*HEADER    CYTOKINE                                20-OCT-00   1G2T              
*TITLE     SOLUTION STRUCTURE OF EOTAXIN-3                                       
*COMPND    MOL_ID: 1;                                                            
*COMPND   2 MOLECULE: EOTAXIN-3;                                                 
*COMPND   3 CHAIN: A;                                                            
*COMPND   4 SYNONYM: SMALL INDUCIBLE CYTOKINE A26, MACROPHAGE                    
*COMPND   5 INFLAMMATORY PROTEIN 4-ALPHA;                                        
*COMPND   6 ENGINEERED: YES                                                      
*SOURCE    MOL_ID: 1;                                                            
*SOURCE   2 ORGANISM_SCIENTIFIC: HOMO SAPIENS;                                   
*SOURCE   3 ORGANISM_COMMON: HUMAN;                                              
*SOURCE   4 ORGAN: LUNG;                                                         
*SOURCE   5 GENE: EOTAXIN-3;                                                     
*SOURCE   6 EXPRESSION_SYSTEM: ESCHERICHIA COLI;                                 
*SOURCE   7 EXPRESSION_SYSTEM_COMMON: BACTERIA;                                  
*SOURCE   8 EXPRESSION_SYSTEM_STRAIN: BL21(DE3);                                 
*SOURCE   9 EXPRESSION_SYSTEM_VECTOR_TYPE: PLASMID;                              
*SOURCE  10 EXPRESSION_SYSTEM_PLASMID: PET28A+                                   
*KEYWDS    BETA-BETA-BETA-ALPHA HELIX                                            
*EXPDTA    NMR, 20 STRUCTURES                                                    
*AUTHOR    J.YE, K.L.MAYER, M.R.MAYER, M.J.STONE                                 
*REVDAT   1   13-MAR-02 1G2T    0                                                

assign (resid 40 and name HD#) (resid 30 and name HN) 5.0 3.2 1.7      ! 246
assign (resid 43 and name HG2#) (resid 24 and name HA) 3.3 1.5 1.5        ! 448
assign (resid 43 and name HG2#) (resid 49 and name HB*) 5.0 3.2 1.5       ! 965
assign (resid 14 and name HE#) (resid 50 and name HA) 5.0 3.2 2.0       ! 969
assign (resid 14 and name HD#) (resid 50 and name HA) 5.0 3.2 2.0       ! 968
assign (resid 51 and name HA) (resid 52 and name HB*) 5.0 3.2 1.0       ! 1035
assign (resid 53 and name HB*) (resid 62 and name HD#) 5.0 3.2 2.5       ! 1082
assign (resid 27 and name HE#) (resid 68 and name HA) 5.0 3.2 2.0       ! 1580
assign (resid 65 and name HD1#) (resid 42 and name HA) 5.0 3.2 1.5 !1507
assign (resid 65 and name HB*) (resid 26 and name HA) 5.0 3.2 1.0 !1688 1689
assign (resid 65 and name HD2#) (resid 27 and name HA) 5.0 3.2 1.5 !517
assign (resid 40 and name HG2#) (resid 27 and name HA) 5.0 3.2 1.5 !518
assign (resid 27 and name HE#) (resid 66 and name HA) 5.0 3.2 2.0 !1544
assign (resid 67 and name HB*) (resid 68 and name HG#) 5.0 3.2 1.5 !1553
assign (resid 29 and name HA) (resid 40 and name HD#) 5.0 3.2 1.5 !580
assign (resid 10 and name HA) (resid 38 and name HB*) 5.0 3.2 1.5 !684
assign (resid 30 and name HG2#) (resid 38 and name HA) 5.0 3.2 1.5 !688
assign (resid 51 and name HG2#) (resid 41 and name HN) 3.3 1.5 1.7        ! 346
assign (resid 14 and name HE#) (resid 39 and name HN) 5.0 3.2 2.2        ! 320
assign (resid 21 and name HD#) (resid 22 and name HN) 5.0 3.2 2.2        ! 127
assign (resid 61 and name HD#) (resid 19 and name HN) 5.0 3.2 2.2        ! 100
assign (resid 42 and name HG2#) (resid 26 and name HN) 5.0 3.2 1.7        ! 190
assign (resid 24 and name HG1#) (resid 41 and name HE#) 5.0 3.2 3.5        ! 1671
assign (resid 24 and name HG1#) (resid 41 and name HD#) 3.3 1.5 3.5        ! 440
assign (resid 6 and name HG2#) (resid 7 and name HB*) 5.0 3.2 2.5        ! 15
assign (resid 12 and name HA) (resid 36 and name HB*) 5.0 3.2 1.0        ! 80
assign (resid 15 and name HB*) (resid 17 and name HB*) 5.0 3.2 2.0        ! 136
assign (resid 15 and name HB*) (resid 17 and name HG*) 5.0 3.2 2.0        ! 138
assign (resid 43 and name HA) (resid 44 and name HG*) 5.0 3.2 1.5        ! 1566
assign (resid 26 and name HB*) (resid 25 and name HB*) 5.0 3.2 2.0       ! 482
assign (resid 26 and name HB*) (resid 25 and name HG#) 5.0 3.2 2.0       ! 483
assign (resid 21 and name HZ2) (resid 65 and name HD2#) 3.3 1.5 3.5      ! 1538
assign (resid 62 and name HD#) (resid 29 and name HD#) 3.3 1.5 3.5      ! 1594 1439
assign (resid 62 and name HD#) (resid 27 and name HE#) 5.0 3.2 3.5      ! 1440
assign (resid 65 and name HD2#) (resid 26 and name HA) 5.0 3.2 1.5      ! 480
assign (resid 1 and name HA) (resid 1 and name HB*) 3.3 1.5 0.0 ! 1  
assign (resid 1 and name HA) (resid 1 and name HG2#) 5.0 3.2 1.5 ! 2  
assign (resid 4 and name HA) (resid 4 and name HB*) 3.3 1.5 1.0 ! 3  
assign (resid 5 and name HB*) (resid 5 and name HA) 5.0 3.2 1.0 ! 5  4  
assign (resid 6 and name HA) (resid 6 and name HB*) 3.3 1.5 0.0 ! 6  
assign (resid 6 and name HA) (resid 6 and name HG1#) 5.0 3.2 1.5 ! 7  
assign (resid 7 and name HA) (resid 7 and name HB*) 2.7 0.9 1.0 ! 19  17  
assign (resid 8 and name HA) (resid 8 and name HG#) 5.0 3.2 1.5 ! 22  
assign (resid 8 and name HA) (resid 8 and name HB*) 3.3 1.5 1.0 ! 24  23  
assign (resid 8 and name HA) (resid 8 and name HD#) 3.3 1.5 1.5 ! 25  
assign (resid 9 and name HB*) (resid 9 and name HA) 2.7 0.9 1.0 ! 27  
assign (resid 9 and name HG2#) (resid 9 and name HA) 3.3 1.5 1.5 ! 32  
assign (resid 9 and name HG2#) (resid 9 and name HB*) 2.7 0.9 2.5 ! 33  28  
assign (resid 10 and name HB1) (resid 34 and name HA) 5.0 3.2 0.0      ! 46
assign (resid 10 and name HB2) (resid 34 and name HA) 5.0 3.2 0.0      ! 42
assign (resid 10 and name HA) (resid 10 and name HB1) 3.3 1.5  0.0  ! 44 50
assign (resid 10 and name HA) (resid 10 and name HB2) 3.3 1.5  0.0      ! 43 51
assign (resid 10 and name HA) (resid 9 and name HG2#) 5.0 3.2 1.5 ! 53  31  
assign (resid 11 and name HA) (resid 50 and name HB*) 3.3 1.5 1.0 ! 56  55  
assign (resid 11 and name HB*) (resid 50 and name HA) 5.0 3.2 1.0 ! 65  
assign (resid 11 and name HB*) (resid 11 and name HA) 2.7 0.9 1.0 ! 70  69  66  58  57  
assign (resid 12 and name HB*) (resid 12 and name HA) 5.0 3.2 1.0 ! 89  88  84  83  
assign (resid 13 and name HA) (resid 14 and name HD#) 5.0 3.2 2.0 ! 95  
assign (resid 13 and name HA) (resid 14 and name HE#) 5.0 3.2 2.0 ! 96  
assign (resid 13 and name HA) (resid 14 and name HB*) 5.0 3.2 1.0 ! 99  98  
assign (resid 13 and name HA) (resid 13 and name HG#) 3.3 1.5 1.5 ! 100  
assign (resid 13 and name HA) (resid 13 and name HB*) 3.3 1.5 1.0 ! 102  101  94  93  
assign (resid 14 and name HE#) (resid 52 and name HA) 5.0 3.2 2.0 ! 106  
assign (resid 14 and name HE#) (resid 11 and name HB*) 5.0 3.2 3.0 ! 111  64  61  
assign (resid 14 and name HD#) (resid 14 and name HE#) 2.7 0.9 4.0 ! 113  103  
assign (resid 14 and name HD#) (resid 51 and name HB*) 5.0 3.2 2.0 ! 119  
assign (resid 14 and name HD#) (resid 50 and name HB*) 5.0 3.2 3.0 ! 124  120  
assign (resid 14 and name HB*) (resid 14 and name HD#) 5.0 3.2 3.0 ! 129  127  123  122  
assign (resid 14 and name HB*) (resid 14 and name HE#) 3.3 1.5 3.0 ! 130  128  109  108  
assign (resid 15 and name HB*) (resid 15 and name HA) 2.7 0.9 1.0 ! 141  134  
assign (resid 16 and name HA) (resid 16 and name HD#) 5.0 3.2 2.0 ! 142  
assign (resid 16 and name HB*) (resid 16 and name HA) 2.7 0.9 1.0 ! 152  151  148  147  
assign (resid 16 and name HB*) (resid 16 and name HD#) 5.0 3.2 3.0 ! 154  153  
assign (resid 18 and name HD#) (resid 18 and name HG#) 5.0 3.2 3.0 ! 172  170  166  164  159  158  
assign (resid 18 and name HA) (resid 21 and name HZ2) 5.0 3.2 2.0 ! 181  
assign (resid 18 and name HA) (resid 21 and name HD#) 5.0 3.2 2.0 ! 182  
assign (resid 18 and name HA) (resid 18 and name HD#) 5.0 3.2 1.5 ! 188  187  169  
assign (resid 18 and name HA) (resid 18 and name HG#) 5.0 3.2 1.5 ! 192  190  161  
assign (resid 18 and name HB*) (resid 18 and name HD#) 5.0 3.2 2.5 ! 205  200  199  174  173  168  167  
assign (resid 18 and name HB*) (resid 18 and name HA) 2.7 0.9 1.0 ! 207  202  194  193  
assign (resid 18 and name HB*) (resid 18 and name HG2#) 5.0 3.2 2.5 ! 208  
assign (resid 19 and name HD##) (resid 19 and name HB*) 3.3 1.5 2.5 ! 225  
assign (resid 19 and name HA) (resid 19 and name HG#) 5.0 3.2 1.5 ! 237  
