HA       PHE  13  -8.935  10.332   5.335
   85   1HB   PHE  13          2HB       PHE  13  -8.694   7.825   3.963
   86   2HB   PHE  13          1HB       PHE  13  -7.574   7.846   5.328
   87    HD1  PHE  13           1HD      PHE  13 -10.943   7.377   4.295
   88    HD2  PHE  13           2HD      PHE  13  -8.527   8.509   7.610
   89    HE1  PHE  13           1HE      PHE  13 -12.806   6.872   5.821
   90    HE2  PHE  13           2HE      PHE  13 -10.385   8.004   9.142
   91    HZ   PHE  13           HZ       PHE  13 -12.527   7.184   8.249
   92    H    LEU  14           H        LEU  14  -6.326  10.461   3.182
   93    HA   LEU  14           HA       LEU  14  -4.488  10.983   5.419
   94   1HB   LEU  14          2HB       LEU  14  -3.524   9.853   2.814
   95   2HB   LEU  14          1HB       LEU  14  -2.717   9.864   4.378
   96    HG   LEU  14           HG       LEU  14  -5.151   8.367   4.604
   97   1HD1  LEU  14          1HD1      LEU  14  -4.278   8.210   2.017
   98   2HD1  LEU  14          2HD1      LEU  14  -5.225   6.981   2.855
   99   3HD1  LEU  14          3HD1      LEU  14  -3.470   6.837   2.774
  100   1HD2  LEU  14          1HD2      LEU  14  -3.828   7.010   5.810
  101   2HD2  LEU  14          2HD2      LEU  14  -2.669   8.332   5.675
  102   3HD2  LEU  14          3HD2      LEU  14  -2.574   6.959   4.572
  103    H    SER  15           H        SER  15  -2.489  12.212   4.576
  104    HA   SER  15           HA       SER  15  -3.485  14.535   3.135
  105   1HB   SER  15          2HB       SER  15  -0.663  14.409   4.090
  106   2HB   SER  15          1HB       SER  15  -1.826  15.739   4.170
  107    HG   SER  15           HG       SER  15  -2.562  15.005   6.026
  108    H    GLU  16           H        GLU  16  -2.099  15.560   1.465
  109    HA   GLU  16           HA       GLU  16  -1.644  13.930  -0.712
  110   1HB   GLU  16          2HB       GLU  16  -1.168  16.683  -0.028
  111   2HB   GLU  16          1HB       GLU  16   0.208  16.059  -0.927
  112   1HG   GLU  16          2HG       GLU  16  -0.973  16.575  -2.739
  113   2HG   GLU  16          1HG       GLU  16  -1.894  15.114  -2.385
  114    H    GLU  17           H        GLU  17   0.381  14.573   2.018
  115    HA   GLU  17           HA       GLU  17   2.878  13.798   1.017
  116   1HB   GLU  17          2HB       GLU  17   1.619  14.087   3.682
  117   2HB   GLU  17          1HB       GLU  17   3.030  13.036   3.611
  118   1HG   GLU  17          2HG       GLU  17   4.191  14.912   3.924
  119   2HG   GLU  17          1HG       GLU  17   3.899  15.195   2.208
  120    H    MET  18           H        MET  18   0.618  11.875   3.002
  121    HA   MET  18           HA       MET  18   1.919   9.432   2.778
  122   1HB   MET  18          2HB       MET  18  -0.276  10.290   4.094
  123   2HB   MET  18          1HB       MET  18  -1.045   9.361   2.808
  124   1HG   MET  18          2HG       MET  18  -0.812   7.867   4.584
  125   2HG   MET  18          1HG       MET  18   0.495   7.453   3.476
  126   1HE   MET  18          1HE       MET  18  -0.136   7.077   6.818
  127   2HE   MET  18          2HE       MET  18   1.514   7.063   7.440
  128   3HE   MET  18          3HE       MET  18   1.101   6.107   6.018
  129    H    ILE  19           H        ILE  19   0.021  11.131   0.443
  130    HA   ILE  19           HA       ILE  19  -0.653   8.873  -1.177
  131    HB   ILE  19           HB       ILE  19  -0.679  11.842  -1.669
  132   1HG1  ILE  19          2HG1      ILE  19  -2.878   9.767  -1.541
  133   2HG1  ILE  19          1HG1      ILE  19  -2.439  10.875  -0.237
  134   1HG2  ILE  19          1HG2      ILE  19  -0.273  11.248  -3.833
  135   2HG2  ILE  19          2HG2      ILE  19  -2.023  11.020  -3.793
  136   3HG2  ILE  19          3HG2      ILE  19  -0.947   9.630  -3.635
  137   1HD1  ILE  19          1HD1      ILE  19  -3.639  12.525  -1.115
  138   2HD1  ILE  19          2HD1      ILE  19  -4.363  11.295  -2.151
  139   3HD1  ILE  19          3HD1      ILE  19  -2.998  12.248  -2.735
  140    H    ALA  20           H        ALA  20   1.534  11.609  -1.812
  141    HA   ALA  20           HA       ALA  20   2.827  10.634  -4.024
  142   1HB   ALA  20          1HB       ALA  20   3.133  12.788  -2.282
  143   2HB   ALA  20          2HB       ALA  20   3.959  12.533  -3.820
  144   3HB   ALA  20          3HB       ALA  20   4.707  11.993  -2.316
  145    H    GLU  21           H        GLU  21   3.209   9.666  -0.709
  146    HA   GLU  21           HA       GLU  21   5.693   8.279  -1.114
  147   1HB   GLU  21          2HB       GLU  21   3.785   7.815   1.169
  148   2HB   GLU  21          1HB       GLU  21   5.532   7.624   1.151
  149   1HG   GLU  21          2HG       GLU  21   4.860  10.330   0.516
  150   2HG   GLU  21          1HG       GLU  21   4.039   9.843   1.997
  151    H    PHE  22           H        PHE  22   2.277   7.501  -1.173
  152    HA   PHE  22           HA       PHE  22   2.477   4.692  -1.118
  153   1HB   PHE  22          2HB       PHE  22   0.401   6.500  -2.369
  154   2HB   PHE  22          1HB       PHE  22   0.231   4.755  -2.252
  155    HD1  PHE  22           1HD      PHE  22   1.470   4.495   0.540
  156    HD2  PHE  22           2HD      PHE  22  -1.471   7.105  -1.084
  157    HE1  PHE  22           1HE      PHE  22   0.467   4.751   2.772
  158    HE2  PHE  22           2HE      PHE  22  -2.476   7.368   1.145
  159    HZ   PHE  22           HZ       PHE  22  -1.506   6.189   3.077
  160    H    LYS  23           H        LYS  23   2.345   6.990  -3.809
  161    HA   LYS  23           HA       LYS  23   2.527   5.047  -5.861
  162   1HB   LYS  23          2HB       LYS  23   1.675   7.379  -6.155
  163   2HB   LYS  23          1HB       LYS  23   3.333   7.958  -5.984
  164   1HG   LYS  23          2HG       LYS  23   2.908   5.869  -8.016
  165   2HG   LYS  23          1HG       LYS  23   2.165   7.436  -8.345
  166   1HD   LYS  23          2HD       LYS  23   4.628   8.204  -7.516
  167   2HD   LYS  23          1HD       LYS  23   5.002   6.653  -8.283
  168   1HE   LYS  23          2HE       LYS  23   3.530   8.964  -9.548
  169   2HE   LYS  23          1HE       LYS  23   5.193   8.483  -9.880
  170   1HZ   LYS  23          1HZ       LYS  23   2.703   7.297 -10.789
  171   2HZ   LYS  23          2HZ       LYS  23   3.918   6.202 -10.359
  172   3HZ   LYS  23          3HZ       LYS  23   4.213   7.365 -11.550
  173    H    ALA  24           H        ALA  24   4.808   6.290  -3.688
  174    HA   ALA  24           HA       ALA  24   7.185   6.448  -5.020
  175   1HB   ALA  24          1HB       ALA  24   8.253   6.109  -2.971
  176   2HB   ALA  24          2HB       ALA  24   6.988   5.032  -2.382
  177   3HB   ALA  24          3HB       ALA  24   6.673   6.761  -2.536
  178    H    ALA  25           H        ALA  25   6.342   3.479  -3.244
  179    HA   ALA  25           HA       ALA  25   8.119   1.935  -4.899
  180   1HB   ALA  25          1HB       ALA  25   7.889   1.561  -2.463
  181   2HB   ALA  25          2HB       ALA  25   7.623   0.103  -3.422
  182   3HB   ALA  25          3HB       ALA  25   6.248   0.976  -2.741
  183    H    PHE  26           H        PHE  26   5.056   3.006  -5.431
  184    HA   PHE  26           HA       PHE  26   3.587   0.799  -6.252
  185   1HB   PHE  26          2HB       PHE  26   2.729   3.135  -6.074
  186   2HB   PHE  26          1HB       PHE  26   3.581   3.521  -7.566
  187    HD1  PHE  26           1HD      PHE  26   2.943   2.267  -9.668
  188    HD2  PHE  26           2HD      PHE  26   0.603   2.177  -6.114
  189    HE1  PHE  26           1HE      PHE  26   0.998   1.510 -10.972
  190    HE2  PHE  26           2HE      PHE  26  -1.345   1.418  -7.411
  191    HZ   PHE  26           HZ       PHE  26  -1.149   1.084  -9.844
  192    H    ASP  27           H        ASP  27   6.229   2.444  -7.832
  193    HA   ASP  27           HA       ASP  27   5.805   1.177 -10.381
  194   1HB   ASP  27          2HB       ASP  27   8.097   2.123 -10.887
  195   2HB   ASP  27          1HB       ASP  27   6.875   3.308 -10.436
  196    H    MET  28           H        MET  28   8.184   0.821  -7.756
  197    HA   MET  28           HA       MET  28   9.513  -1.393  -8.928
  198   1HB   MET  28          2HB       MET  28  10.098   0.269  -6.881
  199   2HB   MET  28          1HB       MET  28   9.537  -1.131  -5.977
  200   1HG   MET  28          2HG       MET  28  11.776  -1.564  -6.125
  201   2HG   MET  28          1HG       MET  28  11.168  -2.436  -7.537
  202   1HE   MET  28          1HE       MET  28  14.484   0.290  -7.296
  203   2HE   MET  28          2HE       MET  28  13.414  -0.272  -6.011
  204   3HE   MET  28          3HE       MET  28  13.132   1.293  -6.773
  205    H    PHE  29           H        PHE  29   6.672  -1.059  -6.962
  206    HA   PHE  29           HA       PHE  29   6.455  -3.609  -5.867
  207   1HB   PHE  29          2HB       PHE  29   4.577  -1.415  -6.532
  208   2HB   PHE  29          1HB       PHE  29   3.860  -3.012  -6.319
  209    HD1  PHE  29           1HD      PHE  29   5.225  -4.237  -4.175
  210    HD2  PHE  29           2HD      PHE  29   4.271  -0.123  -4.676
  211    HE1  PHE  29           1HE      PHE  29   5.281  -3.929  -1.735
  212    HE2  PHE  29           2HE      PHE  29   4.328   0.192  -2.238
  213    HZ   PHE  29           HZ       PHE  29   4.832  -1.714  -0.763
  214    H    ASP  30           H        ASP  30   4.641  -2.477  -8.720
  215    HA   ASP  30           HA       ASP  30   3.855  -5.002  -9.593
  216   1HB   ASP  30          2HB       ASP  30   4.250  -2.435 -11.142
  217   2HB   ASP  30          1HB       ASP  30   3.487  -3.881 -11.812
  218    H    ALA  31           H        ALA  31   5.014  -6.633 -10.310
  219    HA   ALA  31           HA       ALA  31   7.688  -6.159 -11.390
  220   1HB   ALA  31          1HB       ALA  31   7.371  -7.821  -9.581
  221   2HB   ALA  31          2HB       ALA  31   8.081  -8.509 -11.042
  222   3HB   ALA  31          3HB       ALA  31   6.376  -8.777 -10.679
  223    H    ASP  32           H        ASP  32   4.679  -7.846 -12.230
  224    HA   ASP  32           HA       ASP  32   5.498  -8.762 -14.757
  225   1HB   ASP  32          2HB       ASP  32   3.076  -9.012 -15.225
  226   2HB   ASP  32          1HB       ASP  32   3.533  -9.677 -13.654
  227    H    GLY  33           H        GLY  33   4.635  -5.627 -13.656
  228   1HA   GLY  33          2HA       GLY  33   5.495  -4.017 -15.514
  229   2HA   GLY  33          1HA       GLY  33   4.125  -4.685 -16.390
  230    H    GLY  34           H        GLY  34   1.977  -4.357 -15.480
  231   1HA   GLY  34          2HA       GLY  34   1.795  -2.169 -13.532
  232   2HA   GLY  34          1HA       GLY  34   1.057  -1.943 -15.116
  233    H    GLY  35           H        GLY  35   1.166  -4.743 -12.913
  234   1HA   GLY  35          2HA       GLY  35  -1.721  -5.055 -13.277
  235   2HA   GLY  35          1HA       GLY  35  -0.626  -6.239 -12.565
  236    H    ASP  36           H        ASP  36  -0.643  -6.444 -10.422
  237    HA   ASP  36           HA       ASP  36  -1.465  -4.176  -8.767
  238   1HB   ASP  36          2HB       ASP  36  -2.686  -6.937  -8.542
  239   2HB   ASP  36          1HB       ASP  36  -2.998  -5.579  -7.456
  240    H    ILE  37           H        ILE  37  -1.410  -5.146  -6.317
  241    HA   ILE  37           HA       ILE  37   1.272  -6.340  -6.066
  242    HB   ILE  37           HB       ILE  37  -0.158  -4.316  -4.356
  243   1HG1  ILE  37          2HG1      ILE  37   2.661  -4.251  -5.413
  244   2HG1  ILE  37          1HG1      ILE  37   1.290  -3.712  -6.386
  245   1HG2  ILE  37          1HG2      ILE  37   1.776  -4.478  -2.792
  246   2HG2  ILE  37          2HG2      ILE  37   2.265  -5.952  -3.627
  247   3HG2  ILE  37          3HG2      ILE  37   0.719  -5.889  -2.782
  248   1HD1  ILE  37          1HD1      ILE  37   2.190  -2.579  -3.750
  249   2HD1  ILE  37          2HD1      ILE  37   0.737  -2.081  -4.619
  250   3HD1  ILE  37          3HD1      ILE  37   2.329  -1.824  -5.337
  251    H    SER  38           H        SER  38   1.230  -8.378  -5.423
  252    HA   SER  38           HA       SER  38  -0.982  -9.306  -3.730
  253   1HB   SER  38          2HB       SER  38   0.984 -11.133  -5.087
  254   2HB   SER  38          1HB       SER  38  -0.689 -11.454  -4.610
  255    HG   SER  38           HG       SER  38   0.153  -9.719  -6.697
  256    H    THR  39           H        THR  39   0.227 -11.606  -2.708
  257    HA   THR  39           HA       THR  39   1.571 -10.551  -0.452
  258    HB   THR  39           HB       THR  39   1.882 -12.917   0.200
  259    HG1  THR  39           1HG      THR  39   1.526 -14.515  -1.173
  260   1HG2  THR  39          1HG2      THR  39  -0.761 -11.909  -0.671
  261   2HG2  THR  39          2HG2      THR  39  -0.189 -12.372   0.933
  262   3HG2  THR  39          3HG2      THR  39  -0.628 -13.615  -0.239
  263    H    LYS  40           H        LYS  40   2.690 -11.598  -3.528
  264    HA   LYS  40           HA       LYS  40   5.408 -12.057  -2.595
  265   1HB   LYS  40          2HB       LYS  40   3.992 -13.203  -4.596
  266   2HB   LYS  40          1HB       LYS  40   4.847 -11.953  -5.499
  267   1HG   LYS  40          2HG       LYS  40   6.584 -13.322  -5.603
  268   2HG   LYS  40          1HG       LYS  40   6.780 -13.119  -3.857
  269   1HD   LYS  40          2HD       LYS  40   4.876 -14.971  -3.817
  270   2HD   LYS  40          1HD       LYS  40   5.569 -15.356  -5.393
  271   1HE   LYS  40          2HE       LYS  40   7.523 -14.936  -3.238
  272   2HE   LYS  40          1HE       LYS  40   6.475 -16.338  -3.031
  273   1HZ   LYS  40          1HZ       LYS  40   8.724 -16.389  -4.439
  274   2HZ   LYS  40          2HZ       LYS  40   7.635 -15.996  -5.672
  275   3HZ   LYS  40          3HZ       LYS  40   7.409 -17.403  -4.761
  276    H    GLU  41           H        GLU  41   3.521  -9.597  -4.186
  277    HA   GLU  41           HA       GLU  41   5.756  -8.087  -5.141
  278   1HB   GLU  41          2HB       GLU  41   2.834  -7.432  -4.803
  279   2HB   GLU  41          1HB       GLU  41   4.001  -6.276  -5.432
  280   1HG   GLU  41          2HG       GLU  41   4.466  -8.496  -6.970
  281   2HG   GLU  41          1HG       GLU  41   2.720  -8.544  -6.732
  282    H    LEU  42           H        LEU  42   4.029  -8.280  -2.141
  283    HA   LEU  42           HA       LEU  42   4.930  -5.724  -1.172
  284   1HB   LEU  42          2HB       LEU  42   2.918  -7.470  -0.459
  285   2HB   LEU  42          1HB       LEU  42   4.078  -7.649   0.852
  286    HG   LEU  42           HG       LEU  42   2.499  -5.980   1.500
  287   1HD1  LEU  42          1HD1      LEU  42   3.934  -4.015   1.792
  288   2HD1  LEU  42          2HD1      LEU  42   5.056  -4.661   0.595
  289   3HD1  LEU  42          3HD1      LEU  42   4.804  -5.515   2.117
  290   1HD2  LEU  42          1HD2      LEU  42   1.823  -5.499  -0.907
  291   2HD2  LEU  42          2HD2      LEU  42   3.172  -4.362  -0.940
  292   3HD2  LEU  42          3HD2      LEU  42   1.851  -4.131   0.206
  293    H    GLY  43           H        GLY  43   5.709  -9.117  -0.415
  294   1HA   GLY  43          2HA       GLY  43   7.684  -8.639   1.492
  295   2HA   GLY  43          1HA       GLY  43   7.605 -10.066   0.463
  296    H    THR  44           H        THR  44   7.803  -8.164  -1.923
  297    HA   THR  44           HA       THR  44  10.560  -8.451  -2.363
  298    HB   THR  44           HB       THR  44   8.342  -6.997  -3.754
  299    HG1  THR  44           1HG      THR  44  10.162  -9.016  -4.557
  300   1HG2  THR  44          1HG2      THR  44  10.123  -6.654  -5.623
  301   2HG2  THR  44          2HG2      THR  44  11.245  -6.579  -4.264
  302   3HG2  THR  44          3HG2      THR  44   9.904  -5.437  -4.364
  303    H    VAL  45           H        VAL  45   9.011  -5.284  -2.587
  304    HA   VAL  45           HA       VAL  45  11.273  -3.796  -2.024
  305    HB   VAL  45           HB       VAL  45   9.405  -2.736  -3.047
  306   1HG1  VAL  45          1HG1      VAL  45   7.557  -3.949  -2.257
  307   2HG1  VAL  45          2HG1      VAL  45   7.313  -2.299  -1.680
  308   3HG1  VAL  45          3HG1      VAL  45   7.901  -3.542  -0.575
  309   1HG2  VAL  45          1HG2      VAL  45  10.750  -1.628  -0.880
  310   2HG2  VAL  45          2HG2      VAL  45   9.058  -1.208  -0.614
  311   3HG2  VAL  45          3HG2      VAL  45   9.851  -0.760  -2.123
  312    H    MET  46           H        MET  46   8.850  -5.071   0.210
  313    HA   MET  46           HA       MET  46   9.718  -3.642   2.480
  314   1HB   MET  46          2HB       MET  46   8.055  -6.081   2.028
  315   2HB   MET  46          1HB       MET  46   8.620  -5.734   3.664
  316   1HG   MET  46          2HG       MET  46   6.980  -3.900   1.922
  317   2HG   MET  46          1HG       MET  46   6.389  -4.849   3.291
  318   1HE   MET  46          1HE       MET  46   5.893  -1.595   4.823
  319   2HE   MET  46          2HE       MET  46   6.083  -3.068   5.780
  320   3HE   MET  46          3HE       MET  46   5.296  -3.136   4.204
  321    H    ARG  47           H        ARG  47  11.000  -6.433   0.884
  322    HA   ARG  47           HA       ARG  47  12.552  -7.267   3.189
  323   1HB   ARG  47          2HB       ARG  47  12.161  -8.300   0.411
  324   2HB   ARG  47          1HB       ARG  47  13.578  -8.808   1.321
  325   1HG   ARG  47          2HG       ARG  47  12.267  -9.833   2.988
  326   2HG   ARG  47          1HG       ARG  47  10.791  -9.057   2.411
  327   1HD   ARG  47          2HD       ARG  47  10.390 -10.873   1.195
  328   2HD   ARG  47          1HD       ARG  47  11.802 -10.465   0.215
  329    HE   ARG  47           HE       ARG  47  11.608 -12.527   2.226
  330   1HH1  ARG  47          1HH1      ARG  47  13.753 -10.518   0.342
  331   2HH1  ARG  47          2HH1      ARG  47  15.104 -11.586   0.513
  332   1HH2  ARG  47          1HH2      ARG  47  13.384 -13.931   2.450
  333   2HH2  ARG  47          2HH2      ARG  47  14.895 -13.524   1.707
  334    H    MET  48           H        MET  48  13.074  -5.571   0.141
  335    HA   MET  48           HA       MET  48  15.933  -5.489   0.486
  336   1HB   MET  48          2HB       MET  48  15.876  -3.981  -1.497
  337   2HB   MET  48          1HB       MET  48  15.088  -5.536  -1.761
  338   1HG   MET  48          2HG       MET  48  13.077  -4.608  -2.084
  339   2HG   MET  48          1HG       MET  48  13.313  -3.398  -0.824
  340   1HE   MET  48          1HE       MET  48  12.702  -0.757  -3.436
  341   2HE   MET  48          2HE       MET  48  12.468  -1.325  -1.782
  342   3HE   MET  48          3HE       MET  48  11.749  -2.211  -3.129
  343    H    LEU  49           H        LEU  49  13.263  -3.593   1.520
  344    HA   LEU  49           HA       LEU  49  14.786  -1.167   1.888
  345   1HB   LEU  49          2HB       LEU  49  11.999  -2.004   2.660
  346   2HB   LEU  49          1HB       LEU  49  12.684  -0.463   3.144
  347    HG   LEU  49           HG       LEU  49  12.348  -1.352   0.279
  348   1HD1  LEU  49          1HD1      LEU  49  10.167  -1.060   1.061
  349   2HD1  LEU  49          2HD1      LEU  49  10.581   0.497   0.341
  350   3HD1  LEU  49          3HD1      LEU  49  10.624   0.296   2.092
  351   1HD2  LEU  49          1HD2      LEU  49  14.056   0.211   0.247
  352   2HD2  LEU  49          2HD2      LEU  49  13.383   1.125   1.596
  353   3HD2  LEU  49          3HD2      LEU  49  12.622   1.210   0.008
  354    H    GLY  50           H        GLY  50  13.356  -3.656   3.986
  355   1HA   GLY  50          2HA       GLY  50  15.306  -4.014   5.799
  356   2HA   GLY  50          1HA       GLY  50  14.601  -2.491   6.336
  357    H    GLN  51           H        GLN  51  11.915  -3.459   5.330
  358    HA   GLN  51           HA       GLN  51  10.995  -4.515   7.794
  359   1HB   GLN  51          2HB       GLN  51   9.846  -3.370   5.498
  360   2HB   GLN  51          1HB       GLN  51   9.143  -4.982   5.622
  361   1HG   GLN  51          2HG       GLN  51   9.223  -3.058   7.929
  362   2HG   GLN  51          1HG       GLN  51   7.899  -3.106   6.765
  363   1HE2  GLN  51          1HE2      GLN  51   6.413  -4.719   6.874
  364   2HE2  GLN  51          2HE2      GLN  51   6.377  -5.911   8.124
  365    H    ASN  52           H        ASN  52   9.799  -6.570   8.037
  366    HA   ASN  52           HA       ASN  52  10.619  -8.687   6.206
  367   1HB   ASN  52          2HB       ASN  52  11.422 -10.107   8.055
  368   2HB   ASN  52          1HB       ASN  52  12.397  -8.647   7.860
  369   1HD2  ASN  52          1HD2      ASN  52  12.657  -9.895  10.168
  370   2HD2  ASN  52          2HD2      ASN  52  11.842  -9.062  11.444
  371    HA   PRO  53           HA       PRO  53   6.295  -9.026   8.106
  372   1HB   PRO  53          2HB       PRO  53   4.898  -8.701   5.799
  373   2HB   PRO  53          1HB       PRO  53   5.347  -7.350   6.845
  374   1HG   PRO  53          2HG       PRO  53   6.672  -8.327   4.341
  375   2HG   PRO  53          1HG       PRO  53   6.314  -6.662   4.841
  376   1HD   PRO  53          2HD       PRO  53   8.777  -7.749   5.103
  377   2HD   PRO  53          1HD       PRO  53   8.133  -6.564   6.262
  378    H    THR  54           H        THR  54   6.352 -11.187   8.473
  379    HA   THR  54           HA       THR  54   7.094 -13.190   6.702
  380    HB   THR  54           HB       THR  54   4.968 -13.820   8.683
  381    HG1  THR  54           1HG      THR  54   5.974 -12.443   9.984
  382   1HG2  THR  54          1HG2      THR  54   7.211 -15.279   9.282
  383   2HG2  THR  54          2HG2      THR  54   7.284 -15.128   7.526
  384   3HG2  THR  54          3HG2      THR  54   5.853 -15.817   8.293
  385    H    LYS  55           H        LYS  55   5.509 -15.036   6.073
  386    HA   LYS  55           HA       LYS  55   3.890 -14.142   4.000
  387   1HB   LYS  55          2HB       LYS  55   4.825 -16.457   4.279
  388   2HB   LYS  55          1HB       LYS  55   3.566 -16.761   5.475
  389   1HG   LYS  55          2HG       LYS  55   2.737 -17.682   3.502
  390   2HG   LYS  55          1HG       LYS  55   1.912 -16.129   3.637
  391   1HD   LYS  55          2HD       LYS  55   3.419 -15.134   2.042
  392   2HD   LYS  55          1HD       LYS  55   4.394 -16.604   1.992
  393   1HE   LYS  55          2HE       LYS  55   1.483 -16.655   1.282
  394   2HE   LYS  55          1HE       LYS  55   2.697 -16.174   0.097
  395   1HZ   LYS  55          1HZ       LYS  55   2.396 -18.789   1.446
  396   2HZ   LYS  55          2HZ       LYS  55   3.833 -18.346   0.672
  397   3HZ   LYS  55          3HZ       LYS  55   2.397 -18.456  -0.213
  398    H    CYS  56           H        CYS  56   2.991 -15.146   7.281
  399    HA   CYS  56           HA       CYS  56   0.205 -14.832   6.953
  400   1HB   CYS  56          2HB       CYS  56   1.742 -15.885   8.901
  401   2HB   CYS  56          1HB       CYS  56   1.377 -14.322   9.633
  402    HG   CYS  56           HG       CYS  56  -1.220 -15.393   8.833
  403    H    GLU  57           H        GLU  57   2.784 -12.607   7.736
  404    HA   GLU  57           HA       GLU  57   1.242 -10.484   8.741
  405   1HB   GLU  57          2HB       GLU  57   3.827 -10.315   7.178
  406   2HB   GLU  57          1HB       GLU  57   3.162  -9.069   8.234
  407   1HG   GLU  57          2HG       GLU  57   4.224 -11.768   9.031
  408   2HG   GLU  57          1HG       GLU  57   4.911 -10.187   9.400
  409    H    LEU  58           H        LEU  58   2.740 -10.665   5.513
  410    HA   LEU  58           HA       LEU  58   1.204  -8.593   4.407
  411   1HB   LEU  58          2HB       LEU  58   2.382 -10.882   2.841
  412   2HB   LEU  58          1HB       LEU  58   2.091  -9.236   2.293
  413    HG   LEU  58           HG       LEU  58   4.071  -9.861   4.476
  414   1HD1  LEU  58          1HD1      LEU  58   5.046 -11.081   2.793
  415   2HD1  LEU  58          2HD1      LEU  58   5.717  -9.479   2.483
  416   3HD1  LEU  58          3HD1      LEU  58   4.365 -10.069   1.518
  417   1HD2  LEU  58          1HD2      LEU  58   3.787  -7.604   4.554
  418   2HD2  LEU  58          2HD2      LEU  58   3.303  -7.492   2.862
  419   3HD2  LEU  58          3HD2      LEU  58   5.006  -7.686   3.282
  420    H    ASP  59           H        ASP  59   0.651 -12.043   4.668
  421    HA   ASP  59           HA       ASP  59  -1.563 -12.140   2.879
  422   1HB   ASP  59          2HB       ASP  59  -0.234 -14.140   3.478
  423   2HB   ASP  59          1HB       ASP  59  -0.845 -14.030   5.131
  424    H    ALA  60           H        ALA  60  -1.174 -11.220   6.184
  425    HA   ALA  60           HA       ALA  60  -3.938 -11.549   6.882
  426   1HB   ALA  60          1HB       ALA  60  -1.500 -10.569   8.226
  427   2HB   ALA  60          2HB       ALA  60  -2.775 -11.635   8.819
  428   3HB   ALA  60          3HB       ALA  60  -3.026  -9.890   8.790
  429    H    ILE  61           H        ILE  61  -1.910  -8.986   5.641
  430    HA   ILE  61           HA       ILE  61  -3.883  -6.927   6.017
  431    HB   ILE  61           HB       ILE  61  -1.198  -7.050   4.680
  432   1HG1  ILE  61          2HG1      ILE  61  -0.797  -5.125   6.259
  433   2HG1  ILE  61          1HG1      ILE  61  -2.405  -5.423   6.927
  434   1HG2  ILE  61          1HG2      ILE  61  -3.206  -4.823   4.413
  435   2HG2  ILE  61          2HG2      ILE  61  -2.441  -5.748   3.121
  436   3HG2  ILE  61          3HG2      ILE  61  -1.481  -4.635   4.095
  437   1HD1  ILE  61          1HD1      ILE  61  -0.704  -6.438   8.307
  438   2HD1  ILE  61          2HD1      ILE  61  -0.084  -7.340   6.926
  439   3HD1  ILE  61          3HD1      ILE  61  -1.695  -7.687   7.554
  440    H    ILE  62           H        ILE  62  -2.382  -8.344   3.101
  441    HA   ILE  62           HA       ILE  62  -3.956  -7.305   1.144
  442    HB   ILE  62           HB       ILE  62  -2.921 -10.134   1.310
  443   1HG1  ILE  62          2HG1      ILE  62  -1.820  -7.612   0.049
  444   2HG1  ILE  62          1HG1      ILE  62  -1.173  -8.449   1.463
  445   1HG2  ILE  62          1HG2      ILE  62  -3.082  -9.336  -1.367
  446   2HG2  ILE  62          2HG2      ILE  62  -4.630  -8.896  -0.645
  447   3HG2  ILE  62          3HG2      ILE  62  -4.055 -10.561  -0.553
  448   1HD1  ILE  62          1HD1      ILE  62  -0.304 -10.169   0.200
  449   2HD1  ILE  62          2HD1      ILE  62  -0.051  -8.765  -0.838
  450   3HD1  ILE  62          3HD1      ILE  62  -1.393  -9.866  -1.153
  451    H    CYS  63           H        CYS  63  -4.802  -9.915   3.347
  452    HA   CYS  63           HA       CYS  63  -7.206 -10.662   2.018
  453   1HB   CYS  63          2HB       CYS  63  -5.781 -11.919   3.847
  454   2HB   CYS  63          1HB       CYS  63  -6.842 -11.058   4.964
  455    HG   CYS  63           HG       CYS  63  -8.174 -12.815   2.796
  456    H    GLU  64           H        GLU  64  -6.471  -8.553   4.772
  457    HA   GLU  64           HA       GLU  64  -9.176  -7.837   5.282
  458   1HB   GLU  64          2HB       GLU  64  -6.502  -6.898   6.180
  459   2HB   GLU  64          1HB       GLU  64  -7.845  -5.778   6.363
  460   1HG   GLU  64          2HG       GLU  64  -9.043  -7.764   7.494
  461   2HG   GLU  64          1HG       GLU  64  -7.422  -8.441   7.647