assign (resid 19 and name HA) (resid 19 and name HB*) 5.0 3.2 1.0 ! 238  229  
assign (resid 19 and name HA) (resid 19 and name HD##) 5.0 3.2 1.5 ! 239  218  
assign (resid 20 and name HD#) (resid 23 and name HZ3) 5.0 3.2 3.5 ! 267  
assign (resid 20 and name HD#) (resid 23 and name HE3) 5.0 3.2 3.5 ! 269  268  
assign (resid 20 and name HD#) (resid 23 and name HD#) 5.0 3.2 3.5 ! 271  
assign (resid 20 and name HD#) (resid 20 and name HG#) 5.0 3.2 3.0 ! 282  279  273  262  261  258  
assign (resid 20 and name HA) (resid 20 and name HD#) 3.3 1.5 1.5 ! 291  289  277  272  
assign (resid 20 and name HA) (resid 20 and name HG#) 3.3 1.5 1.5 ! 293  287  260  257  
assign (resid 20 and name HB*) (resid 20 and name HD#) 5.0 3.2 2.5 ! 300  299  278  275  274  247  
assign (resid 20 and name HB*) (resid 20 and name HA) 5.0 3.2 1.0 ! 303  301  294  292  252  251  
assign (resid 20 and name HB*) (resid 20 and name HG#) 5.0 3.2 2.5 ! 307  306  304  297  265  263  250  248  
assign (resid 21 and name HZ2) (resid 21 and name HD#) 3.3 1.5 4.0 ! 316  
assign (resid 21 and name HZ2) (resid 18 and name HG#) 5.0 3.2 3.5 ! 320  155  
assign (resid 21 and name HA) (resid 21 and name HD#) 5.0 3.2 2.0 ! 326  311  
assign (resid 21 and name HB*) (resid 21 and name HA) 5.0 3.2 1.0 ! 339  338  337  333  332  
assign (resid 22 and name HA) (resid 21 and name HD#) 5.0 3.2 2.0 ! 349  312  
assign (resid 22 and name HA) (resid 22 and name HB*) 2.7 0.9 0.0 ! 354  347  
assign (resid 22 and name HG2#) (resid 21 and name HB*) 5.0 3.2 2.5 ! 357  356  
assign (resid 22 and name HG2#) (resid 22 and name HA) 2.7 0.9 1.5 ! 358  355  
assign (resid 22 and name HG2#) (resid 22 and name HB*) 2.7 0.9 1.5 ! 359  348  
assign (resid 22 and name HG2#) (resid 21 and name HD#) 3.3 1.5 3.5 ! 360  315  
assign (resid 23 and name HA) (resid 23 and name HE3) 5.0 3.2 2.0 ! 362  
assign (resid 23 and name HA) (resid 23 and name HD#) 3.3 1.5 2.0 ! 363  
assign (resid 23 and name HA) (resid 22 and name HA) 5.0 3.2 0.0 ! 373  350  
assign (resid 23 and name HB*) (resid 23 and name HA) 3.3 1.5 1.0 ! 394  392  375  374  
assign (resid 23 and name HB*) (resid 23 and name HE3) 5.0 3.2 3.0 ! 396  395  
assign (resid 23 and name HB*) (resid 23 and name HD#) 5.0 3.2 3.0 ! 398  397  
assign (resid 24 and name HB*) (resid 24 and name HG2#) 5.0 3.2 1.5 ! 400  
assign (resid 24 and name HB*) (resid 21 and name HH2) 5.0 3.2 2.0 ! 402  
assign (resid 24 and name HB*) (resid 21 and name HZ2) 5.0 3.2 2.0 ! 403  
assign (resid 24 and name HB*) (resid 21 and name HE3) 5.0 3.2 2.0 ! 404  
assign (resid 24 and name HB*) (resid 43 and name HA) 5.0 3.2 0.0 ! 405  
assign (resid 24 and name HB*) (resid 21 and name HA) 5.0 3.2 0.0 ! 406  330  
assign (resid 24 and name HG2#) (resid 24 and name HG1#) 2.7 0.9 3.0 ! 417  
assign (resid 24 and name HG1#) (resid 21 and name HA) 3.3 1.5 1.5 ! 426  336  
assign (resid 24 and name HG1#) (resid 21 and name HZ3) 5.0 3.2 3.5 ! 430  
assign (resid 24 and name HG1#) (resid 24 and name HB*) 5.0 3.2 1.5 ! 439  399  
assign (resid 24 and name HA) (resid 43 and name HB*) 5.0 3.2 0.0 ! 444  
assign (resid 24 and name HA) (resid 24 and name HG2#) 2.7 0.9 1.5 ! 445  421  
assign (resid 24 and name HA) (resid 24 and name HG1#) 3.3 1.5 1.5 ! 446  438  
assign (resid 24 and name HA) (resid 24 and name HB*) 5.0 3.2 0.0 ! 449  407  
assign (resid 25 and name HD#) (resid 25 and name HG#) 5.0 3.2 3.0 ! 452  
assign (resid 25 and name HD#) (resid 43 and name HA) 5.0 3.2 1.5 ! 455  
assign (resid 25 and name HD#) (resid 44 and name HA) 5.0 3.2 1.5 ! 457  
assign (resid 25 and name HA) (resid 24 and name HA) 5.0 3.2  0.0 ! 460  
assign (resid 25 and name HA) (resid 25 and name HD#) 3.3 1.5 1.5 ! 463  458  
assign (resid 25 and name HA) (resid 44 and name HG#) 3.3 1.5 1.5 ! 466  
assign (resid 25 and name HB*) (resid 25 and name HA) 2.7 0.9 1.0 ! 470  465  464  
assign (resid 25 and name HB*) (resid 44 and name HG#) 5.0 3.2 2.5 ! 473  
assign (resid 25 and name HB*) (resid 25 and name HD#) 5.0 3.2 2.5 ! 475  469  453  451  
assign (resid 26 and name HB*) (resid 26 and name HA) 2.7 0.9 1.0 ! 492  491  478  477  
assign (resid 27 and name HA) (resid 26 and name HB*) 5.0 3.2 1.0 ! 525  
assign (resid 27 and name HA) (resid 41 and name HD*) 3.3 1.5 2.0 ! 526  
assign (resid 27 and name HA) (resid 41 and name HE#) 5.0 3.2 2.0 ! 527  
assign (resid 27 and name HB*) (resid 27 and name HA) 2.7 0.9 1.0 ! 538  536  521  520  
assign (resid 28 and name HA) (resid 39 and name HG1#) 5.0 3.2 1.5 ! 553  
assign (resid 28 and name HA) (resid 29 and name HB*) 5.0 3.2 1.0 ! 555  554  
assign (resid 28 and name HA) (resid 27 and name HB*) 5.0 3.2 1.0 ! 556  
assign (resid 28 and name HA) (resid 29 and name HD#) 5.0 3.2 2.0 ! 557  
assign (resid 28 and name HA) (resid 27 and name HA) 5.0 3.2 0.0 ! 558  524  
assign (resid 28 and name HA) (resid 29 and name HA) 5.0 3.2 0.0 ! 559  
assign (resid 28 and name HA) (resid 27 and name HE#) 3.3 1.5 2.0 ! 560  496  
assign (resid 28 and name HG#) (resid 28 and name HA) 5.0 3.2 1.5 ! 562  561  
assign (resid 28 and name HB*) (resid 28 and name HA) 5.0 3.2 1.0 ! 570  569  
assign (resid 29 and name HA) (resid 27 and name HE#) 5.0 3.2 2.0 ! 572  
assign (resid 29 and name HB*) (resid 29 and name HA) 3.3 1.5 1.0 ! 587  586  576  575  
assign (resid 30 and name HG2#) (resid 29 and name HB*) 5.0 3.2 2.5 ! 595  
assign (resid 30 and name HG2#) (resid 10 and name HB1) 5.0 3.2 1.5     ! 596 37
assign (resid 30 and name HG2#) (resid 10 and name HB2) 5.0 3.2 1.5     ! 593 36
assign (resid 30 and name HG2#) (resid 11 and name HB*) 5.0 3.2 2.5 ! 598  597  74  73  
assign (resid 30 and name HG2#) (resid 40 and name HG1#) 3.3 1.5 3.0 ! 600  
assign (resid 30 and name HG2#) (resid 29 and name HA) 5.0 3.2 1.5 ! 602  
assign (resid 30 and name HG2#) (resid 11 and name HA) 3.3 1.5 1.5 ! 603  
assign (resid 30 and name HB*) (resid 10 and name HB*) 5.0 3.2 1.0 ! 615  
assign (resid 30 and name HB*) (resid 30 and name HG2#) 2.7 0.9 1.5 ! 618  604  
assign (resid 30 and name HA) (resid 30 and name HG2#) 2.7 0.9 1.5 ! 620  605  
assign (resid 30 and name HA) (resid 30 and name HB*) 2.7 0.9 0.0 ! 623  612  
assign (resid 31 and name HB*) (resid 31 and name HA) 2.7 0.9 1.0 ! 631  630  
assign (resid 32 and name HA) (resid 32 and name HB*) 2.7 0.9 1.0 ! 635  632  
assign (resid 33 and name HA) (resid 32 and name HB*) 5.0 3.2 1.0 ! 636  
assign (resid 33 and name HB*) (resid 33 and name HA) 2.7 0.9 1.0 ! 639  638  637  
assign (resid 34 and name HB*) (resid 30 and name HB*) 5.0 3.2 1.0 ! 644  643  617  616  
assign (resid 34 and name HB*) (resid 10 and name HB1) 5.0 3.2 1.0 ! 41 647 641 649
assign (resid 34 and name HB*) (resid 10 and name HB2) 5.0 3.2 1.0 ! 40
assign (resid 34 and name HB*) (resid 30 and name HG2#) 5.0 3.2 2.5 ! 650  
assign (resid 35 and name HA) (resid 35 and name HB*) 2.7 0.9 1.0 ! 653  
assign (resid 36 and name HA) (resid 36 and name HB*) 3.3 1.5 1.0 ! 664  663  657  656  
assign (resid 37 and name HB*) (resid 37 and name HD#) 5.0 3.2 2.5 ! 669  668  
assign (resid 37 and name HB*) (resid 37 and name HA) 5.0 3.2 1.0 ! 671  670  
assign (resid 37 and name HD#) (resid 37 and name HA) 5.0 3.2 1.5 ! 672  
assign (resid 38 and name HB*) (resid 14 and name HD#) 3.3 1.5 3.0 ! 674  121  115  
assign (resid 38 and name HB*) (resid 14 and name HE#) 3.3 1.5 3.0 ! 675  112  
assign (resid 38 and name HB*) (resid 52 and name HA) 5.0 3.2 1.0 ! 676  
assign (resid 38 and name HB*) (resid 11 and name HA) 5.0 3.2 1.0 ! 677  
assign (resid 38 and name HB*) (resid 11 and name HB*) 5.0 3.2 2.0 ! 683  681  72  71  
assign (resid 38 and name HA) (resid 39 and name HB*) 5.0 3.2 1.0 ! 687  
assign (resid 38 and name HA) (resid 38 and name HB*) 2.7 0.9 1.0 ! 691  685  
assign (resid 38 and name HA) (resid 14 and name HD#) 5.0 3.2 2.0 ! 695  
assign (resid 38 and name HA) (resid 14 and name HE#) 5.0 3.2 2.0 ! 696  105  
assign (resid 39 and name HB*) (resid 41 and name HE#) 5.0 3.2 3.0 ! 698  
assign (resid 39 and name HA) (resid 39 and name HB*) 3.3 1.5 1.0 ! 704  
assign (resid 39 and name HA) (resid 29 and name HB*) 5.0 3.2 1.0 ! 707  706  589  588  
assign (resid 39 and name HA) (resid 29 and name HA) 2.7 0.9 0.0 ! 710  574  
assign (resid 39 and name HA) (resid 29 and name HD#) 3.3 1.5 2.0 ! 711  