  462    H    VAL  65           H        VAL  65  -6.588  -6.476   3.329
  463    HA   VAL  65           HA       VAL  65  -7.878  -4.048   2.660
  464    HB   VAL  65           HB       VAL  65  -5.780  -5.577   1.106
  465   1HG1  VAL  65          1HG1      VAL  65  -6.381  -2.634   0.942
  466   2HG1  VAL  65          2HG1      VAL  65  -7.087  -3.818  -0.157
  467   3HG1  VAL  65          3HG1      VAL  65  -5.340  -3.597  -0.106
  468   1HG2  VAL  65          1HG2      VAL  65  -4.859  -5.111   3.222
  469   2HG2  VAL  65          2HG2      VAL  65  -5.588  -3.510   3.281
  470   3HG2  VAL  65          3HG2      VAL  65  -4.259  -3.834   2.167
  471    H    ASP  66           H        ASP  66  -7.311  -6.902   0.599
  472    HA   ASP  66           HA       ASP  66  -9.091  -6.159  -1.426
  473   1HB   ASP  66          2HB       ASP  66  -7.960  -8.823  -0.586
  474   2HB   ASP  66          1HB       ASP  66  -9.047  -8.669  -1.965
  475    H    GLU  67           H        GLU  67 -11.218  -5.957  -1.362
  476    HA   GLU  67           HA       GLU  67 -12.738  -7.418   0.669
  477   1HB   GLU  67          2HB       GLU  67 -13.153  -4.897  -0.860
  478   2HB   GLU  67          1HB       GLU  67 -14.587  -5.803  -0.377
  479   1HG   GLU  67          2HG       GLU  67 -12.683  -5.503   1.794
  480   2HG   GLU  67          1HG       GLU  67 -13.223  -3.952   1.141
  481    H    ASP  68           H        ASP  68 -11.707  -8.632  -1.837
  482    HA   ASP  68           HA       ASP  68 -14.217  -9.838  -2.675
  483   1HB   ASP  68          2HB       ASP  68 -13.731  -9.575  -5.063
  484   2HB   ASP  68          1HB       ASP  68 -13.902  -8.008  -4.279
  485    H    GLY  69           H        GLY  69 -11.617 -10.526  -1.249
  486   1HA   GLY  69          2HA       GLY  69 -10.098 -12.253  -1.168
  487   2HA   GLY  69          1HA       GLY  69 -11.403 -13.182  -1.886
  488    H    SER  70           H        SER  70  -9.668 -10.499  -3.382
  489    HA   SER  70           HA       SER  70  -8.975 -12.247  -5.607
  490   1HB   SER  70          2HB       SER  70  -8.104  -9.901  -6.485
  491   2HB   SER  70          1HB       SER  70  -9.827 -10.301  -6.506
  492    HG   SER  70           HG       SER  70  -9.321  -8.219  -5.582
  493    H    GLY  71           H        GLY  71  -7.469 -10.504  -2.989
  494   1HA   GLY  71          2HA       GLY  71  -5.334 -10.687  -2.137
  495   2HA   GLY  71          1HA       GLY  71  -5.026 -11.954  -3.322
  496    H    THR  72           H        THR  72  -6.190  -9.181  -4.830
  497    HA   THR  72           HA       THR  72  -3.447  -8.303  -5.452
  498    HB   THR  72           HB       THR  72  -4.348  -7.631  -7.683
  499    HG1  THR  72           1HG      THR  72  -6.510  -7.480  -7.338
  500   1HG2  THR  72          1HG2      THR  72  -4.565  -9.868  -8.643
  501   2HG2  THR  72          2HG2      THR  72  -4.696 -10.545  -7.019
  502   3HG2  THR  72          3HG2      THR  72  -3.203  -9.755  -7.528
  503    H    ILE  73           H        ILE  73  -2.976  -6.202  -5.209
  504    HA   ILE  73           HA       ILE  73  -5.076  -4.454  -4.183
  505    HB   ILE  73           HB       ILE  73  -2.095  -3.970  -4.317
  506   1HG1  ILE  73          2HG1      ILE  73  -3.759  -4.803  -1.932
  507   2HG1  ILE  73          1HG1      ILE  73  -2.800  -5.925  -2.900
  508   1HG2  ILE  73          1HG2      ILE  73  -2.413  -1.990  -3.274
  509   2HG2  ILE  73          2HG2      ILE  73  -3.795  -2.575  -2.349
  510   3HG2  ILE  73          3HG2      ILE  73  -4.002  -2.091  -4.031
  511   1HD1  ILE  73          1HD1      ILE  73  -1.226  -3.667  -2.032
  512   2HD1  ILE  73          2HD1      ILE  73  -0.950  -5.393  -1.805
  513   3HD1  ILE  73          3HD1      ILE  73  -1.970  -4.507  -0.672
  514    H    ASP  74           H        ASP  74  -6.111  -3.155  -5.528
  515    HA   ASP  74           HA       ASP  74  -5.237  -2.650  -8.186
  516   1HB   ASP  74          2HB       ASP  74  -7.652  -2.552  -6.895
  517   2HB   ASP  74          1HB       ASP  74  -7.286  -0.837  -7.106
  518    H    PHE  75           H        PHE  75  -5.870   0.009  -8.630
  519    HA   PHE  75           HA       PHE  75  -3.424   1.281  -8.078
  520   1HB   PHE  75          2HB       PHE  75  -5.768   1.821  -9.620
  521   2HB   PHE  75          1HB       PHE  75  -5.386   3.258  -8.670
  522    HD1  PHE  75           1HD      PHE  75  -3.323   4.473  -9.031
  523    HD2  PHE  75           2HD      PHE  75  -4.277   1.026 -11.338
  524    HE1  PHE  75           1HE      PHE  75  -1.573   5.078 -10.652
  525    HE2  PHE  75           2HE      PHE  75  -2.529   1.626 -12.962
  526    HZ   PHE  75           HZ       PHE  75  -1.174   3.653 -12.619
  527    H    GLU  76           H        GLU  76  -6.537   2.716  -7.149
  528    HA   GLU  76           HA       GLU  76  -5.437   4.183  -5.019
  529   1HB   GLU  76          2HB       GLU  76  -8.285   3.426  -5.661
  530   2HB   GLU  76          1HB       GLU  76  -7.855   4.479  -4.318
  531   1HG   GLU  76          2HG       GLU  76  -6.968   5.083  -7.114
  532   2HG   GLU  76          1HG       GLU  76  -8.567   5.547  -6.534
  533    H    GLU  77           H        GLU  77  -6.562   0.924  -5.220
  534    HA   GLU  77           HA       GLU  77  -7.334   0.359  -2.634
  535   1HB   GLU  77          2HB       GLU  77  -6.318  -1.158  -4.909
  536   2HB   GLU  77          1HB       GLU  77  -5.861  -1.876  -3.370
  537   1HG   GLU  77          2HG       GLU  77  -8.361  -1.573  -2.769
  538   2HG   GLU  77          1HG       GLU  77  -8.581  -1.435  -4.518
  539    H    PHE  78           H        PHE  78  -4.138   0.997  -3.869
  540    HA   PHE  78           HA       PHE  78  -2.656  -0.081  -1.710
  541   1HB   PHE  78          2HB       PHE  78  -1.746   0.581  -3.981
  542   2HB   PHE  78          1HB       PHE  78  -1.817   2.258  -3.427
  543    HD1  PHE  78           1HD      PHE  78  -0.060  -0.908  -3.206
  544    HD2  PHE  78           2HD      PHE  78  -0.381   3.013  -1.587
  545    HE1  PHE  78           1HE      PHE  78   2.139  -1.174  -2.135
  546    HE2  PHE  78           2HE      PHE  78   1.819   2.757  -0.516
  547    HZ   PHE  78           HZ       PHE  78   3.082   0.660  -0.788
  548    H    LEU  79           H        LEU  79  -4.596   2.729  -1.992
  549    HA   LEU  79           HA       LEU  79  -3.273   4.104   0.204
  550   1HB   LEU  79          2HB       LEU  79  -5.684   4.819  -1.463
  551   2HB   LEU  79          1HB       LEU  79  -5.060   5.814  -0.161
  552    HG   LEU  79           HG       LEU  79  -2.833   5.437  -1.730
  553   1HD1  LEU  79          1HD1      LEU  79  -3.759   4.512  -3.617
  554   2HD1  LEU  79          2HD1      LEU  79  -3.845   6.231  -3.998
  555   3HD1  LEU  79          3HD1      LEU  79  -5.281   5.383  -3.429
  556   1HD2  LEU  79          1HD2      LEU  79  -4.871   7.655  -1.699
  557   2HD2  LEU  79          2HD2      LEU  79  -3.296   7.781  -2.484
  558   3HD2  LEU  79          3HD2      LEU  79  -3.395   7.531  -0.741
  559    H    VAL  80           H        VAL  80  -6.223   2.310  -0.470
  560    HA   VAL  80           HA       VAL  80  -7.408   2.869   2.081
  561    HB   VAL  80           HB       VAL  80  -8.662   2.260  -0.052
  562   1HG1  VAL  80          1HG1      VAL  80  -9.073  -0.110  -0.448
  563   2HG1  VAL  80          2HG1      VAL  80  -7.910  -0.528   0.811
  564   3HG1  VAL  80          3HG1      VAL  80  -7.368   0.286  -0.657
  565   1HG2  VAL  80          1HG2      VAL  80  -9.683   0.469   2.049
  566   2HG2  VAL  80          2HG2      VAL  80 -10.464   1.817   1.223
  567   3HG2  VAL  80          3HG2      VAL  80  -9.346   2.127   2.553
  568    H    MET  81           H        MET  81  -5.442   0.306   0.724
  569    HA   MET  81           HA       MET  81  -5.731  -1.721   2.569
  570   1HB   MET  81          2HB       MET  81  -3.239  -2.122   2.114
  571   2HB   MET  81          1HB       MET  81  -4.321  -2.150   0.731
  572   1HG   MET  81          2HG       MET  81  -3.426  -0.308  -0.180
  573   2HG   MET  81          1HG       MET  81  -3.122   0.462   1.379
  574   1HE   MET  81          1HE       MET  81  -0.644  -2.208   2.585
  575   2HE   MET  81          2HE       MET  81  -1.838  -0.981   3.012
  576   3HE   MET  81          3HE       MET  81  -0.154  -0.517   2.742
  577    H    MET  82           H        MET  82  -3.867   1.201   2.720
  578    HA   MET  82           HA       MET  82  -2.589   0.664   5.212
  579   1HB   MET  82          2HB       MET  82  -2.818   2.949   3.311
  580   2HB   MET  82          1HB       MET  82  -2.205   3.253   4.938
  581   1HG   MET  82          2HG       MET  82  -1.070   1.143   3.142
  582   2HG   MET  82          1HG       MET  82  -0.504   2.810   3.127
  583   1HE   MET  82          1HE       MET  82   1.012   3.755   4.373
  584   2HE   MET  82          2HE       MET  82   2.130   2.421   4.087
  585   3HE   MET  82          3HE       MET  82   1.949   3.088   5.710
  586    H    VAL  83           H        VAL  83  -5.352   2.584   4.142
  587    HA   VAL  83           HA       VAL  83  -5.938   3.891   6.534
  588    HB   VAL  83           HB       VAL  83  -7.928   2.938   4.469
  589   1HG1  VAL  83          1HG1      VAL  83  -9.285   3.724   6.121
  590   2HG1  VAL  83          2HG1      VAL  83  -8.939   5.243   5.294
  591   3HG1  VAL  83          3HG1      VAL  83  -8.059   4.817   6.763
  592   1HG2  VAL  83          1HG2      VAL  83  -7.268   4.546   3.052
  593   2HG2  VAL  83          2HG2      VAL  83  -5.759   4.524   3.974
  594   3HG2  VAL  83          3HG2      VAL  83  -7.007   5.714   4.349
  595    H    ARG  84           H        ARG  84  -6.616   0.628   5.481
  596    HA   ARG  84           HA       ARG  84  -8.507   0.058   7.555
  597   1HB   ARG  84          2HB       ARG  84  -6.935  -1.794   5.757
  598   2HB   ARG  84          1HB       ARG  84  -8.246  -2.292   6.818
  599   1HG   ARG  84          2HG       ARG  84  -9.369  -0.251   5.348
  600   2HG   ARG  84          1HG       ARG  84  -8.334  -1.082   4.179
  601   1HD   ARG  84          2HD       ARG  84  -9.771  -2.771   4.030
  602   2HD   ARG  84          1HD       ARG  84  -9.755  -3.000   5.777
  603    HE   ARG  84           HE       ARG  84 -11.823  -1.826   4.258
  604   1HH1  ARG  84          1HH1      ARG  84 -10.124  -1.449   7.283
  605   2HH1  ARG  84          2HH1      ARG  84 -11.464  -0.703   8.087
  606   1HH2  ARG  84          1HH2      ARG  84 -13.586  -0.843   5.313
  607   2HH2  ARG  84          2HH2      ARG  84 -13.430  -0.359   6.969
  608    H    GLN  85           H        GLN  85  -5.199   0.508   7.610
  609    HA   GLN  85           HA       GLN  85  -4.904  -1.236   9.969
  610   1HB   GLN  85          2HB       GLN  85  -2.517  -0.176   8.517
  611   2HB   GLN  85          1HB       GLN  85  -2.696  -1.663   9.444
  612   1HG   GLN  85          2HG       GLN  85  -3.804  -2.754   7.674
  613   2HG   GLN  85          1HG       GLN  85  -4.054  -1.237   6.801
  614   1HE2  GLN  85          1HE2      GLN  85  -1.661  -0.073   6.764
  615   2HE2  GLN  85          2HE2      GLN  85  -0.495  -1.057   5.954
  616    H    MET  86           H        MET  86  -4.750   1.980   8.737
  617    HA   MET  86           HA       MET  86  -3.215   3.057  10.915
  618   1HB   MET  86          2HB       MET  86  -4.707   4.213   8.584
  619   2HB   MET  86          1HB       MET  86  -4.148   5.264   9.887
  620   1HG   MET  86          2HG       MET  86  -1.848   4.336   9.512
  621   2HG   MET  86          1HG       MET  86  -2.485   3.537   8.069
  622   1HE   MET  86          1HE       MET  86  -1.272   5.927   5.650
  623   2HE   MET  86          2HE       MET  86  -2.780   5.009   5.617
  624   3HE   MET  86          3HE       MET  86  -1.326   4.300   6.330
  625    H    LYS  87           H        LYS  87  -6.629   2.904  10.014
  626    HA   LYS  87           HA       LYS  87  -7.541   4.494  12.195
  627   1HB   LYS  87          2HB       LYS  87  -8.819   2.753  10.136
  628   2HB   LYS  87          1HB       LYS  87  -9.761   3.189  11.563
  629   1HG   LYS  87          2HG       LYS  87 -10.143   5.235  10.791
  630   2HG   LYS  87          1HG       LYS  87  -8.434   5.492  10.417
  631   1HD   LYS  87          2HD       LYS  87  -9.425   5.633   8.329
  632   2HD   LYS  87          1HD       LYS  87  -8.912   3.945   8.387
  633   1HE   LYS  87          2HE       LYS  87 -11.618   4.559   9.416
  634   2HE   LYS  87          1HE       LYS  87 -11.380   4.704   7.674
  635   1HZ   LYS  87          1HZ       LYS  87 -10.382   2.292   8.998
  636   2HZ   LYS  87          2HZ       LYS  87 -11.025   2.484   7.445
  637   3HZ   LYS  87          3HZ       LYS  87 -12.055   2.438   8.785
  638    H    GLU  88           H        GLU  88  -7.426   0.994  11.600
  639    HA   GLU  88           HA       GLU  88  -7.260  -0.761  13.057
  640   1HB   GLU  88          2HB       GLU  88  -6.180   1.311  14.526
  641   2HB   GLU  88          1HB       GLU  88  -7.463   0.720  15.572
  642   1HG   GLU  88          2HG       GLU  88  -6.353  -1.615  14.879
  643   2HG   GLU  88          1HG       GLU  88  -4.942  -0.566  14.743
  644    H    ASP  89           H        ASP  89  -9.312   1.738  14.578
  645    HA   ASP  89           HA       ASP  89 -11.533   1.744  15.094
  646   1HB   ASP  89          2HB       ASP  89 -11.801  -0.992  13.846
  647   2HB   ASP  89          1HB       ASP  89 -13.052   0.233  14.071
  648    H    ALA  90           H        ALA  90 -12.800   1.052  16.819
  649    HA   ALA  90           HA       ALA  90 -11.453  -0.308  18.885
  650   1HB   ALA  90          1HB       ALA  90 -13.137   0.401  20.199