assign (resid 39 and name HA) (resid 27 and name HD#) 5.0 3.2 2.0 ! 712  
assign (resid 39 and name HG2#) (resid 39 and name HA) 2.7 0.9 1.5 ! 714  708  
assign (resid 39 and name HG2#) (resid 29 and name HA) 5.0 3.2 1.5 ! 715  581  
assign (resid 39 and name HG2#) (resid 38 and name HA) 5.0 3.2 1.5 ! 718  692  
assign (resid 39 and name HG2#) (resid 27 and name HE#) 5.0 3.2 3.5 ! 720  500  
assign (resid 39 and name HG2#) (resid 39 and name HB*) 5.0 3.2 2.5 ! 724  700  
assign (resid 39 and name HG1#) (resid 27 and name HE#) 3.3 1.5 3.5 ! 730  512  501  
assign (resid 39 and name HG1#) (resid 39 and name HA) 3.3 1.5 1.5 ! 731  709  
assign (resid 39 and name HG1#) (resid 27 and name HA) 5.0 3.2 1.5 ! 732  519  
assign (resid 39 and name HG1#) (resid 29 and name HA) 5.0 3.2 1.5 ! 734  582  
assign (resid 39 and name HG1#) (resid 27 and name HB*) 5.0 3.2 2.5 ! 737  736  550  549  
assign (resid 39 and name HG1#) (resid 39 and name HB*) 5.0 3.2 2.5 ! 738  701  
assign (resid 39 and name HG1#) (resid 40 and name HG1#) 5.0 3.2 3.0 ! 739  
assign (resid 39 and name HG1#) (resid 62 and name HD#) 3.3 1.5 3.0 ! 741  
assign (resid 39 and name HG1#) (resid 39 and name HG2#) 2.7 0.9 3.0 ! 742  725  
assign (resid 40 and name HB*) (resid 28 and name HG#) 5.0 3.2 1.5 ! 747  746  566  565  
assign (resid 40 and name HG1#) (resid 40 and name HB*) 5.0 3.2 1.5 ! 750  748  744  
assign (resid 40 and name HA) (resid 50 and name HB*) 5.0 3.2 1.0 ! 757  755  
assign (resid 40 and name HA) (resid 40 and name HB*) 3.3 1.5 0.0 ! 758  745  
assign (resid 40 and name HA) (resid 40 and name HG1#) 3.3 1.5 1.5 ! 761  759  754  753  
assign (resid 40 and name HA) (resid 39 and name HG1#) 5.0 3.2 1.5 ! 763  735  
assign (resid 40 and name HD#) (resid 28 and name HG#) 3.3 1.5 3.0 ! 765  764  
assign (resid 40 and name HD#) (resid 40 and name HB*) 5.0 3.2 1.5 ! 766  749  
assign (resid 40 and name HD#) (resid 30 and name HA) 3.3 1.5 1.5 ! 770  621  
assign (resid 41 and name HA) (resid 41 and name HE#) 5.0 3.2 2.0 ! 773  
assign (resid 41 and name HA) (resid 27 and name HE#) 5.0 3.2 2.0 ! 774  
assign (resid 41 and name HA) (resid 40 and name HG2#) 5.0 3.2 1.5 ! 782  
assign (resid 41 and name HA) (resid 39 and name HG1#) 5.0 3.2 1.5 ! 783  733  
assign (resid 41 and name HA) (resid 27 and name HA) 2.7 0.9 0.0 ! 784  529  
assign (resid 41 and name HB*) (resid 41 and name HA) 3.3 1.5 1.0 ! 789  786  777  776  
assign (resid 42 and name HB*) (resid 48 and name HD#) 3.3 1.5 1.5 ! 797  
assign (resid 42 and name HB*) (resid 48 and name HB*) 5.0 3.2 1.0 ! 798  
assign (resid 42 and name HG2#) (resid 42 and name HB*) 2.7 0.9 1.5 ! 802  800  
assign (resid 42 and name HG2#) (resid 25 and name HD#) 5.0 3.2 3.0 ! 804  454  
assign (resid 42 and name HA) (resid 48 and name HD#) 3.3 1.5 1.5 ! 810  
assign (resid 42 and name HA) (resid 42 and name HG2#) 2.7 0.9 1.5 ! 814  806  
assign (resid 42 and name HA) (resid 42 and name HB*) 3.3 1.5 0.0 ! 815  796  
assign (resid 43 and name HB*) (resid 23 and name HD#) 5.0 3.2 2.0 ! 816  
assign (resid 43 and name HB*) (resid 23 and name HE3) 5.0 3.2 2.0 ! 817  
assign (resid 43 and name HB*) (resid 23 and name HB*) 5.0 3.2 1.0 ! 819  818  393  391  
assign (resid 43 and name HB*) (resid 43 and name HG2#) 2.7 0.9 1.5 ! 822  
assign (resid 43 and name HA) (resid 23 and name HE3) 5.0 3.2 2.0 ! 827  
assign (resid 43 and name HA) (resid 24 and name HA) 2.7 0.9 0.0 ! 832  443  
assign (resid 43 and name HA) (resid 43 and name HB*) 2.7 0.9 0.0 ! 833  826  
assign (resid 43 and name HG2#) (resid 23 and name HB*) 5.0 3.2 2.5 ! 837  836  384  383  
assign (resid 43 and name HG2#) (resid 23 and name HZ3) 5.0 3.2 3.5 ! 840  
assign (resid 43 and name HG2#) (resid 23 and name HE3) 5.0 3.2 3.5 ! 841  
assign (resid 44 and name HB*) (resid 23 and name HA) 5.0 3.2 1.0 ! 843  842  367  
assign (resid 44 and name HB*) (resid 44 and name HG#) 5.0 3.2 2.5 ! 845  844  
assign (resid 44 and name HE#) (resid 44 and name HB*) 5.0 3.2 2.5 ! 851  850  
assign (resid 44 and name HE#) (resid 23 and name HA) 5.0 3.2 1.5 ! 853  852  366  365  
assign (resid 44 and name HE#) (resid 25 and name HA) 3.3 1.5 1.5 ! 855  854  462  461  
assign (resid 44 and name HE#) (resid 44 and name HD#) 5.0 3.2 3.0 ! 857  856  
assign (resid 44 and name HE#) (resid 44 and name HG#) 5.0 3.2 3.0 ! 859  858  
assign (resid 44 and name HA) (resid 46 and name HA*) 5.0 3.2 1.0 ! 860  
assign (resid 44 and name HA) (resid 25 and name HA) 5.0 3.2 0.0 ! 862  459  
assign (resid 44 and name HA) (resid 43 and name HA) 5.0 3.2 0.0 ! 863  831  
assign (resid 44 and name HA) (resid 43 and name HB*) 5.0 3.2 0.0 ! 864  
assign (resid 44 and name HA) (resid 23 and name HA) 5.0 3.2 0.0 ! 865  364  
assign (resid 44 and name HA) (resid 44 and name HB*) 5.0 3.2 1.0 ! 867  847  846  
assign (resid 44 and name HA) (resid 44 and name HD#) 3.3 1.5 1.5 ! 868  
assign (resid 44 and name HA) (resid 25 and name HB*) 3.3 1.5 1.0 ! 869  474  
assign (resid 44 and name HA) (resid 44 and name HG#) 2.7 0.9 1.5 ! 870  
assign (resid 45 and name HB*) (resid 45 and name HA) 5.0 3.2 1.0 ! 876  875  
assign (resid 45 and name HD#) (resid 45 and name HB*) 5.0 3.2 2.5 ! 879  878  874  873  
assign (resid 46 and name HA*) (resid 42 and name HG2#) 5.0 3.2 2.5 ! 883  803  
assign (resid 47 and name HG#) (resid 47 and name HE#) 5.0 3.2 3.0 ! 885  
assign (resid 47 and name HG#) (resid 47 and name HD#) 2.7 0.9 3.0 ! 888  
assign (resid 47 and name HA) (resid 47 and name HD#) 3.3 1.5 1.5 ! 894  
assign (resid 47 and name HA) (resid 47 and name HG#) 2.7 0.9 1.5 ! 897  895  887  886  
assign (resid 47 and name HA) (resid 47 and name HB*) 2.7 0.9 1.0 ! 898  890  889  
assign (resid 48 and name HB*) (resid 48 and name HE#) 5.0 3.2 2.5 ! 900  899  
assign (resid 48 and name HB*) (resid 42 and name HA) 3.3 1.5 1.0 ! 906  905  811  809  
assign (resid 48 and name HA) (resid 47 and name HA) 5.0 3.2 0.0 ! 910  893  
assign (resid 48 and name HA) (resid 42 and name HB*) 5.0 3.2 0.0 ! 911  795  
assign (resid 48 and name HA) (resid 48 and name HB*) 2.7 0.9 1.0 ! 915  914  908  907  
assign (resid 48 and name HA) (resid 42 and name HG2#) 5.0 3.2 1.5 ! 916  807  
assign (resid 48 and name HA) (resid 42 and name HA) 2.7 0.9 0.0 ! 919  808  
assign (resid 49 and name HG2#) (resid 42 and name HA) 5.0 3.2 1.5 ! 933  
assign (resid 49 and name HG2#) (resid 48 and name HA) 5.0 3.2 1.5 ! 934  917  
assign (resid 49 and name HG2#) (resid 15 and name HB*) 5.0 3.2 2.5 ! 936  139  
assign (resid 49 and name HG2#) (resid 41 and name HB*) 5.0 3.2 2.5 ! 938  937  
assign (resid 49 and name HG1#) (resid 15 and name HA) 5.0 3.2 1.5 ! 946  133  
assign (resid 49 and name HG1#) (resid 15 and name HB*) 2.7 0.9 2.5 ! 949  140  
assign (resid 49 and name HA) (resid 48 and name HA) 5.0 3.2 0.0 ! 952  
assign (resid 49 and name HA) (resid 49 and name HG1#) 2.7 0.9 1.5 ! 954  947  
assign (resid 49 and name HA) (resid 49 and name HG2#) 2.7 0.9 1.5 ! 955  939  
assign (resid 49 and name HB*) (resid 48 and name HA) 5.0 3.2 0.0 ! 957  913  
assign (resid 49 and name HB*) (resid 49 and name HA) 3.3 1.5 0.0 ! 960  953  
assign (resid 49 and name HB*) (resid 15 and name HB*) 5.0 3.2 1.0 ! 961  135  
assign (resid 49 and name HB*) (resid 49 and name HG1#) 5.0 3.2 1.5 ! 966  951  
assign (resid 49 and name HB*) (resid 49 and name HG2#) 5.0 3.2 1.5 ! 967  940  
assign (resid 50 and name HA) (resid 40 and name HB*) 3.3 1.5 1.0 ! 970  
assign (resid 50 and name HA) (resid 40 and name HG1#) 3.3 1.5 1.5 ! 972  971  
assign (resid 50 and name HA) (resid 40 and name HD#) 3.3 1.5 1.5 ! 973  
assign (resid 50 and name HB*) (resid 14 and name HB*) 5.0 3.2 2.0 ! 984  982  
assign (resid 50 and name HB*) (resid 14 and name HE#) 5.0 3.2 3.0 ! 985  983  110  
assign (resid 50 and name HB*) (resid 50 and name HA) 5.0 3.2 1.0 ! 991  989  975  974  
assign (resid 50 and name HB*) (resid 11 and name HB*) 5.0 3.2 2.0 ! 995  993  987  986  68  67  60  59  
assign (resid 50 and name HB*) (resid 38 and name HB*) 3.3 1.5 2.0 ! 998  997  682  679  
assign (resid 51 and name HB*) (resid 57 and name HZ2) 5.0 3.2 2.0 ! 999  
assign (resid 51 and name HG2#) (resid 49 and name HB*) 5.0 3.2 1.5 ! 1015  964  
assign (resid 51 and name HG2#) (resid 49 and name HG1#) 2.7 0.9 3.0 ! 1018  941  