  651   2HB   ALA  90          2HB       ALA  90 -14.384  -0.175  19.091
  652   3HB   ALA  90          3HB       ALA  90 -13.578   1.364  18.788
  653   2H    ARG 115          HN2       ARG 115   2.773  -1.885   9.884
  654    H    ARG 115           H        ARG 115   1.769  -2.602  11.078
  655   3H    ARG 115          HN3       ARG 115   2.343  -3.542   9.765
  656    HA   ARG 115           HA       ARG 115   0.991  -2.543   8.260
  657   1HB   ARG 115          2HB       ARG 115  -1.197  -2.884   9.159
  658   2HB   ARG 115          1HB       ARG 115  -0.122  -4.014   9.967
  659   1HG   ARG 115          2HG       ARG 115   0.018  -2.116  11.769
  660   2HG   ARG 115          1HG       ARG 115  -1.513  -1.618  11.048
  661   1HD   ARG 115          2HD       ARG 115  -2.627  -3.371  11.907
  662   2HD   ARG 115          1HD       ARG 115  -1.299  -4.490  11.599
  663    HE   ARG 115           HE       ARG 115  -1.913  -3.262  14.059
  664   1HH1  ARG 115          1HH1      ARG 115   0.828  -4.093  12.064
  665   2HH1  ARG 115          2HH1      ARG 115   1.915  -4.242  13.403
  666   1HH2  ARG 115          1HH2      ARG 115  -0.483  -3.459  15.821
  667   2HH2  ARG 115          2HH2      ARG 115   1.172  -3.883  15.535
  668    H    MET 116           H        MET 116   1.124  -0.623  11.232
  669    HA   MET 116           HA       MET 116  -0.009   1.667   9.802
  670   1HB   MET 116          2HB       MET 116  -0.933   1.128  12.027
  671   2HB   MET 116          1HB       MET 116   0.659   1.363  12.735
  672   1HG   MET 116          2HG       MET 116   0.624   3.669  12.330
  673   2HG   MET 116          1HG       MET 116  -0.719   3.535  11.198
  674   1HE   MET 116          1HE       MET 116   0.015   5.140  14.302
  675   2HE   MET 116          2HE       MET 116  -1.667   5.507  14.681
  676   3HE   MET 116          3HE       MET 116  -1.050   5.783  13.052
  677    H    SER 117           H        SER 117   1.044   3.791  10.096
  678    HA   SER 117           HA       SER 117   2.837   5.135   9.673
  679   1HB   SER 117          2HB       SER 117   4.473   5.202  11.352
  680   2HB   SER 117          1HB       SER 117   3.084   4.482  12.166
  681    HG   SER 117           HG       SER 117   5.383   3.173  11.151
  682    H    ALA 118           H        ALA 118   2.519   2.846   7.984
  683    HA   ALA 118           HA       ALA 118   5.092   1.691   7.474
  684   1HB   ALA 118          1HB       ALA 118   2.382   1.339   6.532
  685   2HB   ALA 118          2HB       ALA 118   3.726   0.196   6.554
  686   3HB   ALA 118          3HB       ALA 118   3.539   1.312   5.200
  687    H    ASP 119           H        ASP 119   4.035   4.756   7.009
  688    HA   ASP 119           HA       ASP 119   4.517   5.536   4.445
  689   1HB   ASP 119          2HB       ASP 119   3.863   6.971   6.446
  690   2HB   ASP 119          1HB       ASP 119   5.585   7.079   6.805
  691    H    ALA 120           H        ALA 120   6.848   4.379   6.750
  692    HA   ALA 120           HA       ALA 120   9.224   5.416   5.873
  693   1HB   ALA 120          1HB       ALA 120   9.386   2.532   6.327
  694   2HB   ALA 120          2HB       ALA 120   8.510   3.408   7.583
  695   3HB   ALA 120          3HB       ALA 120  10.166   3.862   7.183
  696    H    MET 121           H        MET 121   8.206   2.172   4.773
  697    HA   MET 121           HA       MET 121   9.908   2.011   2.601
  698   1HB   MET 121          2HB       MET 121   8.884  -0.010   2.978
  699   2HB   MET 121          1HB       MET 121   7.324   0.723   3.324
  700   1HG   MET 121          2HG       MET 121   6.910   1.066   0.974
  701   2HG   MET 121          1HG       MET 121   8.520   0.477   0.570
  702   1HE   MET 121          1HE       MET 121   5.862  -0.624   3.100
  703   2HE   MET 121          2HE       MET 121   5.267  -2.161   2.473
  704   3HE   MET 121          3HE       MET 121   4.823  -0.653   1.675
  705    H    LEU 122           H        LEU 122   6.690   3.405   2.821
  706    HA   LEU 122           HA       LEU 122   6.298   3.988   0.113
  707   1HB   LEU 122          2HB       LEU 122   5.266   5.281   2.632
  708   2HB   LEU 122          1HB       LEU 122   4.767   5.806   1.039
  709    HG   LEU 122           HG       LEU 122   3.568   3.846   0.618
  710   1HD1  LEU 122          1HD1      LEU 122   3.757   1.785   1.867
  711   2HD1  LEU 122          2HD1      LEU 122   4.925   2.520   2.964
  712   3HD1  LEU 122          3HD1      LEU 122   5.344   2.265   1.270
  713   1HD2  LEU 122          1HD2      LEU 122   2.562   5.291   2.368
  714   2HD2  LEU 122          2HD2      LEU 122   3.268   4.235   3.591
  715   3HD2  LEU 122          3HD2      LEU 122   2.062   3.603   2.471
  716    H    ARG 123           H        ARG 123   8.150   5.587   2.605
  717    HA   ARG 123           HA       ARG 123   8.652   7.912   0.921
  718   1HB   ARG 123          2HB       ARG 123   8.347   7.830   3.537
  719   2HB   ARG 123          1HB       ARG 123  10.057   7.428   3.515
  720   1HG   ARG 123          2HG       ARG 123  10.203   9.539   1.959
  721   2HG   ARG 123          1HG       ARG 123   8.693   9.961   2.769
  722   1HD   ARG 123          2HD       ARG 123  10.043   9.365   4.932
  723   2HD   ARG 123          1HD       ARG 123  11.440   9.661   3.898
  724    HE   ARG 123           HE       ARG 123   9.478  11.761   3.824
  725   1HH1  ARG 123          1HH1      ARG 123  12.279  10.520   5.496
  726   2HH1  ARG 123          2HH1      ARG 123  12.731  12.062   6.141
  727   1HH2  ARG 123          1HH2      ARG 123  10.071  13.789   4.672
  728   2HH2  ARG 123          2HH2      ARG 123  11.477  13.917   5.675
  729    H    ALA 124           H        ALA 124  10.070   4.885   1.727
  730    HA   ALA 124           HA       ALA 124  12.776   5.300   1.434
  731   1HB   ALA 124          1HB       ALA 124  11.401   3.145   1.945
  732   2HB   ALA 124          2HB       ALA 124  12.989   3.021   1.192
  733   3HB   ALA 124          3HB       ALA 124  11.534   2.877   0.206
  734    H    LEU 125           H        LEU 125  10.851   3.894  -1.202
  735    HA   LEU 125           HA       LEU 125  12.771   4.710  -3.152
  736   1HB   LEU 125          2HB       LEU 125  10.006   3.598  -3.601
  737   2HB   LEU 125          1HB       LEU 125  11.334   3.614  -4.748
  738    HG   LEU 125           HG       LEU 125  11.629   2.181  -2.137
  739   1HD1  LEU 125          1HD1      LEU 125  10.943   0.144  -3.650
  740   2HD1  LEU 125          2HD1      LEU 125   9.983   1.374  -4.473
  741   3HD1  LEU 125          3HD1      LEU 125   9.741   1.070  -2.752
  742   1HD2  LEU 125          1HD2      LEU 125  13.507   1.380  -3.033
  743   2HD2  LEU 125          2HD2      LEU 125  13.329   2.651  -4.243
  744   3HD2  LEU 125          3HD2      LEU 125  12.727   1.027  -4.575
  745    H    LEU 126           H        LEU 126  10.335   6.403  -1.633
  746    HA   LEU 126           HA       LEU 126   9.102   7.836  -3.684
  747   1HB   LEU 126          2HB       LEU 126   8.765   7.815  -1.068
  748   2HB   LEU 126          1HB       LEU 126   9.827   9.207  -1.136
  749    HG   LEU 126           HG       LEU 126   7.148   8.925  -2.494
  750   1HD1  LEU 126          1HD1      LEU 126   6.275  10.258  -0.879
  751   2HD1  LEU 126          2HD1      LEU 126   7.800  11.091  -0.583
  752   3HD1  LEU 126          3HD1      LEU 126   7.537   9.476   0.074
  753   1HD2  LEU 126          1HD2      LEU 126   9.156  11.172  -2.595
  754   2HD2  LEU 126          2HD2      LEU 126   7.496  11.272  -3.181
  755   3HD2  LEU 126          3HD2      LEU 126   8.634  10.159  -3.941
  756    H    GLY 127           H        GLY 127  11.760   9.054  -1.632
  757   1HA   GLY 127          2HA       GLY 127  12.898  10.345  -4.021
  758   2HA   GLY 127          1HA       GLY 127  12.584  11.305  -2.584
  759    H    SER 128           H        SER 128  14.892   9.593  -4.231
  760    HA   SER 128           HA       SER 128  16.383   8.666  -1.929
  761   1HB   SER 128          2HB       SER 128  18.071   7.968  -3.593
  762   2HB   SER 128          1HB       SER 128  16.464   7.368  -4.003
  763    HG   SER 128           HG       SER 128  17.983   9.385  -5.228
  764    H    LYS 129           H        LYS 129  16.093  11.151  -1.309
  765    HA   LYS 129           HA       LYS 129  18.644  12.442  -2.014
  766   1HB   LYS 129          2HB       LYS 129  16.132  13.415  -2.668
  767   2HB   LYS 129          1HB       LYS 129  16.546  14.307  -1.211
  768   1HG   LYS 129          2HG       LYS 129  17.957  15.607  -2.319
  769   2HG   LYS 129          1HG       LYS 129  18.788  14.214  -3.014
  770   1HD   LYS 129          2HD       LYS 129  16.431  14.273  -4.423
  771   2HD   LYS 129          1HD       LYS 129  16.782  15.986  -4.189
  772   1HE   LYS 129          2HE       LYS 129  17.837  15.412  -6.209
  773   2HE   LYS 129          1HE       LYS 129  19.128  15.460  -5.010
  774   1HZ   LYS 129          1HZ       LYS 129  18.873  13.011  -4.809
  775   2HZ   LYS 129          2HZ       LYS 129  19.414  13.520  -6.328
  776   3HZ   LYS 129          3HZ       LYS 129  17.803  13.049  -6.120
  777    H    HIS 130           H        HIS 130  16.040  12.209   0.386
  778    HA   HIS 130           HA       HIS 130  17.983  12.969   2.463
  779   1HB   HIS 130          2HB       HIS 130  15.625  14.184   1.980
  780   2HB   HIS 130          1HB       HIS 130  15.089  12.942   3.107
  781    HD1  HIS 130           1HD      HIS 130  14.691  14.362   5.141
  782    HD2  HIS 130           2HD      HIS 130  18.462  14.945   3.495
  783    HE1  HIS 130           1HE      HIS 130  15.932  15.796   6.793
  784    HE2  HIS 130           2HE      HIS 130  18.239  16.064   5.815
  785    H    LYS 131           H        LYS 131  14.975  11.057   2.273
  786    HA   LYS 131           HA       LYS 131  14.403   9.032   3.137
  787   1HB   LYS 131          2HB       LYS 131  17.280   8.724   2.458
  788   2HB   LYS 131          1HB       LYS 131  16.570   7.495   3.497
  789   1HG   LYS 131          2HG       LYS 131  14.696   7.593   1.585
  790   2HG   LYS 131          1HG       LYS 131  16.110   8.064   0.640
  791   1HD   LYS 131          2HD       LYS 131  16.326   5.818   0.420
  792   2HD   LYS 131          1HD       LYS 131  17.150   5.986   1.972
  793   1HE   LYS 131          2HE       LYS 131  14.471   5.772   2.650
  794   2HE   LYS 131          1HE       LYS 131  14.666   4.632   1.319
  795   1HZ   LYS 131          1HZ       LYS 131  16.578   3.685   2.542
  796   2HZ   LYS 131          2HZ       LYS 131  15.110   3.514   3.363
  797   3HZ   LYS 131          3HZ       LYS 131  16.216   4.698   3.849
  Start of MODEL   21
    1   2H    ALA   1          HN2       ALA   1 -22.338   1.166 -10.943
    2    H    ALA   1           H        ALA   1 -22.832   1.345 -12.577
    3   3H    ALA   1          HN3       ALA   1 -21.837   0.026 -12.124
    4    HA   ALA   1           HA       ALA   1 -20.410   1.472 -13.123
    5   1HB   ALA   1          1HB       ALA   1 -21.851   3.375 -13.332
    6   2HB   ALA   1          2HB       ALA   1 -20.361   3.890 -12.541
    7   3HB   ALA   1          3HB       ALA   1 -21.826   3.646 -11.590
    8    H    SER   2           H        SER   2 -21.234   2.336  -9.760
    9    HA   SER   2           HA       SER   2 -18.454   1.695  -9.022
   10   1HB   SER   2          2HB       SER   2 -19.603   4.121  -8.736
   11   2HB   SER   2          1HB       SER   2 -20.062   3.391  -7.198
   12    HG   SER   2           HG       SER   2 -17.434   3.643  -8.244
   13    H    MET   3           H        MET   3 -18.354   1.234  -6.532
   14    HA   MET   3           HA       MET   3 -20.627  -0.161  -5.454
   15   1HB   MET   3          2HB       MET   3 -19.121  -2.292  -5.197
   16   2HB   MET   3          1HB       MET   3 -20.051  -2.034  -6.664
   17   1HG   MET   3          2HG       MET   3 -17.273  -0.997  -6.571
   18   2HG   MET   3          1HG       MET   3 -17.511  -2.735  -6.721
   19   1HE   MET   3          1HE       MET   3 -17.221   0.287  -9.728
   20   2HE   MET   3          2HE       MET   3 -16.159  -1.121  -9.690
   21   3HE   MET   3          3HE       MET   3 -16.392  -0.154  -8.235
   22    H    THR   4           H        THR   4 -17.133   0.398  -5.245
   23    HA   THR   4           HA       THR   4 -17.464   0.821  -2.355
   24    HB   THR   4           HB       THR   4 -15.191  -0.187  -2.038
   25    HG1  THR   4           1HG      THR   4 -14.599  -0.007  -4.292
   26   1HG2  THR   4          1HG2      THR   4 -15.928  -2.321  -1.780
   27   2HG2  THR   4          2HG2      THR   4 -16.809  -2.323  -3.309
   28   3HG2  THR   4          3HG2      THR   4 -17.471  -1.477  -1.910
   29    H    ASP   5           H        ASP   5 -17.074   2.901  -1.994
   30    HA   ASP   5           HA       ASP   5 -15.279   4.385  -3.731
   31   1HB   ASP   5          2HB       ASP   5 -17.036   5.280  -1.438
   32   2HB   ASP   5          1HB       ASP   5 -16.059   6.361  -2.437
   33    H    GLN   6           H        GLN   6 -14.765   2.465  -1.149
   34    HA   GLN   6           HA       GLN   6 -13.323   3.848   0.731
   35   1HB   GLN   6          2HB       GLN   6 -11.980   1.739   1.003
   36   2HB   GLN   6          1HB       GLN   6 -13.724   1.520   1.051
   37   1HG   GLN   6          2HG       GLN   6 -13.655   0.816  -1.320
   38   2HG   GLN   6          1HG       GLN   6 -11.897   0.930  -1.266
   39   1HE2  GLN   6          1HE2      GLN   6 -10.741  -0.703  -0.403
   40   2HE2  GLN   6          2HE2      GLN   6 -11.427  -2.146   0.251
   41    H    GLN   7           H        GLN   7 -12.216   2.694  -2.419
   42    HA   GLN   7           HA       GLN   7  -9.506   3.358  -2.185
   43   1HB   GLN   7          2HB       GLN   7  -9.764   3.739  -4.772
   44   2HB   GLN   7          1HB       GLN   7  -9.870   2.118  -4.089
   45   1HG   GLN   7          2HG       GLN   7 -12.110   1.948  -4.512
   46   2HG   GLN   7          1HG       GLN   7 -12.376   3.689  -4.400
   47   1HE2  GLN   7          1HE2      GLN   7 -12.221   1.119  -6.459
   48   2HE2  GLN   7          2HE2      GLN   7 -11.958   1.961  -7.944
   49    H    ALA   8           H        ALA   8 -12.305   5.298  -2.786
   50    HA   ALA   8           HA       ALA   8 -10.834   7.571  -3.718
   51   1HB   ALA   8          1HB       ALA   8 -12.845   8.053  -4.530
   52   2HB   ALA   8          2HB       ALA   8 -13.404   8.378  -2.889
   53   3HB   ALA   8          3HB       ALA   8 -13.573   6.760  -3.577
   54    H    GLU   9           H        GLU   9 -12.714   6.858  -0.766
   55    HA   GLU   9           HA       GLU   9 -12.072   9.208   0.612
   56   1HB   GLU   9          2HB       GLU   9 -12.490   6.551   1.970
   57   2HB   GLU   9          1HB       GLU   9 -12.907   8.155   2.559
   58   1HG   GLU   9          2HG       GLU   9 -14.381   8.023   0.281
   59   2HG   GLU   9          1HG       GLU   9 -14.395   6.337   0.812
   60    H    ALA  10           H        ALA  10 -10.468   6.064   0.502
   61    HA   ALA  10           HA       ALA  10  -8.542   6.270   2.413
   62   1HB   ALA  10          1HB       ALA  10  -8.269   4.288   1.399
   63   2HB   ALA  10          2HB       ALA  10  -7.127   5.153   0.372
   64   3HB   ALA  10          3HB       ALA  10  -8.789   4.908  -0.169
   65    H    ARG  11           H        ARG  11  -8.160   7.383  -0.955
   66    HA   ARG  11           HA       ARG  11  -5.664   8.572  -0.686
   67   1HB   ARG  11          2HB       ARG  11  -7.160   8.166  -2.789
   68   2HB   ARG  11          1HB       ARG  11  -7.767   9.781  -2.452
   69   1HG   ARG  11          2HG       ARG  11  -5.791  10.791  -2.998
   70   2HG   ARG  11          1HG       ARG  11  -4.824   9.377  -2.576
   71   1HD   ARG  11          2HD       ARG  11  -4.759   8.814  -4.722
   72   2HD   ARG  11          1HD       ARG  11  -6.510   8.609  -4.702
   73    HE   ARG  11           HE       ARG  11  -5.029  10.799  -5.831
   74   1HH1  ARG  11          1HH1      ARG  11  -8.106   9.803  -4.520
   75   2HH1  ARG  11          2HH1      ARG  11  -9.001  11.022  -5.363
   76   1HH2  ARG  11          1HH2      ARG  11  -6.204  12.402  -6.942
   77   2HH2  ARG  11          2HH2      ARG  11  -7.921  12.498  -6.739
   78    H    ALA  12           H        ALA  12  -8.762   9.637   0.407
   79    HA   ALA  12           HA       ALA  12  -7.787  12.344   0.927
   80   1HB   ALA  12          1HB       ALA  12  -9.984  12.148  -0.096
   81   2HB   ALA  12          2HB       ALA  12 -10.112  12.852   1.517
   82   3HB   ALA  12          3HB       ALA  12 -10.542  11.161   1.255
   83    H    PHE  13           H        PHE  13  -8.187   9.342   2.515
   84    HA   PHE  13           HA       PHE  13  -8.711  10.290   5.138
   85   1HB   PHE  13          2HB       PHE  13  -9.128   7.960   4.452
   86   2HB   PHE  13          1HB       PHE  13  -7.389   7.710   4.271
   87    HD1  PHE  13           1HD      PHE  13 -10.042   8.489   6.731
   88    HD2  PHE  13           2HD      PHE  13  -6.052   7.147   6.110
   89    HE1  PHE  13           1HE      PHE  13  -9.891   7.855   9.102
   90    HE2  PHE  13           2HE      PHE  13  -5.894   6.509   8.479
   91    HZ   PHE  13           HZ       PHE  13  -7.815   6.863   9.980
   92    H    LEU  14           H        LEU  14  -5.817   9.986   3.238
   93    HA   LEU  14           HA       LEU  14  -4.214  10.737   5.592
   94   1HB   LEU  14          2HB       LEU  14  -2.996   9.691   3.067
   95   2HB   LEU  14          1HB       LEU  14  -2.372   9.633   4.710
   96    HG   LEU  14           HG       LEU  14  -4.762   8.117   4.696
   97   1HD1  LEU  14          1HD1      LEU  14  -4.068   6.366   3.023
   98   2HD1  LEU  14          2HD1      LEU  14  -2.985   7.576   2.333
   99   3HD1  LEU  14          3HD1      LEU  14  -4.725   7.857   2.348
  100   1HD2  LEU  14          1HD2      LEU  14  -2.214   6.666   4.568
  101   2HD2  LEU  14          2HD2      LEU  14  -3.468   6.660   5.808
  102   3HD2  LEU  14          3HD2      LEU  14  -2.274   7.957   5.769
  103    H    SER  15           H        SER  15  -2.146  11.971   4.863
  104    HA   SER  15           HA       SER  15  -3.076  14.326   3.429
  105   1HB   SER  15          2HB       SER  15  -1.590  14.089   5.682
  106   2HB   SER  15          1HB       SER  15  -0.301  14.242   4.478
  107    HG   SER  15           HG       SER  15  -1.134  16.260   5.388
  108    H    GLU  16           H        GLU  16  -1.629  15.385   1.843
  109    HA   GLU  16           HA       GLU  16  -1.043  13.794  -0.334
  110   1HB   GLU  16          2HB       GLU  16  -0.536  16.546   0.457
  111   2HB   GLU  16          1HB       GLU  16   0.773  15.906  -0.528
  112   1HG   GLU  16          2HG       GLU  16  -2.127  15.779  -1.311
  113   2HG   GLU  16          1HG       GLU  16  -1.029  17.071  -1.794
  114    H    GLU  17           H        GLU  17   0.842  14.443   2.497
  115    HA   GLU  17           HA       GLU  17   3.391  13.695   1.605
  116   1HB   GLU  17          2HB       GLU  17   2.013  13.974   4.213
  117   2HB   GLU  17          1HB       GLU  17   3.437  12.939   4.203
  118   1HG   GLU  17          2HG       GLU  17   4.272  15.161   2.814
  119   2HG   GLU  17          1HG       GLU  17   3.229  15.833   4.067
  120    H    MET  18           H        MET  18   0.793  11.801   3.106
  121    HA   MET  18           HA       MET  18   2.228   9.333   2.975
  122   1HB   MET  18          2HB       MET  18   0.129  10.161   4.438
  123   2HB   MET  18          1HB       MET  18  -0.734   9.303   3.161
  124   1HG   MET  18          2HG       MET  18  -0.459   7.620   4.660
  125   2HG   MET  18          1HG       MET  18   1.006   7.413   3.705
  126   1HE   MET  18          1HE       MET  18   0.551   6.967   7.650
  127   2HE   MET  18          2HE       MET  18   2.022   6.233   7.008
  128   3HE   MET  18          3HE       MET  18   0.507   6.103   6.113
  129    H    ILE  19           H        ILE  19   0.385  11.146   0.723
  130    HA   ILE  19           HA       ILE  19  -0.386   8.890  -0.909
  131    HB   ILE  19           HB       ILE  19  -0.581  11.871  -1.286
  132   1HG1  ILE  19          2HG1      ILE  19  -2.656   9.677  -1.085
  133   2HG1  ILE  19          1HG1      ILE  19  -2.209  10.791   0.208
  134   1HG2  ILE  19          1HG2      ILE  19  -2.053  10.919  -3.338
  135   2HG2  ILE  19          2HG2      ILE  19  -0.734   9.748  -3.322
  136   3HG2  ILE  19          3HG2      ILE  19  -0.384  11.467  -3.495
  137   1HD1  ILE  19          1HD1      ILE  19  -3.943  11.192  -2.125
  138   2HD1  ILE  19          2HD1      ILE  19  -2.866  12.536  -1.740
  139   3HD1  ILE  19          3HD1      ILE  19  -3.993  11.931  -0.525
  140    H    ALA  20           H        ALA  20   1.630  11.759  -1.599
  141    HA   ALA  20           HA       ALA  20   2.843  10.857  -3.899
  142   1HB   ALA  20          1HB       ALA  20   4.788  12.356  -3.152
  143   2HB   ALA  20          2HB       ALA  20   3.794  12.703  -1.736
  144   3HB   ALA  20          3HB       ALA  20   3.199  13.096  -3.349
  145    H    GLU  21           H        GLU  21   3.440   9.927  -0.618
  146    HA   GLU  21           HA       GLU  21   5.920   8.559  -1.227
  147   1HB   GLU  21          2HB       GLU  21   4.263   8.685   1.301
  148   2HB   GLU  21          1HB       GLU  21   5.822   7.888   1.165
  149   1HG   GLU  21          2HG       GLU  21   6.941   9.944   0.795
  150   2HG   GLU  21          1HG       GLU  21   5.417  10.808   0.594
  151    H    PHE  22           H        PHE  22   2.529   7.888  -0.794
  152    HA   PHE  22           HA       PHE  22   2.617   5.104  -0.456
  153   1HB   PHE  22          2HB       PHE  22   0.624   7.121  -0.954
  154   2HB   PHE  22          1HB       PHE  22   0.319   5.729  -1.987
  155    HD1  PHE  22           1HD      PHE  22  -0.931   7.053   0.739
  156    HD2  PHE  22           2HD      PHE  22   1.123   3.488  -0.335
  157    HE1  PHE  22           1HE      PHE  22  -1.980   5.882   2.631
  158    HE2  PHE  22           2HE      PHE  22   0.077   2.309   1.553
  159    HZ   PHE  22           HZ       PHE  22  -1.478   3.509   3.038
  160    H    LYS  23           H        LYS  23   2.735   7.145  -3.303
  161    HA   LYS  23           HA       LYS  23   2.572   4.945  -5.151
  162   1HB   LYS  23          2HB       LYS  23   1.853   7.437  -5.482
  163   2HB   LYS  23          1HB       LYS  23   3.550   7.680  -5.894
  164   1HG   LYS  23          2HG       LYS  23   2.866   7.210  -7.972
  165   2HG   LYS  23          1HG       LYS  23   2.960   5.532  -7.431
  166   1HD   LYS  23          2HD       LYS  23   0.814   5.379  -8.043
  167   2HD   LYS  23          1HD       LYS  23   0.461   6.315  -6.583
  168   1HE   LYS  23          2HE       LYS  23  -0.627   7.538  -8.210
  169   2HE   LYS  23          1HE       LYS  23   0.926   8.366  -8.110
  170   1HZ   LYS  23          1HZ       LYS  23   0.938   8.083 -10.316
  171   2HZ   LYS  23          2HZ       LYS  23  -0.217   6.849 -10.284
  172   3HZ   LYS  23          3HZ       LYS  23   1.407   6.494  -9.975
  173    H    ALA  24           H        ALA  24   4.995   6.172  -3.199
  174    HA   ALA  24           HA       ALA  24   7.308   6.319  -4.608
  175   1HB   ALA  24          1HB       ALA  24   8.433   5.327  -2.605
  176   2HB   ALA  24          2HB       ALA  24   6.832   4.984  -1.953
  177   3HB   ALA  24          3HB       ALA  24   7.323   6.652  -2.254
  178    H    ALA  25           H        ALA  25   6.523   3.254  -2.990
  179    HA   ALA  25           HA       ALA  25   8.221   1.773  -4.740
  180   1HB   ALA  25          1HB       ALA  25   6.295   0.911  -2.597
  181   2HB   ALA  25          2HB       ALA  25   8.046   1.072  -2.470
  182   3HB   ALA  25          3HB       ALA  25   7.347  -0.197  -3.479
  183    H    PHE  26           H        PHE  26   5.214   2.987  -5.325
  184    HA   PHE  26           HA       PHE  26   3.632   0.995  -6.323
  185   1HB   PHE  26          2HB       PHE  26   3.336   3.598  -6.288
  186   2HB   PHE  26          1HB       PHE  26   3.955   3.497  -7.932
  187    HD1  PHE  26           1HD      PHE  26   1.089   3.206  -5.846
  188    HD2  PHE  26           2HD      PHE  26   2.750   1.929  -9.550
  189    HE1  PHE  26           1HE      PHE  26  -1.163   2.630  -6.653
  190    HE2  PHE  26           2HE      PHE  26   0.501   1.352 -10.363
  191    HZ   PHE  26           HZ       PHE  26  -1.459   1.702  -8.915
  192    H    ASP  27           H        ASP  27   6.610   2.197  -7.668
  193    HA   ASP  27           HA       ASP  27   6.197   0.894 -10.221
  194   1HB   ASP  27          2HB       ASP  27   8.561   1.665 -10.653
  195   2HB   ASP  27          1HB       ASP  27   7.406   2.949 -10.310
  196    H    MET  28           H        MET  28   8.413   0.512  -7.461
  197    HA   MET  28           HA       MET  28   9.724  -1.776  -8.443
  198   1HB   MET  28          2HB       MET  28  10.102  -0.128  -6.324
  199   2HB   MET  28          1HB       MET  28   9.444  -1.542  -5.513
  200   1HG   MET  28          2HG       MET  28  11.323  -2.704  -5.771
  201   2HG   MET  28          1HG       MET  28  11.499  -2.211  -7.459
  202   1HE   MET  28          1HE       MET  28  12.423   0.129  -8.183
  203   2HE   MET  28          2HE       MET  28  13.283   1.248  -7.124
  204   3HE   MET  28          3HE       MET  28  11.531   1.086  -7.000
  205    H    PHE  29           H        PHE  29   6.697  -1.360  -6.778
  206    HA   PHE  29           HA       PHE  29   6.308  -3.915  -5.739
  207   1HB   PHE  29          2HB       PHE  29   4.488  -1.730  -6.659
  208   2HB   PHE  29          1HB       PHE  29   3.795  -3.314  -6.306
  209    HD1  PHE  29           1HD      PHE  29   4.827  -4.326  -3.993
  210    HD2  PHE  29           2HD      PHE  29   4.354  -0.214  -4.968
  211    HE1  PHE  29           1HE      PHE  29   4.779  -3.764  -1.598
  212    HE2  PHE  29           2HE      PHE  29   4.306   0.354  -2.577
  213    HZ   PHE  29           HZ       PHE  29   4.519  -1.424  -0.887
  214    H    ASP  30           H        ASP  30   4.614  -2.774  -8.648
  215    HA   ASP  30           HA       ASP  30   3.877  -5.229  -9.633
  216   1HB   ASP  30          2HB       ASP  30   4.456  -2.621 -11.018
  217   2HB   ASP  30          1HB       ASP  30   3.919  -4.041 -11.919
  218    H    ALA  31           H        ALA  31   4.978  -6.920 -10.281
  219    HA   ALA  31           HA       ALA  31   7.778  -6.645 -11.052
  220   1HB   ALA  31          1HB       ALA  31   6.173  -9.167 -10.673
  221   2HB   ALA  31          2HB       ALA  31   7.071  -8.356  -9.389
  222   3HB   ALA  31          3HB       ALA  31   7.927  -9.026 -10.779
  223    H    ASP  32           H        ASP  32   4.781  -8.078 -12.315
  224    HA   ASP  32           HA       ASP  32   6.001  -8.479 -14.923
  225   1HB   ASP  32          2HB       ASP  32   3.813  -9.493 -15.516
  226   2HB   ASP  32          1HB       ASP  32   4.542 -10.234 -14.089
  227    H    GLY  33           H        GLY  33   3.906  -6.242 -13.300
  228   1HA   GLY  33          2HA       GLY  33   3.056  -4.215 -13.967
  229   2HA   GLY  33          1HA       GLY  33   4.116  -4.318 -15.365
  230    H    GLY  34           H        GLY  34   1.093  -5.740 -14.117