assign (resid 51 and name HG2#) (resid 51 and name HB*) 2.7 0.9 1.5 ! 1025  1004  
assign (resid 51 and name HA) (resid 14 and name HD#) 3.3 1.5 2.0 ! 1031  114  
assign (resid 51 and name HA) (resid 14 and name HE#) 5.0 3.2 2.0 ! 1032  104  
assign (resid 51 and name HA) (resid 49 and name HG1#) 5.0 3.2 1.5 ! 1033  944  
assign (resid 51 and name HA) (resid 50 and name HB*) 5.0 3.2 1.0 ! 1034  980  
assign (resid 51 and name HA) (resid 14 and name HB*) 3.3 1.5 1.0 ! 1037  1036  132  131  
assign (resid 51 and name HA) (resid 51 and name HG2#) 3.3 1.5 1.5 ! 1038  1024  
assign (resid 51 and name HA) (resid 51 and name HB*) 2.7 0.9 0.0 ! 1041  1003  
assign (resid 52 and name HD#) (resid 52 and name HE#) 5.0 3.2 4.0 ! 1042  
assign (resid 52 and name HB*) (resid 52 and name HD#) 5.0 3.2 3.0 ! 1047  1046  1044  1043  
assign (resid 53 and name HG#) (resid 55 and name HE#) 5.0 3.2 3.0 ! 1062  1061  
assign (resid 53 and name HG#) (resid 38 and name HA) 5.0 3.2 1.5 ! 1064  1063  686  
assign (resid 53 and name HG#) (resid 52 and name HA) 5.0 3.2 1.5 ! 1066  1065  
assign (resid 53 and name HG#) (resid 53 and name HA) 5.0 3.2 1.5 ! 1068  1067  
assign (resid 53 and name HG#) (resid 39 and name HG2#) 3.3 1.5 3.0 ! 1076  1075  722  
assign (resid 53 and name HB*) (resid 38 and name HA) 5.0 3.2 1.0 ! 1079  689  
assign (resid 53 and name HB*) (resid 52 and name HA) 5.0 3.2 1.0 ! 1080  
assign (resid 53 and name HB*) (resid 29 and name HD#) 5.0 3.2 3.0 ! 1086  1085  
assign (resid 53 and name HA) (resid 29 and name HD#) 5.0 3.2 2.0 ! 1094  
assign (resid 53 and name HA) (resid 52 and name HB*) 5.0 3.2 1.0 ! 1098  
assign (resid 53 and name HA) (resid 53 and name HB*) 5.0 3.2 1.0 ! 1100  1099  1088  1087  
assign (resid 53 and name HA) (resid 55 and name HB*) 5.0 3.2 1.0 ! 1102  
assign (resid 53 and name HA) (resid 39 and name HG2#) 3.3 1.5 1.5 ! 1104  
assign (resid 53 and name HA) (resid 39 and name HG1#) 5.0 3.2 1.5 ! 1105  
assign (resid 53 and name HA) (resid 58 and name HG2#) 5.0 3.2 1.5 ! 1106  
assign (resid 53 and name HD#) (resid 52 and name HD#) 5.0 3.2 3.5 ! 1108  
assign (resid 53 and name HD#) (resid 38 and name HA) 5.0 3.2 1.5 ! 1114  1113  694  690  
assign (resid 53 and name HD#) (resid 53 and name HG#) 5.0 3.2 3.0 ! 1118  1116  1072  1071  1070  1069  
assign (resid 53 and name HD#) (resid 38 and name HB*) 3.3 1.5 2.5 ! 1119  680  678  
assign (resid 53 and name HD#) (resid 53 and name HB*) 5.0 3.2 2.5 ! 1120  1117  1091  1090  1089  
assign (resid 53 and name HD#) (resid 53 and name HA) 5.0 3.2 1.5 ! 1123  1097  
assign (resid 53 and name HD#) (resid 52 and name HB*) 5.0 3.2 2.5 ! 1127  1126  1122  1121  1050  1049  
assign (resid 53 and name HD#) (resid 39 and name HG2#) 5.0 3.2 3.0 ! 1129  1128  717  716  
assign (resid 54 and name HB*) (resid 54 and name HG#) 5.0 3.2 2.5 ! 1134  
assign (resid 54 and name HD#) (resid 54 and name HB*) 5.0 3.2 2.5 ! 1141  1140  1136  
assign (resid 54 and name HD#) (resid 54 and name HG#) 5.0 3.2 3.0 ! 1142  
assign (resid 54 and name HA) (resid 54 and name HD#) 5.0 3.2 1.5 ! 1143  1139  
assign (resid 54 and name HA) (resid 53 and name HB*) 5.0 3.2 1.0 ! 1144  
assign (resid 54 and name HA) (resid 54 and name HB*) 2.7 0.9 1.0 ! 1148  1147  1132  1131  
assign (resid 54 and name HA) (resid 54 and name HG#) 2.7 0.9 1.5 ! 1149  
assign (resid 55 and name HB*) (resid 55 and name HE#) 5.0 3.2 2.5 ! 1151  1150  
assign (resid 55 and name HB*) (resid 57 and name HD#) 5.0 3.2 2.5 ! 1153  
assign (resid 55 and name HD#) (resid 57 and name HZ2) 5.0 3.2 3.5 ! 1156  
assign (resid 55 and name HD#) (resid 57 and name HD#) 5.0 3.2 3.5 ! 1157  
assign (resid 55 and name HD#) (resid 52 and name HB*) 5.0 3.2 2.5 ! 1158  1054  
assign (resid 55 and name HD#) (resid 55 and name HE#) 5.0 3.2 3.0 ! 1161  1160  
assign (resid 55 and name HD#) (resid 55 and name HG#) 5.0 3.2 3.0 ! 1162  
assign (resid 55 and name HD#) (resid 55 and name HB*) 5.0 3.2 2.5 ! 1163  
assign (resid 55 and name HD#) (resid 58 and name HG2#) 5.0 3.2 3.0 ! 1164  
assign (resid 55 and name HA) (resid 55 and name HE#) 5.0 3.2 1.5 ! 1166  1165  
assign (resid 55 and name HA) (resid 55 and name HG#) 3.3 1.5 1.5 ! 1169  
assign (resid 55 and name HA) (resid 55 and name HB*) 3.3 1.5 1.0 ! 1171  1170  1155  1154  
assign (resid 55 and name HA) (resid 55 and name HD#) 2.7 0.9 1.5 ! 1173  1159  
assign (resid 56 and name HA) (resid 56 and name HE#) 5.0 3.2 1.5 ! 1175  
assign (resid 56 and name HA) (resid 56 and name HD#) 5.0 3.2 1.5 ! 1176  
assign (resid 56 and name HA) (resid 56 and name HB*) 2.7 0.9 1.0 ! 1178  
assign (resid 56 and name HA) (resid 59 and name HG#) 5.0 3.2 1.5 ! 1180  1179  
assign (resid 56 and name HA) (resid 56 and name HG#) 3.3 1.5 1.5 ! 1181  1177  
assign (resid 57 and name HZ3) (resid 19 and name HD##) 5.0 3.2 3.5 ! 1182  215  
assign (resid 57 and name HZ3) (resid 19 and name HB*) 5.0 3.2 3.0 ! 1183  242  
assign (resid 57 and name HZ3) (resid 57 and name HB*) 5.0 3.2 3.0 ! 1184  
assign (resid 57 and name HE3) (resid 57 and name HZ2) 5.0 3.2 4.0 ! 1190  
assign (resid 57 and name HE3) (resid 57 and name HH2) 5.0 3.2 4.0 ! 1193  
assign (resid 57 and name HZ3) (resid 57 and name HE3) 3.3 1.5 4.0 ! 1198  1197  
assign (resid 57 and name HD#) (resid 55 and name HA) 5.0 3.2 2.0 ! 1199  1168  
assign (resid 57 and name HD#) (resid 55 and name HB*) 5.0 3.2 3.0 ! 1201  1152  
assign (resid 57 and name HZ2) (resid 57 and name HZ3) 5.0 3.2 4.0 ! 1207  1191  
assign (resid 57 and name HZ2) (resid 58 and name HG2#) 5.0 3.2 3.5 ! 1208  
assign (resid 57 and name HA) (resid 57 and name HZ3) 5.0 3.2 2.0 ! 1209  
assign (resid 57 and name HA) (resid 57 and name HD#) 5.0 3.2 2.0 ! 1210  
assign (resid 57 and name HA) (resid 60 and name HD#) 5.0 3.2 1.5 ! 1215  
assign (resid 57 and name HA) (resid 60 and name HE#) 5.0 3.2 1.5 ! 1216  
assign (resid 57 and name HA) (resid 61 and name HE#) 5.0 3.2 2.0 ! 1217  
assign (resid 57 and name HA) (resid 57 and name HE3) 5.0 3.2 2.0 ! 1218  
assign (resid 57 and name HZ2) (resid 51 and name HB*) 5.0 3.2 2.0 ! 1220  
assign (resid 57 and name HB*) (resid 57 and name HD#) 5.0 3.2 3.0 ! 1226  1203  
assign (resid 57 and name HB*) (resid 57 and name HA) 2.7 0.9 1.0 ! 1229  1219  
assign (resid 58 and name HA) (resid 51 and name HG1#) 5.0 3.2 1.5 ! 1231  
assign (resid 58 and name HA) (resid 39 and name HG1#) 5.0 3.2 1.5 ! 1233  
assign (resid 58 and name HA) (resid 41 and name HE#) 3.3 1.5 2.0 ! 1240  
assign (resid 58 and name HA) (resid 41 and name HD#) 3.3 1.5 2.0 ! 1241  
assign (resid 58 and name HA) (resid 61 and name HD#) 5.0 3.2 2.0 ! 1242  
assign (resid 58 and name HA) (resid 57 and name HZ3) 5.0 3.2 2.0 ! 1243  1185  
assign (resid 58 and name HA) (resid 57 and name HE3) 3.3 1.5 2.0 ! 1244  
assign (resid 58 and name HB*) (resid 53 and name HA) 3.3 1.5 0.0 ! 1245  1101  
assign (resid 58 and name HB*) (resid 58 and name HA) 3.3 1.5 0.0 ! 1246  1230  
assign (resid 58 and name HG1#) (resid 53 and name HA) 2.7 0.9 1.5 ! 1249  1103  
assign (resid 58 and name HG1#) (resid 58 and name HA) 3.3 1.5 1.5 ! 1251  1232  
assign (resid 58 and name HG1#) (resid 41 and name HD#) 3.3 1.5 3.5 ! 1252  
assign (resid 58 and name HG1#) (resid 41 and name HE#) 3.3 1.5 3.5 ! 1253  
assign (resid 58 and name HG1#) (resid 53 and name HB*) 3.3 1.5 2.5 ! 1254  1084  1083  
assign (resid 58 and name HG1#) (resid 58 and name HB*) 5.0 3.2 1.5 ! 1255  1247  
assign (resid 58 and name HG1#) (resid 39 and name HB*) 2.7 0.9 2.5 ! 1256  699  
assign (resid 58 and name HG1#) (resid 39 and name HG2#) 3.3 1.5 3.0 ! 1257  
assign (resid 58 and name HG1#) (resid 39 and name HG1#) 3.3 1.5 3.0 ! 1258  740  
assign (resid 58 and name HG2#) (resid 58 and name HG1#) 2.7 0.9 3.0 ! 1262  1259  
assign (resid 58 and name HG2#) (resid 58 and name HA) 5.0 3.2 1.5 ! 1265  1234  
assign (resid 58 and name HG2#) (resid 51 and name HA) 5.0 3.2 1.5 ! 1267  1039  
assign (resid 58 and name HG2#) (resid 55 and name HA) 5.0 3.2 1.5 ! 1268  1172  
assign (resid 58 and name HG2#) (resid 51 and name HB*) 2.7 0.9 1.5 ! 1269  1010  
assign (resid 59 and name HG#) (resid 54 and name HA) 5.0 3.2 1.5 ! 1280  1146  1145  
assign (resid 59 and name HG#) (resid 55 and name HA) 5.0 3.2 1.5 ! 1281  1167  
assign (resid 59 and name HB*) (resid 56 and name HA) 5.0 3.2 1.0 ! 1286  
assign (resid 59 and name HB*) (resid 59 and name HG#) 5.0 3.2 2.5 ! 1290  1289  1288  1287  
assign (resid 59 and name HA) (resid 59 and name HG#) 3.3 1.5 1.5 ! 1294  1293  1283  1282  
assign (resid 59 and name HA) (resid 59 and name HB*) 2.7 0.9 1.0 ! 1296  1295  1285  1284  
assign (resid 59 and name HA) (resid 58 and name HG1#) 3.3 1.5 1.5 ! 1298  1250  
assign (resid 60 and name HB*) (resid 61 and name HD#) 5.0 3.2 3.0 ! 1303  1302  
assign (resid 60 and name HB*) (resid 57 and name HB*) 5.0 3.2 2.0 ! 1305  1304  1224  1223  
assign (resid 60 and name HB*) (resid 57 and name HA) 5.0 3.2 1.0 ! 1307  1306  1214  1213  
assign (resid 60 and name HA) (resid 60 and name HE#) 5.0 3.2 1.5 ! 1308  
assign (resid 60 and name HA) (resid 60 and name HB*) 3.3 1.5 1.0 ! 1310  1309  
assign (resid 60 and name HA) (resid 60 and name HD#) 3.3 1.5 1.5 ! 1311  
assign (resid 60 and name HA) (resid 64 and name HD1#) 5.0 3.2 1.5 ! 1313  
assign (resid 60 and name HA) (resid 60 and name HG#) 3.3 1.5 1.5 ! 1314  
assign (resid 61 and name HA) (resid 41 and name HD#) 5.0 3.2 2.0 ! 1316  
assign (resid 61 and name HA) (resid 41 and name HE#) 5.0 3.2 2.0 ! 1317  
assign (resid 61 and name HA) (resid 21 and name HE3) 5.0 3.2 2.0 ! 1320  
assign (resid 61 and name HE#) (resid 61 and name HA) 5.0 3.2 2.0 ! 1336  
assign (resid 61 and name HE#) (resid 61 and name HB*) 3.3 1.5 3.0 ! 1339  1338  
assign (resid 61 and name HD#) (resid 24 and name HG2#) 3.3 1.5 3.5 ! 1347  414  
assign (resid 61 and name HD#) (resid 64 and name HD1#) 5.0 3.2 3.5 ! 1348  
assign (resid 61 and name HD#) (resid 61 and name HA) 2.7 0.9 2.0 ! 1349  1318  
assign (resid 27 and name HE#) (resid 27 and name HB*) 3.3 1.5 3.0 ! 1353  
assign (resid 61 and name HB*) (resid 61 and name HD#) 5.0 3.2 3.0 ! 1376  1372  1351  1350  
assign (resid 61 and name HB*) (resid 58 and name HA) 3.3 1.5 1.0 ! 1378  1239  
assign (resid 61 and name HB*) (resid 61 and name HA) 3.3 1.5 1.0 ! 1382  1381  1322  1321  
assign (resid 62 and name HA) (resid 41 and name HD#) 5.0 3.2 2.0 ! 1383  
assign (resid 62 and name HA) (resid 41 and name HE#) 5.0 3.2 2.0 ! 1384  
assign (resid 62 and name HA) (resid 27 and name HE#) 3.3 1.5 2.0 ! 1385  497  
assign (resid 62 and name HB*) (resid 59 and name HA) 3.3 1.5 0.0 ! 1402  1297  
assign (resid 62 and name HB*) (resid 62 and name HA) 3.3 1.5 0.0 ! 1403  1387  
assign (resid 62 and name HB*) (resid 62 and name HG1#) 5.0 3.2 1.5 ! 1406  
assign (resid 62 and name HG2#) (resid 62 and name HA) 2.7 0.9 1.5 ! 1409  1396  
assign (resid 62 and name HG2#) (resid 62 and name HB*) 5.0 3.2 1.5 ! 1415  1405  
assign (resid 62 and name HG1#) (resid 62 and name HG2#) 5.0 3.2 3.0 ! 1429  1416  
assign (resid 62 and name HG1#) (resid 59 and name HA) 3.3 1.5 1.5 ! 1430  1420  1301  
assign (resid 62 and name HG1#) (resid 62 and name HA) 3.3 1.5 1.5 ! 1431  1421  1397  1394  
assign (resid 62 and name HD#) (resid 59 and name HA) 3.3 1.5 1.5 ! 1433  1299  
assign (resid 62 and name HD#) (resid 62 and name HG1#) 2.7 0.9 3.0 ! 1438  1435  
assign (resid 63 and name HB*) (resid 63 and name HA) 2.7 0.9 1.0 ! 1442  
assign (resid 63 and name HB*) (resid 62 and name HG2#) 5.0 3.2 2.5 ! 1444  1407  
assign (resid 64 and name HB*) (resid 21 and name HZ2) 5.0 3.2 3.0 ! 1446  319  
assign (resid 64 and name HA) (resid 64 and name HG#) 2.7 0.9 1.5 ! 1453  
assign (resid 64 and name HD1#) (resid 21 and name HZ2) 5.0 3.2 3.5 ! 1456  323  
assign (resid 64 and name HD1#) (resid 61 and name HE#) 5.0 3.2 3.5 ! 1457  1315  
assign (resid 64 and name HD1#) (resid 21 and name HZ3) 5.0 3.2 3.5 ! 1458  
assign (resid 64 and name HD1#) (resid 61 and name HA) 3.3 1.5 1.5 ! 1459  1332  
assign (resid 64 and name HD1#) (resid 64 and name HA) 5.0 3.2 1.5 ! 1460  1455  
assign (resid 64 and name HD1#) (resid 64 and name HG#) 3.3 1.5 3.0 ! 1464  
assign (resid 64 and name HD2#) (resid 64 and name HA) 2.7 0.9 1.5 ! 1469  1454  
assign (resid 64 and name HD2#) (resid 64 and name HG#) 2.7 0.9 3.0 ! 1473  
assign (resid 64 and name HD2#) (resid 64 and name HD1#) 2.7 0.9 3.0 ! 1475  1468  
assign (resid 64 and name HB*) (resid 61 and name HA) 3.3 1.5 1.0 ! 1480  1326  1324  
assign (resid 64 and name HB*) (resid 64 and name HA) 2.7 0.9 1.0 ! 1483  1481  1452  1451  
assign (resid 64 and name HB*) (resid 64 and name HG#) 5.0 3.2 2.5 ! 1486  1484  
assign (resid 64 and name HB*) (resid 64 and name HD2#) 3.3 1.5 2.5 ! 1488  1474  1472  
assign (resid 64 and name HB*) (resid 64 and name HD1#) 5.0 3.2 2.5 ! 1490  1489  1465  1463  
assign (resid 65 and name HB*) (resid 65 and name HA) 5.0 3.2 1.0 ! 1499  1498  
assign (resid 65 and name HB*) (resid 62 and name HA) 5.0 3.2 1.0 ! 1500  1393  
assign (resid 65 and name HD1#) (resid 27 and name HA) 5.0 3.2 1.5 ! 1506  1505  516  
assign (resid 65 and name HD1#) (resid 61 and name HA) 5.0 3.2 1.5 ! 1511  1327  
assign (resid 65 and name HD1#) (resid 27 and name HB*) 5.0 3.2 2.5 ! 1516  546  545  
assign (resid 65 and name HD1#) (resid 62 and name HA) 5.0 3.2 1.5 ! 1517  1395  
assign (resid 65 and name HG#) (resid 65 and name HB*) 5.0 3.2 2.5 ! 1522 1501 1493  
assign (resid 65 and name HD1#) (resid 65 and name HB*) 5.0 3.2 2.5      ! 1514  1513  1503 1495
assign (resid 65 and name HD2#) (resid 26 and name HB*) 5.0 3.2 2.5 ! 1534  1533  490  485  
assign (resid 65 and name HD2#) (resid 62 and name HA) 5.0 3.2 1.5 ! 1535  1391  
assign (resid 65 and name HD2#) (resid 65 and name HG#) 3.3 1.5 3.0 ! 1541  1524  
assign (resid 65 and name HD2#) (resid 65 and name HB*) 3.3 1.5 2.5 ! 1542  1539  1504  1496  
assign (resid 65 and name HA) (resid 65 and name HD2#) 2.7 0.9 1.5 ! 1543  1540  
assign (resid 66 and name HA) (resid 66 and name HD#) 3.3 1.5 1.5 ! 1545  
assign (resid 66 and name HA) (resid 66 and name HG#) 3.3 1.5 1.5 ! 1546  
assign (resid 66 and name HB*) (resid 66 and name HA) 2.7 0.9 1.0 ! 1549  1548  1547  
assign (resid 67 and name HB*) (resid 67 and name HG2#) 3.3 1.5 1.5 ! 1554  
assign (resid 67 and name HA) (resid 67 and name HB*) 3.3 1.5 0.0 ! 1561  1551  
assign (resid 67 and name HG2#) (resid 68 and name HD#) 3.3 1.5 3.0 ! 1562  
assign (resid 67 and name HG2#) (resid 67 and name HA) 3.3 1.5 1.5 ! 1563  1558  
assign (resid 43 and name HA) (resid 43 and name HG2#) 2.7 0.9 1.5 ! 1565  839  838  
assign (resid 43 and name HA) (resid 24 and name HG1#) 5.0 3.2 1.5 ! 1567  425  
assign (resid 43 and name HA) (resid 24 and name HG2#) 5.0 3.2 1.5 ! 1568  416  
assign (resid 68 and name HD#) (resid 67 and name HB*) 5.0 3.2 1.5 ! 1572  1552  
assign (resid 68 and name HD#) (resid 67 and name HA) 2.7 0.9 1.5 ! 1573  1560  1559  
assign (resid 68 and name HD#) (resid 68 and name HG#) 5.0 3.2 3.0 ! 1579  1578  
assign (resid 68 and name HA) (resid 68 and name HD#) 3.3 1.5 1.5 ! 1581  1571  
assign (resid 68 and name HB*) (resid 68 and name HD#) 5.0 3.2 2.5 ! 1586  1584  1577  1576  
assign (resid 68 and name HB*) (resid 68 and name HA) 5.0 3.2 1.0 ! 1589  1588  1583  1582  
assign (resid 29 and name HD#) (resid 39 and name HG2#) 3.3 1.5 3.5 ! 1593  719  
assign (resid 29 and name HD#) (resid 29 and name HA) 3.3 1.5 2.0 ! 1595  571  
assign (resid 29 and name HD#) (resid 29 and name HB*) 5.0 3.2 3.0 ! 1597  1596  585  584  
assign (resid 29 and name HD#) (resid 27 and name HE#) 5.0 3.2 4.0 ! 1599  1352  
assign (resid 39 and name HG2#) (resid 53 and name HB*) 3.3 1.5 2.5 ! 1601  1600  1093  1092  
assign (resid 58 and name HG2#) (resid 39 and name HG2#) 5.0 3.2 3.0 ! 1604  1602  
assign (resid 29 and name HA) (resid 30 and name HA) 5.0 3.2 0.0 ! 1605  622  
assign (resid 26 and name HA) (resid 27 and name HA) 5.0 3.2 0.0 ! 1608  522  
assign (resid 41 and name HA) (resid 27 and name HB*) 3.3 1.5 1.0 ! 1612  778  539  537  
assign (resid 25 and name HB*) (resid 43 and name HA) 5.0 3.2 1.0 ! 1615  1564  468  
assign (resid 42 and name HA) (resid 48 and name HE#) 5.0 3.2 1.5 ! 1617  
assign (resid 52 and name HA) (resid 38 and name HA) 3.3 1.5 0.0 ! 1624  693  
assign (resid 52 and name HA) (resid 14 and name HD#) 3.3 1.5 2.0 ! 1625  116  
assign (resid 52 and name HA) (resid 52 and name HD#) 5.0 3.2 2.0 ! 1626  
assign (resid 52 and name HA) (resid 52 and name HB*) 3.3 1.5 1.0 ! 1628  1627  1048  1045  