  231   1HA   GLY  34          2HA       GLY  34  -0.469  -4.950 -16.306
  232   2HA   GLY  34          1HA       GLY  34   0.118  -6.582 -16.621
  233    H    GLY  35           H        GLY  35  -0.733  -5.225 -13.469
  234   1HA   GLY  35          2HA       GLY  35  -3.344  -6.330 -13.360
  235   2HA   GLY  35          1HA       GLY  35  -2.188  -7.432 -12.613
  236    H    ASP  36           H        ASP  36  -1.531  -7.058 -10.573
  237    HA   ASP  36           HA       ASP  36  -1.753  -4.440  -9.373
  238   1HB   ASP  36          2HB       ASP  36  -3.661  -6.653  -8.743
  239   2HB   ASP  36          1HB       ASP  36  -3.128  -5.596  -7.430
  240    H    ILE  37           H        ILE  37  -1.418  -4.880  -6.801
  241    HA   ILE  37           HA       ILE  37   1.159  -6.206  -6.682
  242    HB   ILE  37           HB       ILE  37  -0.324  -4.568  -4.627
  243   1HG1  ILE  37          2HG1      ILE  37   1.967  -3.927  -6.493
  244   2HG1  ILE  37          1HG1      ILE  37   0.347  -3.227  -6.519
  245   1HG2  ILE  37          1HG2      ILE  37   1.811  -4.501  -3.413
  246   2HG2  ILE  37          2HG2      ILE  37   2.485  -5.653  -4.567
  247   3HG2  ILE  37          3HG2      ILE  37   1.147  -6.130  -3.520
  248   1HD1  ILE  37          1HD1      ILE  37   0.739  -2.031  -4.521
  249   2HD1  ILE  37          2HD1      ILE  37   2.152  -1.785  -5.547
  250   3HD1  ILE  37          3HD1      ILE  37   2.228  -2.920  -4.199
  251    H    SER  38           H        SER  38   1.562  -8.104  -5.737
  252    HA   SER  38           HA       SER  38  -0.648  -9.437  -4.324
  253   1HB   SER  38          2HB       SER  38   0.093 -10.535  -6.423
  254   2HB   SER  38          1HB       SER  38   1.715 -10.701  -5.737
  255    HG   SER  38           HG       SER  38   0.825 -12.577  -5.198
  256    H    THR  39           H        THR  39   0.813 -11.514  -3.179
  257    HA   THR  39           HA       THR  39   1.779 -10.260  -0.825
  258    HB   THR  39           HB       THR  39   2.349 -12.562  -0.105
  259    HG1  THR  39           1HG      THR  39   1.419 -13.345  -2.664
  260   1HG2  THR  39          1HG2      THR  39   0.146 -12.144   0.410
  261   2HG2  THR  39          2HG2      THR  39   0.032 -13.602  -0.577
  262   3HG2  THR  39          3HG2      THR  39  -0.338 -12.029  -1.282
  263    H    LYS  40           H        LYS  40   3.402 -12.087  -3.409
  264    HA   LYS  40           HA       LYS  40   6.005 -11.858  -2.363
  265   1HB   LYS  40          2HB       LYS  40   6.737 -12.390  -4.696
  266   2HB   LYS  40          1HB       LYS  40   5.545 -13.512  -4.039
  267   1HG   LYS  40          2HG       LYS  40   3.963 -12.921  -5.536
  268   2HG   LYS  40          1HG       LYS  40   4.481 -11.230  -5.582
  269   1HD   LYS  40          2HD       LYS  40   6.283 -11.736  -7.048
  270   2HD   LYS  40          1HD       LYS  40   6.068 -13.472  -6.818
  271   1HE   LYS  40          2HE       LYS  40   4.066 -13.493  -8.057
  272   2HE   LYS  40          1HE       LYS  40   3.918 -11.738  -7.997
  273   1HZ   LYS  40          1HZ       LYS  40   5.902 -13.314  -9.538
  274   2HZ   LYS  40          2HZ       LYS  40   5.974 -11.634  -9.362
  275   3HZ   LYS  40          3HZ       LYS  40   4.661 -12.346 -10.156
  276    H    GLU  41           H        GLU  41   4.056  -9.702  -4.297
  277    HA   GLU  41           HA       GLU  41   6.165  -8.003  -5.158
  278   1HB   GLU  41          2HB       GLU  41   3.205  -7.468  -4.869
  279   2HB   GLU  41          1HB       GLU  41   4.340  -6.398  -5.680
  280   1HG   GLU  41          2HG       GLU  41   4.882  -8.379  -7.181
  281   2HG   GLU  41          1HG       GLU  41   3.439  -9.135  -6.507
  282    H    LEU  42           H        LEU  42   4.362  -8.268  -2.210
  283    HA   LEU  42           HA       LEU  42   4.999  -5.617  -1.293
  284   1HB   LEU  42          2HB       LEU  42   3.275  -7.752  -0.478
  285   2HB   LEU  42          1HB       LEU  42   4.262  -7.257   0.892
  286    HG   LEU  42           HG       LEU  42   2.163  -6.045   0.890
  287   1HD1  LEU  42          1HD1      LEU  42   3.106  -3.684   0.695
  288   2HD1  LEU  42          2HD1      LEU  42   4.628  -4.455   0.248
  289   3HD1  LEU  42          3HD1      LEU  42   3.902  -4.781   1.822
  290   1HD2  LEU  42          1HD2      LEU  42   2.045  -6.214  -1.709
  291   2HD2  LEU  42          2HD2      LEU  42   2.884  -4.664  -1.656
  292   3HD2  LEU  42          3HD2      LEU  42   1.311  -4.843  -0.879
  293    H    GLY  43           H        GLY  43   5.944  -8.892  -0.221
  294   1HA   GLY  43          2HA       GLY  43   7.810  -8.195   1.687
  295   2HA   GLY  43          1HA       GLY  43   7.910  -9.652   0.700
  296    H    THR  44           H        THR  44   8.150  -8.115  -1.792
  297    HA   THR  44           HA       THR  44  10.919  -8.032  -2.029
  298    HB   THR  44           HB       THR  44   8.625  -7.056  -3.664
  299    HG1  THR  44           1HG      THR  44   9.522  -9.209  -3.759
  300   1HG2  THR  44          1HG2      THR  44   9.886  -5.244  -4.275
  301   2HG2  THR  44          2HG2      THR  44  10.435  -6.454  -5.437
  302   3HG2  THR  44          3HG2      THR  44  11.417  -6.082  -4.019
  303    H    VAL  45           H        VAL  45   8.969  -5.128  -2.525
  304    HA   VAL  45           HA       VAL  45  11.022  -3.318  -1.985
  305    HB   VAL  45           HB       VAL  45   9.059  -2.694  -3.257
  306   1HG1  VAL  45          1HG1      VAL  45   7.222  -3.766  -2.431
  307   2HG1  VAL  45          2HG1      VAL  45   6.967  -2.163  -1.742
  308   3HG1  VAL  45          3HG1      VAL  45   7.649  -3.451  -0.748
  309   1HG2  VAL  45          1HG2      VAL  45   9.252  -0.549  -2.666
  310   2HG2  VAL  45          2HG2      VAL  45  10.297  -1.117  -1.363
  311   3HG2  VAL  45          3HG2      VAL  45   8.581  -0.844  -1.062
  312    H    MET  46           H        MET  46   8.725  -4.857   0.159
  313    HA   MET  46           HA       MET  46   9.136  -3.074   2.344
  314   1HB   MET  46          2HB       MET  46   7.874  -5.788   2.074
  315   2HB   MET  46          1HB       MET  46   8.053  -5.008   3.648
  316   1HG   MET  46          2HG       MET  46   6.936  -3.037   2.097
  317   2HG   MET  46          1HG       MET  46   6.154  -4.504   1.502
  318   1HE   MET  46          1HE       MET  46   5.474  -2.358   5.441
  319   2HE   MET  46          2HE       MET  46   5.525  -1.662   3.818
  320   3HE   MET  46          3HE       MET  46   6.996  -2.309   4.550
  321    H    ARG  47           H        ARG  47  10.629  -6.090   1.316
  322    HA   ARG  47           HA       ARG  47  12.136  -6.360   3.766
  323   1HB   ARG  47          2HB       ARG  47  12.177  -7.870   1.159
  324   2HB   ARG  47          1HB       ARG  47  13.281  -8.222   2.480
  325   1HG   ARG  47          2HG       ARG  47  11.502  -8.874   3.909
  326   2HG   ARG  47          1HG       ARG  47  10.290  -8.269   2.779
  327   1HD   ARG  47          2HD       ARG  47  10.434 -10.691   2.659
  328   2HD   ARG  47          1HD       ARG  47  10.977  -9.963   1.143
  329    HE   ARG  47           HE       ARG  47  12.616 -11.368   3.104
  330   1HH1  ARG  47          1HH1      ARG  47  12.476  -9.508   0.147
  331   2HH1  ARG  47          2HH1      ARG  47  14.056  -9.986  -0.369
  332   1HH2  ARG  47          1HH2      ARG  47  14.690 -11.993   2.417
  333   2HH2  ARG  47          2HH2      ARG  47  15.312 -11.396   0.917
  334    H    MET  48           H        MET  48  12.610  -4.942   0.625
  335    HA   MET  48           HA       MET  48  15.479  -4.671   1.076
  336   1HB   MET  48          2HB       MET  48  15.580  -3.793  -1.193
  337   2HB   MET  48          1HB       MET  48  14.712  -5.328  -1.159
  338   1HG   MET  48          2HG       MET  48  12.884  -4.410  -2.009
  339   2HG   MET  48          1HG       MET  48  12.913  -3.093  -0.840
  340   1HE   MET  48          1HE       MET  48  12.308  -1.180  -1.844
  341   2HE   MET  48          2HE       MET  48  11.809  -1.765  -3.432
  342   3HE   MET  48          3HE       MET  48  12.936  -0.412  -3.304
  343    H    LEU  49           H        LEU  49  13.033  -3.106   2.352
  344    HA   LEU  49           HA       LEU  49  14.295  -0.464   2.036
  345   1HB   LEU  49          2HB       LEU  49  11.407  -1.225   2.271
  346   2HB   LEU  49          1HB       LEU  49  11.947   0.362   2.784
  347    HG   LEU  49           HG       LEU  49  12.068  -0.803   0.008
  348   1HD1  LEU  49          1HD1      LEU  49   9.958   0.068   0.237
  349   2HD1  LEU  49          2HD1      LEU  49  10.841   1.478  -0.346
  350   3HD1  LEU  49          3HD1      LEU  49  10.476   1.315   1.371
  351   1HD2  LEU  49          1HD2      LEU  49  14.026   0.349  -0.083
  352   2HD2  LEU  49          2HD2      LEU  49  13.576   1.438   1.230
  353   3HD2  LEU  49          3HD2      LEU  49  12.913   1.684  -0.387
  354    H    GLY  50           H        GLY  50  12.578  -2.633   4.259
  355   1HA   GLY  50          2HA       GLY  50  14.243  -2.225   6.428
  356   2HA   GLY  50          1HA       GLY  50  12.992  -0.992   6.556
  357    H    GLN  51           H        GLN  51  10.796  -2.451   5.604
  358    HA   GLN  51           HA       GLN  51  10.060  -3.849   7.957
  359   1HB   GLN  51          2HB       GLN  51   8.717  -3.684   5.251
  360   2HB   GLN  51          1HB       GLN  51   7.990  -4.420   6.679
  361   1HG   GLN  51          2HG       GLN  51   7.073  -2.303   6.659
  362   2HG   GLN  51          1HG       GLN  51   8.404  -2.148   7.805
  363   1HE2  GLN  51          1HE2      GLN  51   7.872   0.161   7.168
  364   2HE2  GLN  51          2HE2      GLN  51   8.784   0.822   5.858
  365    H    ASN  52           H        ASN  52   9.232  -6.103   7.991
  366    HA   ASN  52           HA       ASN  52  10.503  -7.889   6.061
  367   1HB   ASN  52          2HB       ASN  52  11.196  -7.675   8.952
  368   2HB   ASN  52          1HB       ASN  52  11.171  -9.280   8.216
  369   1HD2  ASN  52          1HD2      ASN  52  13.040  -9.928   7.460
  370   2HD2  ASN  52          2HD2      ASN  52  14.309  -8.920   6.861
  371    HA   PRO  53           HA       PRO  53   6.321  -9.273   7.754
  372   1HB   PRO  53          2HB       PRO  53   4.743  -8.686   5.663
  373   2HB   PRO  53          1HB       PRO  53   5.132  -7.482   6.897
  374   1HG   PRO  53          2HG       PRO  53   6.333  -7.863   4.180
  375   2HG   PRO  53          1HG       PRO  53   5.841  -6.361   4.984
  376   1HD   PRO  53          2HD       PRO  53   8.427  -7.240   4.890
  377   2HD   PRO  53          1HD       PRO  53   7.782  -6.232   6.203
  378    H    THR  54           H        THR  54   6.728 -11.427   7.631
  379    HA   THR  54           HA       THR  54   7.614 -12.817   5.367
  380    HB   THR  54           HB       THR  54   6.379 -14.778   6.744
  381    HG1  THR  54           1HG      THR  54   5.424 -13.268   8.190
  382   1HG2  THR  54          1HG2      THR  54   8.749 -14.764   6.447
  383   2HG2  THR  54          2HG2      THR  54   8.396 -14.966   8.163
  384   3HG2  THR  54          3HG2      THR  54   8.926 -13.400   7.550
  385    H    LYS  55           H        LYS  55   6.122 -14.904   4.755
  386    HA   LYS  55           HA       LYS  55   4.240 -13.958   2.939
  387   1HB   LYS  55          2HB       LYS  55   5.369 -16.196   2.875
  388   2HB   LYS  55          1HB       LYS  55   4.283 -16.724   4.160
  389   1HG   LYS  55          2HG       LYS  55   3.020 -17.460   2.465
  390   2HG   LYS  55          1HG       LYS  55   2.507 -15.775   2.349
  391   1HD   LYS  55          2HD       LYS  55   4.946 -16.687   0.882
  392   2HD   LYS  55          1HD       LYS  55   3.347 -17.038   0.223
  393   1HE   LYS  55          2HE       LYS  55   3.397 -15.006  -0.685
  394   2HE   LYS  55          1HE       LYS  55   3.207 -14.366   0.947
  395   1HZ   LYS  55          1HZ       LYS  55   5.129 -13.474  -0.384
  396   2HZ   LYS  55          2HZ       LYS  55   5.858 -14.991  -0.217
  397   3HZ   LYS  55          3HZ       LYS  55   5.515 -14.062   1.155
  398    H    CYS  56           H        CYS  56   3.658 -15.577   6.061
  399    HA   CYS  56           HA       CYS  56   0.860 -15.320   6.015
  400   1HB   CYS  56          2HB       CYS  56   2.198 -16.828   7.526
  401   2HB   CYS  56          1HB       CYS  56   2.602 -15.403   8.485
  402    HG   CYS  56           HG       CYS  56   0.584 -16.173   9.708
  403    H    GLU  57           H        GLU  57   3.407 -13.149   7.032
  404    HA   GLU  57           HA       GLU  57   1.906 -11.323   8.525
  405   1HB   GLU  57          2HB       GLU  57   4.541 -11.543   7.706
  406   2HB   GLU  57          1HB       GLU  57   3.988 -10.078   6.894
  407   1HG   GLU  57          2HG       GLU  57   3.591 -10.552   9.833
  408   2HG   GLU  57          1HG       GLU  57   5.041  -9.796   9.175
  409    H    LEU  58           H        LEU  58   2.933 -11.006   5.125
  410    HA   LEU  58           HA       LEU  58   1.263  -8.796   4.585
  411   1HB   LEU  58          2HB       LEU  58   2.301 -10.773   2.560
  412   2HB   LEU  58          1HB       LEU  58   1.857  -9.093   2.285
  413    HG   LEU  58           HG       LEU  58   4.094  -9.769   4.167
  414   1HD1  LEU  58          1HD1      LEU  58   5.526  -9.266   2.035
  415   2HD1  LEU  58          2HD1      LEU  58   4.110  -9.893   1.189
  416   3HD1  LEU  58          3HD1      LEU  58   4.954 -10.901   2.365
  417   1HD2  LEU  58          1HD2      LEU  58   3.073  -7.392   2.722
  418   2HD2  LEU  58          2HD2      LEU  58   4.819  -7.524   2.931
  419   3HD2  LEU  58          3HD2      LEU  58   3.759  -7.529   4.341
  420    H    ASP  59           H        ASP  59   0.768 -12.249   4.433
  421    HA   ASP  59           HA       ASP  59  -1.558 -12.279   2.844
  422   1HB   ASP  59          2HB       ASP  59  -0.211 -14.296   3.399
  423   2HB   ASP  59          1HB       ASP  59  -0.804 -14.198   5.059
  424    H    ALA  60           H        ALA  60  -1.016 -11.441   6.159
  425    HA   ALA  60           HA       ALA  60  -3.761 -11.705   6.945
  426   1HB   ALA  60          1HB       ALA  60  -1.257 -10.767   8.220
  427   2HB   ALA  60          2HB       ALA  60  -2.490 -11.876   8.820
  428   3HB   ALA  60          3HB       ALA  60  -2.772 -10.136   8.867
  429    H    ILE  61           H        ILE  61  -1.733  -9.203   5.611
  430    HA   ILE  61           HA       ILE  61  -3.653  -7.102   6.100
  431    HB   ILE  61           HB       ILE  61  -0.993  -7.228   4.708
  432   1HG1  ILE  61          2HG1      ILE  61  -0.414  -5.509   6.371
  433   2HG1  ILE  61          1HG1      ILE  61  -2.071  -5.542   6.981
  434   1HG2  ILE  61          1HG2      ILE  61  -2.967  -4.958   4.593
  435   2HG2  ILE  61          2HG2      ILE  61  -2.258  -5.841   3.240
  436   3HG2  ILE  61          3HG2      ILE  61  -1.248  -4.789   4.231
  437   1HD1  ILE  61          1HD1      ILE  61  -0.174  -7.880   7.017
  438   2HD1  ILE  61          2HD1      ILE  61  -1.785  -7.811   7.733
  439   3HD1  ILE  61          3HD1      ILE  61  -0.489  -6.805   8.378
  440    H    ILE  62           H        ILE  62  -2.237  -8.555   3.152
  441    HA   ILE  62           HA       ILE  62  -3.791  -7.440   1.216
  442    HB   ILE  62           HB       ILE  62  -2.926 -10.330   1.353
  443   1HG1  ILE  62          2HG1      ILE  62  -1.652  -7.849   0.178
  444   2HG1  ILE  62          1HG1      ILE  62  -1.038  -8.835   1.508
  445   1HG2  ILE  62          1HG2      ILE  62  -3.857  -8.692  -1.004
  446   2HG2  ILE  62          2HG2      ILE  62  -4.688 -10.073  -0.288
  447   3HG2  ILE  62          3HG2      ILE  62  -3.141 -10.301  -1.103
  448   1HD1  ILE  62          1HD1      ILE  62  -1.434 -10.428  -0.855
  449   2HD1  ILE  62          2HD1      ILE  62   0.025 -10.171   0.103
  450   3HD1  ILE  62          3HD1      ILE  62  -0.396  -9.043  -1.186
  451    H    CYS  63           H        CYS  63  -4.660 -10.194   3.271
  452    HA   CYS  63           HA       CYS  63  -7.090 -10.860   2.071
  453   1HB   CYS  63          2HB       CYS  63  -5.733 -12.000   4.014
  454   2HB   CYS  63          1HB       CYS  63  -6.766 -11.012   5.049
  455    HG   CYS  63           HG       CYS  63  -7.631 -13.494   3.501
  456    H    GLU  64           H        GLU  64  -6.409  -8.600   4.729
  457    HA   GLU  64           HA       GLU  64  -9.127  -7.742   4.963
  458   1HB   GLU  64          2HB       GLU  64  -6.527  -7.025   6.180
  459   2HB   GLU  64          1HB       GLU  64  -7.717  -5.732   6.119
  460   1HG   GLU  64          2HG       GLU  64  -8.781  -8.279   7.076
  461   2HG   GLU  64          1HG       GLU  64  -7.508  -7.600   8.090
  462    H    VAL  65           H        VAL  65  -6.304  -6.723   3.186
  463    HA   VAL  65           HA       VAL  65  -7.176  -4.172   2.369
  464    HB   VAL  65           HB       VAL  65  -5.277  -6.141   1.084
  465   1HG1  VAL  65          1HG1      VAL  65  -6.004  -3.351   0.233
  466   2HG1  VAL  65          2HG1      VAL  65  -6.009  -4.829  -0.729
  467   3HG1  VAL  65          3HG1      VAL  65  -4.479  -4.117  -0.218
  468   1HG2  VAL  65          1HG2      VAL  65  -4.250  -5.409   3.019
  469   2HG2  VAL  65          2HG2      VAL  65  -4.970  -3.804   2.922
  470   3HG2  VAL  65          3HG2      VAL  65  -3.656  -4.248   1.833
  471    H    ASP  66           H        ASP  66  -7.315  -7.325   0.738
  472    HA   ASP  66           HA       ASP  66  -8.877  -6.345  -1.444
  473   1HB   ASP  66          2HB       ASP  66  -8.005  -9.073  -0.528
  474   2HB   ASP  66          1HB       ASP  66  -9.155  -8.889  -1.852
  475    H    GLU  67           H        GLU  67 -10.961  -5.892  -1.382
  476    HA   GLU  67           HA       GLU  67 -12.627  -6.963   0.750
  477   1HB   GLU  67          2HB       GLU  67 -14.292  -5.343   0.009
  478   2HB   GLU  67          1HB       GLU  67 -12.728  -4.558   0.233
  479   1HG   GLU  67          2HG       GLU  67 -13.376  -5.548  -2.483
  480   2HG   GLU  67          1HG       GLU  67 -14.261  -4.136  -1.893
  481    H    ASP  68           H        ASP  68 -12.049  -7.412  -2.627
  482    HA   ASP  68           HA       ASP  68 -14.504  -8.980  -2.932
  483   1HB   ASP  68          2HB       ASP  68 -13.937  -8.985  -5.348
  484   2HB   ASP  68          1HB       ASP  68 -14.102  -7.359  -4.691
  485    H    GLY  69           H        GLY  69 -11.930  -9.765  -1.473
  486   1HA   GLY  69          2HA       GLY  69 -10.580 -11.614  -1.253
  487   2HA   GLY  69          1HA       GLY  69 -11.972 -12.480  -1.884
  488    H    SER  70           H        SER  70  -9.457 -10.313  -3.195
  489    HA   SER  70           HA       SER  70  -9.124 -12.221  -5.415
  490   1HB   SER  70          2HB       SER  70  -8.024 -10.029  -6.456
  491   2HB   SER  70          1HB       SER  70  -9.767 -10.317  -6.531
  492    HG   SER  70           HG       SER  70  -9.958  -9.019  -4.639
  493    H    GLY  71           H        GLY  71  -7.542 -10.531  -2.841
  494   1HA   GLY  71          2HA       GLY  71  -5.450 -10.918  -1.929
  495   2HA   GLY  71          1HA       GLY  71  -5.162 -12.107  -3.198
  496    H    THR  72           H        THR  72  -6.170  -9.340  -4.706
  497    HA   THR  72           HA       THR  72  -3.393  -8.455  -5.119
  498    HB   THR  72           HB       THR  72  -3.904  -7.945  -7.363
  499    HG1  THR  72           1HG      THR  72  -5.970  -7.808  -8.152
  500   1HG2  THR  72          1HG2      THR  72  -4.571  -9.945  -8.351
  501   2HG2  THR  72          2HG2      THR  72  -5.617 -10.370  -6.996
  502   3HG2  THR  72          3HG2      THR  72  -3.865 -10.428  -6.809
  503    H    ILE  73           H        ILE  73  -2.982  -6.228  -5.343
  504    HA   ILE  73           HA       ILE  73  -5.001  -4.529  -4.043
  505    HB   ILE  73           HB       ILE  73  -2.039  -4.033  -4.301
  506   1HG1  ILE  73          2HG1      ILE  73  -3.559  -4.958  -1.852
  507   2HG1  ILE  73          1HG1      ILE  73  -2.650  -6.042  -2.908
  508   1HG2  ILE  73          1HG2      ILE  73  -2.491  -2.379  -2.474
  509   2HG2  ILE  73          2HG2      ILE  73  -4.214  -2.648  -2.740
  510   3HG2  ILE  73          3HG2      ILE  73  -3.216  -1.976  -4.029
  511   1HD1  ILE  73          1HD1      ILE  73  -0.629  -5.269  -2.183
  512   2HD1  ILE  73          2HD1      ILE  73  -1.594  -5.065  -0.721
  513   3HD1  ILE  73          3HD1      ILE  73  -1.262  -3.679  -1.760
  514    H    ASP  74           H        ASP  74  -6.025  -3.093  -5.269
  515    HA   ASP  74           HA       ASP  74  -5.258  -2.575  -7.968
  516   1HB   ASP  74          2HB       ASP  74  -7.536  -2.023  -6.249
  517   2HB   ASP  74          1HB       ASP  74  -7.133  -0.631  -7.259
  518    H    PHE  75           H        PHE  75  -5.675   0.058  -8.435
  519    HA   PHE  75           HA       PHE  75  -3.188   1.215  -7.828
  520   1HB   PHE  75          2HB       PHE  75  -5.325   1.788  -9.538
  521   2HB   PHE  75          1HB       PHE  75  -5.203   3.199  -8.484
  522    HD1  PHE  75           1HD      PHE  75  -2.930   4.321  -8.264
  523    HD2  PHE  75           2HD      PHE  75  -3.858   1.507 -11.320
  524    HE1  PHE  75           1HE      PHE  75  -1.048   5.163  -9.607
  525    HE2  PHE  75           2HE      PHE  75  -1.977   2.343 -12.667
  526    HZ   PHE  75           HZ       PHE  75  -0.569   4.174 -11.811
  527    H    GLU  76           H        GLU  76  -6.301   2.692  -6.941
  528    HA   GLU  76           HA       GLU  76  -5.176   4.168  -4.803
  529   1HB   GLU  76          2HB       GLU  76  -8.017   3.541  -5.588
  530   2HB   GLU  76          1HB       GLU  76  -7.631   4.521  -4.179
  531   1HG   GLU  76          2HG       GLU  76  -6.240   5.924  -5.854
  532   2HG   GLU  76          1HG       GLU  76  -7.230   5.126  -7.075
  533    H    GLU  77           H        GLU  77  -6.501   0.975  -5.043
  534    HA   GLU  77           HA       GLU  77  -7.330   0.466  -2.460
  535   1HB   GLU  77          2HB       GLU  77  -6.594  -1.085  -4.766
  536   2HB   GLU  77          1HB       GLU  77  -5.954  -1.849  -3.317
  537   1HG   GLU  77          2HG       GLU  77  -8.220  -1.754  -2.322
  538   2HG   GLU  77          1HG       GLU  77  -8.825  -1.121  -3.858
  539    H    PHE  78           H        PHE  78  -4.111   0.932  -3.666
  540    HA   PHE  78           HA       PHE  78  -2.665  -0.332  -1.599
  541   1HB   PHE  78          2HB       PHE  78  -1.772   0.512  -3.835
  542   2HB   PHE  78          1HB       PHE  78  -1.739   2.119  -3.104
  543    HD1  PHE  78           1HD      PHE  78  -0.711  -1.331  -2.101
  544    HD2  PHE  78           2HD      PHE  78   0.331   2.785  -2.400
  545    HE1  PHE  78           1HE      PHE  78   1.493  -1.821  -1.123
  546    HE2  PHE  78           2HE      PHE  78   2.536   2.300  -1.424
  547    HZ   PHE  78           HZ       PHE  78   3.119  -0.003  -0.783
  548    H    LEU  79           H        LEU  79  -4.585   2.477  -1.563
  549    HA   LEU  79           HA       LEU  79  -3.190   3.596   0.752
  550   1HB   LEU  79          2HB       LEU  79  -5.596   4.615  -0.772
  551   2HB   LEU  79          1HB       LEU  79  -4.801   5.455   0.546
  552    HG   LEU  79           HG       LEU  79  -2.745   4.980  -1.259
  553   1HD1  LEU  79          1HD1      LEU  79  -5.328   5.243  -2.665
  554   2HD1  LEU  79          2HD1      LEU  79  -3.820   4.488  -3.182
  555   3HD1  LEU  79          3HD1      LEU  79  -4.000   6.240  -3.260
  556   1HD2  LEU  79          1HD2      LEU  79  -2.529   7.055  -0.458
  557   2HD2  LEU  79          2HD2      LEU  79  -4.265   7.238  -0.212
  558   3HD2  LEU  79          3HD2      LEU  79  -3.562   7.545  -1.800
  559    H    VAL  80           H        VAL  80  -6.323   2.256  -0.204
  560    HA   VAL  80           HA       VAL  80  -7.587   2.473   2.301
  561    HB   VAL  80           HB       VAL  80  -8.090   0.403   0.160
  562   1HG1  VAL  80          1HG1      VAL  80  -9.187  -0.322   2.111
  563   2HG1  VAL  80          2HG1      VAL  80 -10.426   0.502   1.165
  564   3HG1  VAL  80          3HG1      VAL  80  -9.680   1.315   2.542
  565   1HG2  VAL  80          1HG2      VAL  80  -9.531   3.010   0.559
  566   2HG2  VAL  80          2HG2      VAL  80  -9.673   1.886  -0.792
  567   3HG2  VAL  80          3HG2      VAL  80  -8.190   2.815  -0.568
  568    H    MET  81           H        MET  81  -5.451   0.064   0.918
  569    HA   MET  81           HA       MET  81  -5.809  -2.084   2.599
  570   1HB   MET  81          2HB       MET  81  -3.232  -2.353   2.309
  571   2HB   MET  81          1HB       MET  81  -4.275  -2.472   0.902
  572   1HG   MET  81          2HG       MET  81  -3.504  -0.578  -0.009
  573   2HG   MET  81          1HG       MET  81  -3.212   0.198   1.546
  574   1HE   MET  81          1HE       MET  81  -0.845  -2.092   2.951
  575   2HE   MET  81          2HE       MET  81  -1.616  -0.515   3.128
  576   3HE   MET  81          3HE       MET  81   0.086  -0.616   2.670
  577    H    MET  82           H        MET  82  -3.947   0.842   3.134
  578    HA   MET  82           HA       MET  82  -3.204  -0.004   5.813
  579   1HB   MET  82          2HB       MET  82  -2.264   1.978   3.874
  580   2HB   MET  82          1HB       MET  82  -2.285   2.560   5.541
  581   1HG   MET  82          2HG       MET  82  -1.185   0.027   5.731
  582   2HG   MET  82          1HG       MET  82  -0.493   0.687   4.251
  583   1HE   MET  82          1HE       MET  82  -0.694   3.639   4.819
  584   2HE   MET  82          2HE       MET  82   0.927   3.175   4.298
  585   3HE   MET  82          3HE       MET  82   0.716   4.184   5.730
  586    H    VAL  83           H        VAL  83  -5.451   2.136   4.213
  587    HA   VAL  83           HA       VAL  83  -6.089   3.836   6.351
  588    HB   VAL  83           HB       VAL  83  -7.895   2.836   4.139
  589   1HG1  VAL  83          1HG1      VAL  83  -9.231   3.723   5.941
  590   2HG1  VAL  83          2HG1      VAL  83  -9.228   4.865   4.596
  591   3HG1  VAL  83          3HG1      VAL  83  -8.227   5.171   6.017
  592   1HG2  VAL  83          1HG2      VAL  83  -5.634   4.472   4.005
  593   2HG2  VAL  83          2HG2      VAL  83  -7.012   5.570   3.912
  594   3HG2  VAL  83          3HG2      VAL  83  -6.863   4.244   2.760
  595    H    ARG  84           H        ARG  84  -7.352   0.663   5.426
  596    HA   ARG  84           HA       ARG  84  -9.355   0.505   7.410
  597   1HB   ARG  84          2HB       ARG  84  -7.859  -1.761   6.078
  598   2HB   ARG  84          1HB       ARG  84  -9.400  -1.885   6.915
  599   1HG   ARG  84          2HG       ARG  84  -9.983   0.019   5.088
  600   2HG   ARG  84          1HG       ARG  84  -8.787  -0.937   4.203
  601   1HD   ARG  84          2HD       ARG  84 -10.172  -2.692   3.989
  602   2HD   ARG  84          1HD       ARG  84 -10.794  -2.527   5.631
  603    HE   ARG  84           HE       ARG  84 -11.735  -0.497   3.826
  604   1HH1  ARG  84          1HH1      ARG  84 -12.286  -3.720   5.046
  605   2HH1  ARG  84          2HH1      ARG  84 -13.974  -3.712   4.662
  606   1HH2  ARG  84          1HH2      ARG  84 -13.956  -0.483   3.320
  607   2HH2  ARG  84          2HH2      ARG  84 -14.922  -1.874   3.681
  608    H    GLN  85           H        GLN  85  -5.926   0.003   7.475