assign (resid 34 and name HA) (resid 34 and name HB*) 2.7 0.9 1.0 ! 1631  1630  645  642  
assign (resid 52 and name HA) (resid 53 and name HD#) 2.7 0.9 1.5 ! 1632  1629  1115  1112  
assign (resid 14 and name HA) (resid 14 and name HE#) 3.3 1.5 2.0 ! 1633  107  
assign (resid 14 and name HA) (resid 14 and name HD#) 3.3 1.5 2.0 ! 1634  117  
assign (resid 14 and name HA) (resid 51 and name HA) 3.3 1.5 0.0 ! 1635  1040  
assign (resid 41 and name HE#) (resid 58 and name HG2#) 5.0 3.2 3.5 ! 1637  
assign (resid 41 and name HD#) (resid 58 and name HG2#) 5.0 3.2 3.5 ! 1638  
assign (resid 41 and name HD#) (resid 39 and name HG1#) 5.0 3.2 3.5 ! 1639  
assign (resid 41 and name HE#) (resid 39 and name HG1#) 3.3 1.5 3.5 ! 1640  729  
assign (resid 41 and name HD#) (resid 41 and name HA) 3.3 1.5 2.0 ! 1642  1641  772  
assign (resid 12 and name HD#) (resid 12 and name HA) 3.3 1.5 2.0 ! 1643  77  
assign (resid 41 and name HD#) (resid 41 and name HB*) 5.0 3.2 3.0 ! 1646  1645  788  787  
assign (resid 41 and name HD#) (resid 27 and name HB*) 5.0 3.2 3.0 ! 1648  1647  530  
assign (resid 41 and name HD#) (resid 39 and name HB*) 3.3 1.5 3.0 ! 1649  697  
assign (resid 41 and name HE#) (resid 27 and name HB*) 5.0 3.2 3.0 ! 1658  534  531  
assign (resid 23 and name HE3) (resid 23 and name HH2) 3.3 1.5 4.0 ! 1669  
assign (resid 11 and name HB*) (resid 14 and name HD#) 5.0 3.2 3.0 ! 1673  1672  118  
assign (resid 21 and name HH2) (resid 65 and name HD2#) 3.3 1.5 3.5 ! 1674  1537  
assign (resid 21 and name HH2) (resid 64 and name HB*) 5.0 3.2 3.0 ! 1677  1676  1447  
assign (resid 21 and name HH2) (resid 21 and name HZ3) 3.3 1.5 4.0 ! 1679  
assign (resid 21 and name HH2) (resid 21 and name HZ2) 3.3 1.5 4.0 ! 1680  317  
assign (resid 21 and name HH2) (resid 64 and name HD1#) 5.0 3.2 3.5 ! 1682  
assign (resid 65 and name HA) (resid 21 and name HZ3) 5.0 3.2 2.0 ! 1683  
assign (resid 65 and name HA) (resid 21 and name HH2) 5.0 3.2 2.0 ! 1684  1681  
assign (resid 21 and name HE3) (resid 21 and name HA) 3.3 1.5 2.0 ! 1693  329  
assign (resid 21 and name HE3) (resid 21 and name HH2) 5.0 3.2 4.0 ! 1695  
assign (resid 57 and name HH2) (resid 57 and name HZ3) 3.3 1.5 4.0 ! 1700  1194  
assign (resid 57 and name HH2) (resid 57 and name HZ2) 2.7 0.9 4.0 ! 1701  1206  
assign (resid 23 and name HH2) (resid 23 and name HZ2) 2.7 0.9 4.0 ! 1702  1698  
assign (resid 23 and name HZ3) (resid 23 and name HE3) 3.3 1.5 4.0 ! 1703  
assign (resid 23 and name HZ3) (resid 23 and name HH2) 3.3 1.5 4.0 ! 1705  
assign (resid 21 and name HZ3) (resid 21 and name HZ2) 5.0 3.2 4.0 ! 1706  318  
assign (resid 21 and name HZ3) (resid 21 and name HE3) 5.0 3.2 4.0 ! 1707  1694  
assign (resid 40 and name HG2#) (resid 40 and name HA) 3.3 1.5 1.5 ! 1717  
assign (resid 40 and name HG2#) (resid 48 and name HA) 3.3 1.5 1.5 ! 1718  918  
assign (resid 40 and name HG2#) (resid 42 and name HA) 5.0 3.2 1.5 ! 1719  794  
assign (resid 10 and name HA) (resid 34 and name HB*) 5.0 3.2 1.0 ! 49  48  
assign (resid 15 and name HB*) (resid 51 and name HG2#) 3.3 1.5 2.5 ! 137  
assign (resid 18 and name HA) (resid 17 and name HA) 5.0 3.2 0.0 ! 185  
assign (resid 19 and name HD##) (resid 23 and name HE3) 5.0 3.2 3.5 ! 211  
assign (resid 19 and name HD##) (resid 23 and name HZ3) 5.0 3.2 3.5 ! 212  
assign (resid 19 and name HD##) (resid 23 and name HD#) 5.0 3.2 3.5 ! 213  
assign (resid 20 and name HG#) (resid 23 and name HZ2) 5.0 3.2 3.5 ! 253  
assign (resid 20 and name HG#) (resid 23 and name HD#) 5.0 3.2 3.5 ! 254  
assign (resid 20 and name HB*) (resid 19 and name HA) 5.0 3.2 1.0 ! 302  
assign (resid 17 and name HA) (resid 18 and name HG#) 5.0 3.2 1.5 ! 660 157
assign (resid 43 and name HG2#) (resid 41 and name HB*) 5.0 3.2 2.5 ! 835  834  
assign (resid 52 and name HB*) (resid 51 and name HG2#) 5.0 3.2 2.5 ! 1053  1013  
assign (resid 58 and name HG2#) (resid 58 and name HB*) 5.0 3.2 1.5 ! 1264  1248  
assign (resid 65 and name HD1#) (resid 26 and name HA) 3.3 1.5 1.5 ! 1518  479  
assign (resid 65 and name HG#) (resid 65 and name HA) 5.0 3.2 1.5 ! 1520  
assign (resid 65 and name HD1#) (resid 65 and name HA) 5.0 3.2 1.5      ! 1519
assign (resid 65 and name HG#) (resid 41 and name HD#) 5.0 3.2 3.5 ! 1526  
assign (resid 65 and name HD1#) (resid 41 and name HE#) 5.0 3.2 3.5 ! 1527  
assign (resid 16 and name HA) (resid 17 and name HA) 5.0 3.2 0.0 ! 143  
assign (resid 16 and name HA) (resid 15 and name HB*) 5.0 3.2 1.0 ! 144  
assign (resid 18 and name HA) (resid 19 and name HA) 5.0 3.2 0.0 ! 186  
assign (resid 18 and name HB*) (resid 18 and name HG#) 5.0 3.2 2.5 ! 203  209  198  
assign (resid 19 and name HD##) (resid 43 and name HA) 5.0 3.2 1.5 ! 216  
assign (resid 20 and name HG#) (resid 19 and name HA) 5.0 3.2 1.5 ! 256  259  240  
assign (resid 20 and name HD#) (resid 19 and name HA) 5.0 3.2 1.5 ! 276  241  236  
assign (resid 23 and name HB*) (resid 20 and name HB*) 5.0 3.2 2.0 ! 381  379  
assign (resid 27 and name HD#) (resid 62 and name HG2#) 5.0 3.2 3.5 ! 499  
assign (resid 27 and name HD#) (resid 39 and name HG1#) 5.0 3.2 3.5 ! 501  
assign (resid 27 and name HE#) (resid 62 and name HB*) 5.0 3.2 2.0 ! 506  
assign (resid 27 and name HE#) (resid 65 and name HB*) 3.3 1.5 3.0 ! 509  
assign (resid 27 and name HE#) (resid 65 and name HD1#) 5.0 3.2 3.5 ! 510  1529  
assign (resid 27 and name HB*) (resid 62 and name HG2#) 5.0 3.2 2.5 ! 548  1716  1398  
assign (resid 28 and name HA) (resid 40 and name HD#) 5.0 3.2 1.5 ! 551  
assign (resid 28 and name HA) (resid 62 and name HG2#) 5.0 3.2 1.5 ! 552  
assign (resid 17 and name HA) (resid 17 and name HG#) 5.0 3.2 1.5 ! 661  
assign (resid 17 and name HA) (resid 17 and name HB*) 2.7 0.9 1.0 ! 665  
assign (resid 17 and name HA) (resid 18 and name HD#) 2.7 0.9 1.5 ! 667  666  176  175  
assign (resid 40 and name HA) (resid 41 and name HB*) 5.0 3.2 1.0 ! 756  
assign (resid 42 and name HG2#) (resid 48 and name HE#) 5.0 3.2 3.0 ! 805  
assign (resid 43 and name HB*) (resid 44 and name HG#) 5.0 3.2 1.5    ! 823
assign (resid 43 and name HB*) (resid 19 and name HD##) 5.0 3.2 1.5 ! 824  217  
assign (resid 43 and name HA) (resid 23 and name HA) 5.0 3.2 0.0 ! 829  361  
assign (resid 48 and name HA) (resid 48 and name HE#) 5.0 3.2 1.5 ! 912  
assign (resid 49 and name HG2#) (resid 23 and name HE3) 5.0 3.2 3.5 ! 932  
assign (resid 49 and name HB*) (resid 42 and name HA) 5.0 3.2 0.0 ! 958  
assign (resid 49 and name HB*) (resid 41 and name HB*) 5.0 3.2 1.0 ! 963  962  791  790  
assign (resid 50 and name HB*) (resid 40 and name HD#) 5.0 3.2 2.5 ! 977  976  
assign (resid 50 and name HB*) (resid 49 and name HA) 5.0 3.2 1.0 ! 978  
assign (resid 52 and name HB*) (resid 55 and name HG#) 5.0 3.2 2.5 ! 1055  1052  
assign (resid 53 and name HG#) (resid 53 and name HB*) 5.0 3.2 2.5 ! 1074  1073  
assign (resid 57 and name HB*) (resid 57 and name HE3) 5.0 3.2 3.0 ! 1228  
assign (resid 58 and name HG2#) (resid 57 and name HE3) 5.0 3.2 3.5 ! 1266  1188  
assign (resid 61 and name HE#) (resid 57 and name HZ3) 3.3 1.5 4.0 ! 1333  
assign (resid 61 and name HE#) (resid 57 and name HE3) 5.0 3.2 4.0 ! 1334  
assign (resid 27 and name HD#) (resid 65 and name HB*) 3.3 1.5 3.0 ! 1355  
assign (resid 27 and name HD#) (resid 62 and name HB*) 5.0 3.2 2.0 ! 1356  
assign (resid 27 and name HD#) (resid 65 and name HD1#) 3.3 1.5 3.5 ! 1357  
assign (resid 62 and name HG2#) (resid 59 and name HA) 5.0 3.2 1.5 ! 1410  
assign (resid 62 and name HG2#) (resid 27 and name HE#) 3.3 1.5 3.5 ! 1413  511  
assign (resid 65 and name HG#) (resid 21 and name HZ2) 5.0 3.2 3.5 ! 1530  
assign (resid 65 and name HG#) (resid 21 and name HH2) 5.0 3.2 3.5 ! 1678  1675 1528  
assign (resid 65 and name HD1#) (resid 21 and name HH2) 5.0 3.2 3.5     ! 1531
assign (resid 65 and name HG#) (resid 21 and name HZ3) 5.0 3.2 3.5 ! 1532  
assign (resid 40 and name HG2#) (resid 41 and name HB*) 5.0 3.2 2.5 ! 1720  
assign (resid 40 and name HG2#) (resid 28 and name HG#) 5.0 3.2 3.0 ! 1725  
assign (resid 41 and name HB*) (resid 49 and name HG1#) 5.0 3.2 2.5 ! 1726  
assign (resid 43 and name HG2#) (resid 23 and name HA) 5.0 3.2 1.5 ! 1728  369  
assign (resid 58 and name HG2#) (resid 57 and name HZ3) 5.0 3.2 3.5 ! 1730  1189  
assign (resid 14 and name HA) (resid 50 and name HB*) 3.3 1.5 1.0 ! 1731  1636  990  
assign (resid 14 and name HA) (resid 14 and name HB*) 5.0 3.2 1.0 ! 1735  1734  126  125  
assign (resid 6 and name HG2#) (resid 6 and name HA) 3.3 1.5 1.5 ! 1737  8  
assign (resid 6 and name HG2#) (resid 6 and name HB*) 3.3 1.5 1.5 ! 1736  
assign (resid 7 and name HB*) (resid 6 and name HB*) 5.0 3.2 1.0 ! 18  
assign (resid 6 and name HD#) (resid 6 and name HA) 5.0 3.2 1.5 ! 12  
assign (resid 6 and name HD#) (resid 6 and name HB*) 5.0 3.2 1.5 ! 11  
assign (resid 6 and name HG2#) (resid 7 and name HA) 5.0 3.2 1.5 ! 1738  
assign (resid 40 and name HD#) (resid 9 and name HB*) 5.0 3.2 2.5 ! 771  
assign (resid 8 and name HA) (resid 9 and name HG2#) 5.0 3.2 1.5 ! 21  
assign (resid 13 and name HA) (resid 12 and name HB*) 5.0 3.2 1.0 ! 97  
assign (resid 12 and name HB*) (resid 12 and name HD#) 5.0 3.2 3.0 ! 86  87  
assign (resid 10 and name HB1) (resid 12 and name HD#) 5.0 3.2 2.0 ! 35  
assign (resid 10 and name HB2) (resid 12 and name HE#) 5.0 3.2 2.0 ! 34  
assign (resid 12 and name HA) (resid 14 and name HD#) 5.0 3.2 2.0 ! 1739  
assign (resid 12 and name HA) (resid 14 and name HE#) 5.0 3.2 2.0 ! 79  
assign (resid 15 and name HB*) (resid 16 and name HD#) 5.0 3.2 3.0 ! 1740  
assign (resid 16 and name HA) (resid 18 and name HD#) 5.0 3.2 1.5 ! 145  
assign (resid 18 and name HA) (resid 19 and name HB*) 5.0 3.2 1.0 ! 191  
assign (resid 18 and name HD#) (resid 19 and name HB*) 5.0 3.2 2.5 ! 165  171  
assign (resid 24 and name HG1#) (resid 20 and name HD#) 5.0 3.2 3.0 ! 435  
assign (resid 24 and name HG2#) (resid 20 and name HD#) 3.3 1.5 3.0 ! 410  422  
assign (resid 19 and name HB*) (resid 21 and name HZ2) 5.0 3.2 3.0 ! 1743  
assign (resid 24 and name HG2#) (resid 21 and name HE3) 5.0 3.2 3.5 ! 415  
assign (resid 21 and name HB*) (resid 21 and name HD#) 5.0 3.2 3.0 ! 341  343  314  313  
assign (resid 21 and name HB*) (resid 21 and name HE3) 5.0 3.2 3.0 ! 340  345  309  308  
assign (resid 21 and name HA) (resid 21 and name HZ3) 5.0 3.2 2.0 ! 328  
assign (resid 19 and name HB*) (resid 21 and name HH2) 5.0 3.2 3.0 ! 245  
assign (resid 19 and name HB*) (resid 21 and name HD#) 5.0 3.2 3.0 ! 243  
assign (resid 19 and name HD##) (resid 21 and name HA) 5.0 3.2 1.5 ! 219  
assign (resid 22 and name HB*) (resid 23 and name HD#) 5.0 3.2 2.0 ! 346  
assign (resid 19 and name HA) (resid 23 and name HE3) 5.0 3.2 2.0 ! 235  
assign (resid 19 and name HD##) (resid 23 and name HB*) 5.0 3.2 2.5 ! 220  221  
assign (resid 21 and name HA) (resid 24 and name HG2#) 3.3 1.5 1.5 ! 336  420  
assign (resid 19 and name HB*) (resid 24 and name HG2#) 5.0 3.2 2.5 ! 228  
assign (resid 43 and name HA) (resid 25 and name HA) 5.0 3.2 0.0 ! 1714  
assign (resid 41 and name HB*) (resid 27 and name HA) 5.0 3.2 1.0 ! 1741  1742  514  513  
assign (resid 10 and name HA) (resid 30 and name HG2#) 5.0 3.2 1.5 ! 52  
assign (resid 10 and name HA) (resid 30 and name HA) 5.0 3.2 0.0 ! 47  
assign (resid 12 and name HB*) (resid 36 and name HB*) 5.0 3.2 2.0 ! 85  92  
assign (resid 40 and name HD#) (resid 40 and name HG1#) 2.7 0.9 3.0 ! 767  751  
assign (resid 30 and name HG2#) (resid 40 and name HD#) 3.3 1.5 3.0 ! 601  
assign (resid 10 and name HA) (resid 40 and name HD#) 5.0 3.2 1.5 ! 54  
assign (resid 9 and name HG2#) (resid 40 and name HD#) 3.3 1.5 3.0 ! 30  768  
assign (resid 7 and name HB*) (resid 40 and name HD#) 5.0 3.2 2.5 ! 16  
assign (resid 49 and name HB*) (resid 41 and name HD#) 5.0 3.2 2.0 ! 959  
assign (resid 49 and name HG1#) (resid 41 and name HD#) 5.0 3.2 3.5 ! 942  
assign (resid 24 and name HG1#) (resid 41 and name HB*) 5.0 3.2 2.5 ! 436  437  792  793  
assign (resid 24 and name HG2#) (resid 41 and name HB*) 5.0 3.2 2.5 ! 423  424  1727  
assign (resid 24 and name HG2#) (resid 41 and name HD#) 5.0 3.2 3.5 ! 413  
assign (resid 24 and name HG1#) (resid 42 and name HA) 5.0 3.2 1.5 ! 428  
assign (resid 24 and name HG2#) (resid 43 and name HG2#) 3.3 1.5 3.0 ! 419  
assign (resid 4 and name HA) (resid 5 and name HN) 2.7 0.9 0.2 ! 1  
assign (resid 6 and name HN) (resid 5 and name HN) 5.0 3.2 0.4 ! 2  
assign (resid 4 and name HN) (resid 5 and name HN) 5.0 3.2 0.4 ! 3  
assign (resid 5 and name HB*) (resid 5 and name HN) 5.0 3.2 1.2 ! 4  
assign (resid 5 and name HA) (resid 5 and name HN) 2.7 0.9 0.2 ! 5  
assign (resid 6 and name HG#) (resid 6 and name HN) 5.0 3.2 1.7 ! 8  
assign (resid 6 and name HB*) (resid 6 and name HN) 2.7 0.9 0.2 ! 9  
assign (resid 6 and name HA) (resid 6 and name HN) 3.3 1.5 0.2 ! 10  
assign (resid 6 and name HN) (resid 7 and name HN) 2.7 0.9 0.4 ! 14  
assign (resid 7 and name HA) (resid 7 and name HN) 2.7 0.9 0.2 ! 15  
assign (resid 6 and name HA) (resid 7 and name HN) 2.7 0.9 0.2 ! 16  
assign (resid 7 and name HB*) (resid 7 and name HN) 2.7 0.9 1.2 ! 17  
assign (resid 7 and name HB*) (resid 8 and name HN) 5.0 3.2 1.2 ! 18  
assign (resid 8 and name HD#) (resid 8 and name HN) 3.3 1.5 1.7 ! 20  
assign (resid 8 and name HG#) (resid 8 and name HN) 2.7 0.9 1.7 ! 21  
assign (resid 8 and name HB*) (resid 8 and name HN) 3.3 1.5 1.2 ! 22  
assign (resid 8 and name HA) (resid 8 and name HN) 2.7 0.9 0.2 ! 23  
assign (resid 6 and name HA) (resid 8 and name HN) 3.3 1.5 0.2 ! 24  
assign (resid 9 and name HG2#) (resid 9 and name HN) 5.0 3.2 1.7 ! 28  
assign (resid 9 and name HB*) (resid 9 and name HN) 2.7 0.9 0.2 ! 29  
assign (resid 8 and name HA) (resid 9 and name HN) 2.7 0.9 0.2 ! 30  
assign (resid 10 and name HA) (resid 10 and name HN) 3.3 1.5 0.2 ! 35  
assign (resid 9 and name HG2#) (resid 10 and name HN) 3.3 1.5 1.7 ! 36  
assign (resid 10 and name HB1) (resid 10 and name HN) 3.3 1.5 0.2  ! 34
assign (resid 10 and name HB2) (resid 10 and name HN) 2.7 0.9 0.2 ! 33 37
assign (resid 34 and name HB*) (resid 11 and name HN) 5.0 3.2 1.2 ! 38  
assign (resid 11 and name HB*) (resid 11 and name HN) 2.7 0.9 1.2 ! 44  43  
assign (resid 11 and name HA) (resid 11 and name HN) 3.3 1.5 0.2 ! 45  
assign (resid 10 and name HA) (resid 11 and name HN) 2.7 0.9 0.2 ! 46  
assign (resid 10 and name HB2) (resid 11 and name HN) 3.3 1.5 0.2      ! 41
assign (resid 10 and name HB1) (resid 11 and name HN) 2.7 0.9 0.2      ! 47
assign (resid 12 and name HD#) (resid 12 and name HN) 5.0 3.2 2.2 ! 48  
assign (resid 12 and name HA) (resid 12 and name HN) 2.7 0.9 0.2 ! 53  
assign (resid 12 and name HB*) (resid 12 and name HN) 5.0 3.2 1.2 ! 55  54  52  
assign (resid 12 and name HB*) (resid 13 and name HN) 3.3 1.5 1.2 ! 60  58  
assign (resid 12 and name HN) (resid 13 and name HN) 3.3 1.5 0.4 ! 62  49  
assign (resid 13 and name HB*) (resid 13 and name HN) 2.7 0.9 1.2 ! 64  61  
assign (resid 13 and name HG#) (resid 13 and name HN) 3.3 1.5 1.7 ! 65  
assign (resid 13 and name HA) (resid 13 and name HN) 2.7 0.9 0.2 ! 66  
assign (resid 13 and name HN) (resid 14 and name HN) 5.0 3.2 0.4 ! 67  63  
assign (resid 14 and name HD#) (resid 14 and name HN) 2.7 0.9 2.2 ! 69  
assign (resid 14 and name HB*) (resid 14 and name HN) 2.7 0.9 1.2 ! 75  71  
assign (resid 14 and name HA) (resid 14 and name HN) 2.7 0.9 0.2 ! 76  
assign (resid 14 and name HD#) (resid 15 and name HN) 5.0 3.2 2.2 ! 77  
assign (resid 15 and name HB*) (resid 15 and name HN) 2.7 0.9 1.2 ! 84  
assign (resid 15 and name HA) (resid 15 and name HN) 2.7 0.9 0.2 ! 85  
assign (resid 14 and name HB*) (resid 15 and name HN) 3.3 1.5 1.2 ! 86  80  
assign (resid 51 and name HA) (resid 15 and name HN) 3.3 1.5 0.2 ! 87  
assign (resid 17 and name HG#) (resid 17 and name HN) 3.3 1.5 1.7 ! 94  
assign (resid 17 and name HB*) (resid 17 and name HN) 2.7 0.9 1.2 ! 95  
assign (resid 17 and name HA) (resid 17 and name HN) 2.7 0.9 0.2 ! 96  
assign (resid 19 and name HD#) (resid 19 and name HN) 3.3 1.5 1.7 ! 103  
assign (resid 19 and name HB*) (resid 19 and name HN) 2.7 0.9 1.2 ! 104  
assign (resid 19 and name HG#) (resid 19 and name HN) 3.3 1.5 1.7 ! 105  
assign (resid 19 and name HA) (resid 19 and name HN) 3.3 1.5 0.2 ! 106  
assign (resid 18 and name HA) (resid 19 and name HN) 2.7 0.9 0.2 ! 107  
assign (resid 21 and name HZ2) (resid 21 and name HE1) 2.7 0.9 4.0 ! 108  
assign (resid 21 and name HD#) (resid 21 and name HE1) 2.7 0.9 4.0 ! 109  
assign (resid 21 and name HD#) (resid 21 and name HN) 5.0 3.2 2.2 ! 113  