  609    HA   GLN  85           HA       GLN  85  -6.091  -1.174  10.160
  610   1HB   GLN  85          2HB       GLN  85  -3.544  -0.857   8.595
  611   2HB   GLN  85          1HB       GLN  85  -3.920  -2.014   9.871
  612   1HG   GLN  85          2HG       GLN  85  -4.924  -2.024   7.033
  613   2HG   GLN  85          1HG       GLN  85  -3.825  -3.181   7.794
  614   1HE2  GLN  85          1HE2      GLN  85  -6.462  -3.508   6.473
  615   2HE2  GLN  85          2HE2      GLN  85  -7.447  -4.336   7.626
  616    H    MET  86           H        MET  86  -6.286   1.759   9.101
  617    HA   MET  86           HA       MET  86  -4.327   2.897  10.981
  618   1HB   MET  86          2HB       MET  86  -5.231   3.712   8.285
  619   2HB   MET  86          1HB       MET  86  -5.040   5.020   9.456
  620   1HG   MET  86          2HG       MET  86  -2.726   3.964   9.902
  621   2HG   MET  86          1HG       MET  86  -2.983   3.149   8.355
  622   1HE   MET  86          1HE       MET  86  -1.500   3.876   6.799
  623   2HE   MET  86          2HE       MET  86  -1.372   5.486   6.091
  624   3HE   MET  86          3HE       MET  86  -2.859   4.555   5.902
  625    H    LYS  87           H        LYS  87  -7.643   3.021   9.792
  626    HA   LYS  87           HA       LYS  87  -8.608   5.135  11.329
  627   1HB   LYS  87          2HB       LYS  87  -9.788   2.798   9.947
  628   2HB   LYS  87          1HB       LYS  87 -10.777   3.518  11.216
  629   1HG   LYS  87          2HG       LYS  87 -11.409   5.125   9.837
  630   2HG   LYS  87          1HG       LYS  87  -9.725   5.614   9.607
  631   1HD   LYS  87          2HD       LYS  87 -10.283   5.107   7.448
  632   2HD   LYS  87          1HD       LYS  87  -9.709   3.528   7.987
  633   1HE   LYS  87          2HE       LYS  87 -12.567   4.105   8.446
  634   2HE   LYS  87          1HE       LYS  87 -12.074   3.921   6.765
  635   1HZ   LYS  87          1HZ       LYS  87 -12.006   1.737   7.032
  636   2HZ   LYS  87          2HZ       LYS  87 -12.582   1.913   8.613
  637   3HZ   LYS  87          3HZ       LYS  87 -10.916   1.872   8.320
  638    H    GLU  88           H        GLU  88  -9.180   1.688  12.046
  639    HA   GLU  88           HA       GLU  88  -9.792   2.254  14.784
  640   1HB   GLU  88          2HB       GLU  88  -9.668  -0.172  13.067
  641   2HB   GLU  88          1HB       GLU  88  -9.533  -0.406  14.805
  642   1HG   GLU  88          2HG       GLU  88 -11.659   0.612  15.178
  643   2HG   GLU  88          1HG       GLU  88 -11.774   1.106  13.490
  644    H    ASP  89           H        ASP  89  -8.570   1.936  16.591
  645    HA   ASP  89           HA       ASP  89  -5.997   0.649  16.471
  646   1HB   ASP  89          2HB       ASP  89  -5.698   3.063  15.613
  647   2HB   ASP  89          1HB       ASP  89  -5.982   3.547  17.286
  648    H    ALA  90           H        ALA  90  -8.531   0.437  17.937
  649    HA   ALA  90           HA       ALA  90  -9.262  -0.029  20.040
  650   1HB   ALA  90          1HB       ALA  90  -6.303  -0.247  20.325
  651   2HB   ALA  90          2HB       ALA  90  -7.544  -1.491  20.470
  652   3HB   ALA  90          3HB       ALA  90  -7.313  -0.320  21.769
  653   2H    ARG 115          HN2       ARG 115   1.296  -4.077  10.572
  654    H    ARG 115           H        ARG 115   2.548  -3.176   9.824
  655   3H    ARG 115          HN3       ARG 115   1.578  -2.449  11.035
  656    HA   ARG 115           HA       ARG 115   0.979  -3.053   8.255
  657   1HB   ARG 115          2HB       ARG 115  -1.468  -2.731   8.904
  658   2HB   ARG 115          1HB       ARG 115  -0.749  -4.290   9.282
  659   1HG   ARG 115          2HG       ARG 115  -0.279  -2.901  11.577
  660   2HG   ARG 115          1HG       ARG 115  -1.825  -2.229  11.057
  661   1HD   ARG 115          2HD       ARG 115  -2.893  -4.060  11.724
  662   2HD   ARG 115          1HD       ARG 115  -1.851  -5.077  10.730
  663    HE   ARG 115           HE       ARG 115  -0.647  -4.242  13.205
  664   1HH1  ARG 115          1HH1      ARG 115  -2.670  -6.633  11.666
  665   2HH1  ARG 115          2HH1      ARG 115  -2.331  -7.858  12.842
  666   1HH2  ARG 115          1HH2      ARG 115  -0.201  -5.851  14.753
  667   2HH2  ARG 115          2HH2      ARG 115  -0.929  -7.414  14.596
  668    H    MET 116           H        MET 116   0.232  -1.030  11.108
  669    HA   MET 116           HA       MET 116  -0.511   1.263   9.698
  670   1HB   MET 116          2HB       MET 116  -0.457   0.589  12.319
  671   2HB   MET 116          1HB       MET 116   0.916   1.686  12.253
  672   1HG   MET 116          2HG       MET 116  -0.840   3.183  10.938
  673   2HG   MET 116          1HG       MET 116  -1.972   2.228  11.895
  674   1HE   MET 116          1HE       MET 116  -1.749   5.444  12.147
  675   2HE   MET 116          2HE       MET 116  -0.051   5.332  11.683
  676   3HE   MET 116          3HE       MET 116  -0.497   6.030  13.241
  677    H    SER 117           H        SER 117   1.086   3.343  10.629
  678    HA   SER 117           HA       SER 117   2.836   4.612   9.902
  679   1HB   SER 117          2HB       SER 117   4.281   2.007  10.421
  680   2HB   SER 117          1HB       SER 117   5.081   3.554  10.142
  681    HG   SER 117           HG       SER 117   3.816   4.325  11.984
  682    H    ALA 118           H        ALA 118   4.798   2.186   8.528
  683    HA   ALA 118           HA       ALA 118   5.290   1.590   6.391
  684   1HB   ALA 118          1HB       ALA 118   2.771   1.181   6.312
  685   2HB   ALA 118          2HB       ALA 118   3.610   1.402   4.776
  686   3HB   ALA 118          3HB       ALA 118   2.673   2.726   5.467
  687    H    ASP 119           H        ASP 119   4.241   4.812   7.146
  688    HA   ASP 119           HA       ASP 119   4.762   6.271   4.903
  689   1HB   ASP 119          2HB       ASP 119   4.007   7.183   7.109
  690   2HB   ASP 119          1HB       ASP 119   5.665   7.042   7.686
  691    H    ALA 120           H        ALA 120   7.011   4.643   7.006
  692    HA   ALA 120           HA       ALA 120   9.388   5.885   6.125
  693   1HB   ALA 120          1HB       ALA 120  10.447   4.414   7.473
  694   2HB   ALA 120          2HB       ALA 120   9.570   3.029   6.824
  695   3HB   ALA 120          3HB       ALA 120   8.815   4.059   8.040
  696    H    MET 121           H        MET 121   8.077   2.685   5.203
  697    HA   MET 121           HA       MET 121   9.808   2.304   3.022
  698   1HB   MET 121          2HB       MET 121   8.587   0.426   3.922
  699   2HB   MET 121          1HB       MET 121   7.048   1.198   3.573
  700   1HG   MET 121          2HG       MET 121   8.122   1.131   1.099
  701   2HG   MET 121          1HG       MET 121   8.859  -0.303   1.811
  702   1HE   MET 121          1HE       MET 121   5.793   1.725   1.416
  703   2HE   MET 121          2HE       MET 121   4.798   0.820   2.555
  704   3HE   MET 121          3HE       MET 121   4.566   0.607   0.819
  705    H    LEU 122           H        LEU 122   6.651   3.808   3.330
  706    HA   LEU 122           HA       LEU 122   6.136   4.233   0.602
  707   1HB   LEU 122          2HB       LEU 122   5.197   5.487   3.150
  708   2HB   LEU 122          1HB       LEU 122   4.804   6.264   1.629
  709    HG   LEU 122           HG       LEU 122   3.774   4.063   0.902
  710   1HD1  LEU 122          1HD1      LEU 122   3.623   3.385   3.805
  711   2HD1  LEU 122          2HD1      LEU 122   5.006   2.854   2.852
  712   3HD1  LEU 122          3HD1      LEU 122   3.378   2.349   2.401
  713   1HD2  LEU 122          1HD2      LEU 122   2.718   5.798   3.096
  714   2HD2  LEU 122          2HD2      LEU 122   1.775   4.421   2.525
  715   3HD2  LEU 122          3HD2      LEU 122   2.228   5.707   1.404
  716    H    ARG 123           H        ARG 123   7.901   6.111   3.020
  717    HA   ARG 123           HA       ARG 123   8.523   8.181   1.064
  718   1HB   ARG 123          2HB       ARG 123   7.965   8.590   3.546
  719   2HB   ARG 123          1HB       ARG 123   9.601   8.030   3.868
  720   1HG   ARG 123          2HG       ARG 123  10.411   9.809   2.290
  721   2HG   ARG 123          1HG       ARG 123   8.761  10.436   2.275
  722   1HD   ARG 123          2HD       ARG 123   8.971  11.356   4.308
  723   2HD   ARG 123          1HD       ARG 123   9.812   9.950   4.958
  724    HE   ARG 123           HE       ARG 123  10.997  12.344   3.898
  725   1HH1  ARG 123          1HH1      ARG 123  11.499   8.954   4.558
  726   2HH1  ARG 123          2HH1      ARG 123  13.223   9.096   4.634
  727   1HH2  ARG 123          1HH2      ARG 123  13.264  12.533   3.997
  728   2HH2  ARG 123          2HH2      ARG 123  14.225  11.128   4.316
  729    H    ALA 124           H        ALA 124   9.623   5.231   1.296
  730    HA   ALA 124           HA       ALA 124  12.446   5.609   1.611
  731   1HB   ALA 124          1HB       ALA 124  11.465   3.479   2.178
  732   2HB   ALA 124          2HB       ALA 124  12.603   3.264   0.848
  733   3HB   ALA 124          3HB       ALA 124  10.868   3.273   0.530
  734    H    LEU 125           H        LEU 125  10.900   4.108  -1.194
  735    HA   LEU 125           HA       LEU 125  12.926   5.031  -2.959
  736   1HB   LEU 125          2HB       LEU 125  10.248   3.875  -3.705
  737   2HB   LEU 125          1HB       LEU 125  11.714   3.879  -4.669
  738    HG   LEU 125           HG       LEU 125  11.701   2.493  -2.021
  739   1HD1  LEU 125          1HD1      LEU 125   9.980   1.243  -2.715
  740   2HD1  LEU 125          2HD1      LEU 125  11.193   0.463  -3.730
  741   3HD1  LEU 125          3HD1      LEU 125  10.164   1.729  -4.399
  742   1HD2  LEU 125          1HD2      LEU 125  13.035   1.371  -4.386
  743   2HD2  LEU 125          2HD2      LEU 125  13.616   1.561  -2.732
  744   3HD2  LEU 125          3HD2      LEU 125  13.648   2.933  -3.840
  745    H    LEU 126           H        LEU 126   9.929   6.344  -1.888
  746    HA   LEU 126           HA       LEU 126   8.729   8.191  -2.461
  747   1HB   LEU 126          2HB       LEU 126  11.493   8.997  -3.345
  748   2HB   LEU 126          1HB       LEU 126  10.130  10.099  -3.382
  749    HG   LEU 126           HG       LEU 126  11.045   8.718  -0.864
  750   1HD1  LEU 126          1HD1      LEU 126  12.222  10.734  -0.276
  751   2HD1  LEU 126          2HD1      LEU 126  11.745  11.498  -1.793
  752   3HD1  LEU 126          3HD1      LEU 126  12.848  10.122  -1.808
  753   1HD2  LEU 126          1HD2      LEU 126   8.695   9.661  -1.083
  754   2HD2  LEU 126          2HD2      LEU 126   9.456  11.250  -1.161
  755   3HD2  LEU 126          3HD2      LEU 126   9.663  10.244   0.272
  756    H    GLY 127           H        GLY 127   8.404   9.853  -4.421
  757   1HA   GLY 127          2HA       GLY 127   8.073   8.138  -6.795
  758   2HA   GLY 127          1HA       GLY 127   7.059   9.516  -6.395
  759    H    SER 128           H        SER 128   7.498  11.416  -7.325
  760    HA   SER 128           HA       SER 128  10.165  11.816  -8.496
  761   1HB   SER 128          2HB       SER 128   8.055  11.198 -10.064
  762   2HB   SER 128          1HB       SER 128   7.869  12.949  -9.990
  763    HG   SER 128           HG       SER 128   9.991  11.424 -11.026
  764    H    LYS 129           H        LYS 129  11.058  13.583  -7.681
  765    HA   LYS 129           HA       LYS 129   9.356  15.917  -7.146
  766   1HB   LYS 129          2HB       LYS 129  11.133  14.465  -5.254
  767   2HB   LYS 129          1HB       LYS 129  11.123  16.221  -5.162
  768   1HG   LYS 129          2HG       LYS 129   9.028  16.305  -4.327
  769   2HG   LYS 129          1HG       LYS 129   8.486  14.899  -5.247
  770   1HD   LYS 129          2HD       LYS 129   9.540  13.401  -3.713
  771   2HD   LYS 129          1HD       LYS 129  10.353  14.733  -2.886
  772   1HE   LYS 129          2HE       LYS 129   7.856  15.558  -2.561
  773   2HE   LYS 129          1HE       LYS 129   7.522  13.836  -2.736
  774   1HZ   LYS 129          1HZ       LYS 129   7.832  14.444  -0.422
  775   2HZ   LYS 129          2HZ       LYS 129   9.377  15.045  -0.756
  776   3HZ   LYS 129          3HZ       LYS 129   9.060  13.392  -0.924
  777    H    HIS 130           H        HIS 130  10.056  17.181  -8.786
  778    HA   HIS 130           HA       HIS 130  12.779  18.170  -8.621
  779   1HB   HIS 130          2HB       HIS 130  11.679  16.870 -11.118
  780   2HB   HIS 130          1HB       HIS 130  13.112  17.893 -11.097
  781    HD1  HIS 130           1HD      HIS 130  11.889  14.507 -10.099
  782    HD2  HIS 130           2HD      HIS 130  15.407  16.716 -10.005
  783    HE1  HIS 130           1HE      HIS 130  13.701  12.860  -9.530
  784    HE2  HIS 130           2HE      HIS 130  15.809  14.234  -9.400
  785    H    LYS 131           H        LYS 131  11.809  20.113  -7.980
  786    HA   LYS 131           HA       LYS 131  10.267  21.495 -10.076
  787   1HB   LYS 131          2HB       LYS 131  10.208  21.725  -7.076
  788   2HB   LYS 131          1HB       LYS 131   9.589  23.011  -8.104
  789   1HG   LYS 131          2HG       LYS 131   8.184  21.136  -9.198
  790   2HG   LYS 131          1HG       LYS 131   8.556  20.233  -7.727
  791   1HD   LYS 131          2HD       LYS 131   7.399  21.720  -6.371
  792   2HD   LYS 131          1HD       LYS 131   7.485  23.022  -7.558
  793   1HE   LYS 131          2HE       LYS 131   5.219  22.063  -7.347
  794   2HE   LYS 131          1HE       LYS 131   5.885  21.899  -8.971
  795   1HZ   LYS 131          1HZ       LYS 131   5.880  19.758  -6.912
  796   2HZ   LYS 131          2HZ       LYS 131   6.426  19.611  -8.506
  797   3HZ   LYS 131          3HZ       LYS 131   4.784  19.871  -8.196