assign (resid 21 and name HE3) (resid 21 and name HN) 5.0 3.2 2.2 ! 115  
assign (resid 21 and name HB*) (resid 21 and name HN) 2.7 0.9 1.2 ! 122  121  120  
assign (resid 20 and name HG#) (resid 21 and name HN) 5.0 3.2 1.7 ! 124  
assign (resid 20 and name HB*) (resid 21 and name HN) 5.0 3.2 1.2 ! 125  123  
assign (resid 21 and name HN) (resid 22 and name HN) 3.3 1.5 0.4 ! 129  118  
assign (resid 22 and name HB*) (resid 22 and name HN) 3.3 1.5 0.2 ! 130  
assign (resid 22 and name HA) (resid 22 and name HN) 2.7 0.9 0.2 ! 131  
assign (resid 20 and name HA) (resid 22 and name HN) 5.0 3.2 0.2 ! 132  
assign (resid 21 and name HB*) (resid 22 and name HN) 3.3 1.5 1.2 ! 133  128  
assign (resid 21 and name HA) (resid 22 and name HN) 5.0 3.2 0.2 ! 134  
assign (resid 20 and name HB*) (resid 22 and name HN) 5.0 3.2 1.2 ! 137  135  
assign (resid 23 and name HD#) (resid 23 and name HN) 3.3 1.5 2.2 ! 141  
assign (resid 23 and name HZ2) (resid 23 and name HE1) 3.3 1.5 4.0 ! 146  
assign (resid 23 and name HD#) (resid 23 and name HE1) 2.7 0.9 4.0 ! 147  
assign (resid 22 and name HN) (resid 23 and name HN) 2.7 0.9 0.4 ! 148  126  
assign (resid 23 and name HB*) (resid 23 and name HN) 2.7 0.9 1.2 ! 151  150  
assign (resid 23 and name HA) (resid 23 and name HN) 2.7 0.9 0.2 ! 152  
assign (resid 22 and name HA) (resid 23 and name HN) 5.0 3.2 0.2 ! 153  
assign (resid 21 and name HA) (resid 23 and name HN) 5.0 3.2 0.2 ! 154  
assign (resid 22 and name HB*) (resid 23 and name HN) 5.0 3.2 0.2 ! 155  
assign (resid 20 and name HG#) (resid 23 and name HN) 5.0 3.2 1.7 ! 157  
assign (resid 20 and name HB*) (resid 23 and name HN) 3.3 1.5 1.2 ! 158  156  
assign (resid 23 and name HN) (resid 24 and name HN) 2.7 0.9 0.4 ! 161  149  
assign (resid 24 and name HB*) (resid 24 and name HN) 2.7 0.9 0.2 ! 164  
assign (resid 24 and name HA) (resid 24 and name HN) 2.7 0.9 0.2 ! 165  
assign (resid 21 and name HA) (resid 24 and name HN) 5.0 3.2 0.2 ! 166  
assign (resid 22 and name HA) (resid 24 and name HN) 5.0 3.2 0.2 ! 167  
assign (resid 22 and name HB*) (resid 24 and name HN) 5.0 3.2 0.2 ! 168  
assign (resid 23 and name HA) (resid 24 and name HN) 5.0 3.2 0.2 ! 170  
assign (resid 24 and name HN) (resid 25 and name HN) 5.0 3.2 0.4 ! 178  162  
assign (resid 43 and name HA) (resid 25 and name HN) 2.7 0.9 0.2 ! 179  
assign (resid 25 and name HG#) (resid 25 and name HN) 5.0 3.2 1.7 ! 182  
assign (resid 25 and name HB*) (resid 25 and name HN) 2.7 0.9 1.2 ! 183  181  
assign (resid 25 and name HA) (resid 25 and name HN) 3.3 1.5 0.2 ! 184  
assign (resid 43 and name HA) (resid 26 and name HN) 5.0 3.2 0.2 ! 189  
assign (resid 25 and name HN) (resid 26 and name HN) 2.7 0.9 0.4 ! 191  180  
assign (resid 26 and name HB1) (resid 26 and name HN) 3.3 15 0.2      ! 193
assign (resid 26 and name HB2) (resid 26 and name HN) 5.0 3.2 0.2      ! 194
assign (resid 26 and name HA) (resid 26 and name HN) 3.3 1.5 0.2 ! 195  
assign (resid 24 and name HA) (resid 26 and name HN) 5.0 3.2 0.2 ! 196  
assign (resid 25 and name HA) (resid 26 and name HN) 5.0 3.2 0.2 ! 197  
assign (resid 24 and name HG1#) (resid 26 and name HN) 2.7 0.9 1.7 ! 198  
assign (resid 25 and name HG#) (resid 26 and name HN) 5.0 3.2 1.7 ! 200  
assign (resid 25 and name HB*) (resid 26 and name HN) 2.7 0.9 1.2 ! 201  199  
assign (resid 26 and name HN) (resid 27 and name HN) 5.0 3.2 0.4 ! 202  192  
assign (resid 27 and name HD#) (resid 27 and name HN) 2.7 0.9 2.2 ! 203  
assign (resid 27 and name HB*) (resid 27 and name HN) 5.0 3.2 1.2 ! 205  204  
assign (resid 27 and name HA) (resid 27 and name HN) 3.3 1.5 0.2 ! 209  
assign (resid 26 and name HA) (resid 27 and name HN) 2.7 0.9 0.2 ! 210  
assign (resid 26 and name HB1) (resid 27 and name HN) 3.3 1.5 0.2      ! 211
assign (resid 26 and name HB2) (resid 27 and name HN) 5.0 3.2 0.2      ! 212
assign (resid 27 and name HB*) (resid 28 and name HN) 3.3 1.5 1.2 ! 213  
assign (resid 40 and name HN) (resid 28 and name HN) 3.3 1.5 0.4 ! 217  
assign (resid 41 and name HD#) (resid 28 and name HN) 5.0 3.2 2.2 ! 218  
assign (resid 41 and name HA) (resid 28 and name HN) 5.0 3.2 0.2 ! 220  
assign (resid 28 and name HB*) (resid 28 and name HN) 2.7 0.9 1.2 ! 223  
assign (resid 28 and name HA) (resid 28 and name HN) 2.7 0.9 0.2 ! 225  
assign (resid 27 and name HA) (resid 28 and name HN) 2.7 0.9 0.2 ! 226  
assign (resid 39 and name HG1#) (resid 28 and name HN) 3.3 1.5 1.7 ! 227  
assign (resid 39 and name HG2#) (resid 28 and name HN) 5.0 3.2 1.7 ! 228  
assign (resid 28 and name HN) (resid 29 and name HN) 5.0 3.2 0.4 ! 233  221  
assign (resid 29 and name HB*) (resid 29 and name HN) 2.7 0.9 1.2 ! 235  234  
assign (resid 29 and name HA) (resid 29 and name HN) 3.3 1.5 0.2 ! 236  
assign (resid 28 and name HA) (resid 29 and name HN) 2.7 0.9 0.2 ! 237  
assign (resid 40 and name HN) (resid 30 and name HN) 5.0 3.2 0.4 ! 238  
assign (resid 38 and name HN) (resid 30 and name HN) 3.3 1.5 0.4 ! 239  
assign (resid 29 and name HD#) (resid 30 and name HN) 5.0 3.2 2.2 ! 240  
assign (resid 30 and name HB*) (resid 30 and name HN) 5.0 3.2 0.2 ! 242  
assign (resid 39 and name HA) (resid 30 and name HN) 3.3 1.5 0.2 ! 244  
assign (resid 29 and name HN) (resid 30 and name HN) 5.0 3.2 0.4 ! 247  
assign (resid 30 and name HA) (resid 30 and name HN) 2.7 0.9 0.2 ! 248  
assign (resid 39 and name HG2#) (resid 30 and name HN) 5.0 3.2 1.7 ! 249  
assign (resid 39 and name HG1#) (resid 30 and name HN) 5.0 3.2 1.7 ! 250  
assign (resid 29 and name HB*) (resid 30 and name HN) 2.7 0.9 1.2 ! 252  251  
assign (resid 30 and name HG2#) (resid 30 and name HN) 2.7 0.9 1.7 ! 253  
assign (resid 29 and name HA) (resid 30 and name HN) 2.7 0.9 0.2 ! 254  
assign (resid 30 and name HB*) (resid 31 and name HN) 2.7 0.9 0.2 ! 255  
assign (resid 31 and name HB*) (resid 31 and name HN) 2.7 0.9 1.2 ! 257  
assign (resid 30 and name HG2#) (resid 31 and name HN) 3.3 1.5 1.7 ! 258  
assign (resid 30 and name HA) (resid 31 and name HN) 2.7 0.9 0.2 ! 259  
assign (resid 31 and name HA) (resid 31 and name HN) 2.7 0.9 0.2 ! 260  
assign (resid 32 and name HB*) (resid 32 and name HN) 5.0 3.2 1.2 ! 266  
assign (resid 31 and name HA) (resid 32 and name HN) 3.3 1.5 0.2 ! 267  
assign (resid 31 and name HB*) (resid 32 and name HN) 5.0 3.2 1.2 ! 268  
assign (resid 32 and name HN) (resid 33 and name HN) 5.0 3.2 0.4 ! 269  264  
assign (resid 33 and name HB*) (resid 33 and name HN) 2.7 0.9 1.2 ! 271  
assign (resid 33 and name HA) (resid 33 and name HN) 2.7 0.9 0.2 ! 272  
assign (resid 32 and name HB*) (resid 33 and name HN) 5.0 3.2 1.2 ! 273  
assign (resid 33 and name HA) (resid 34 and name HN) 3.3 1.5 0.2 ! 277  
assign (resid 33 and name HN) (resid 34 and name HN) 2.7 0.9 0.4 ! 278  270  
assign (resid 35 and name HN) (resid 34 and name HN) 5.0 3.2 0.4 ! 279  
assign (resid 34 and name HB*) (resid 34 and name HN) 2.7 0.9 1.2 ! 281  280  
assign (resid 33 and name HB*) (resid 34 and name HN) 5.0 3.2 1.2 ! 283  
assign (resid 35 and name HB*) (resid 35 and name HN) 3.3 1.5 1.2 ! 286  
assign (resid 35 and name HA) (resid 35 and name HN) 5.0 3.2 0.2 ! 287  
assign (resid 34 and name HB*) (resid 35 and name HN) 5.0 3.2 1.2 ! 289  288  
assign (resid 34 and name HA) (resid 35 and name HN) 2.7 0.9 0.2 ! 290  
assign (resid 36 and name HB*) (resid 36 and name HN) 3.3 1.5 1.2 ! 296  295  
assign (resid 35 and name HN) (resid 36 and name HN) 3.3 1.5 0.4 ! 299  285  
assign (resid 35 and name HB*) (resid 36 and name HN) 3.3 1.5 1.2 ! 300  
assign (resid 35 and name HA) (resid 36 and name HN) 5.0 3.2 0.2 ! 301  
assign (resid 36 and name HN) (resid 37 and name HN) 5.0 3.2 0.4 ! 303  297  
assign (resid 37 and name HD#) (resid 37 and name HN) 5.0 3.2 1.7 ! 305  
assign (resid 37 and name HA) (resid 37 and name HN) 2.7 0.9 0.2 ! 307  
assign (resid 36 and name HB*) (resid 37 and name HN) 3.3 1.5 1.2 ! 309  308  
assign (resid 36 and name HG#) (resid 37 and name HN) 5.0 3.2 1.7 ! 310  
assign (resid 36 and name HA) (resid 37 and name HN) 2.7 0.9 0.2 ! 311  
assign (resid 30 and name HG2#) (resid 38 and name HN) 3.3 1.5 1.7 ! 313  
assign (resid 38 and name HB*) (resid 38 and name HN) 2.7 0.9 1.2 ! 315  
assign (resid 38 and name HA) (resid 38 and name HN) 2.7 0.9 0.2 ! 316  
assign (resid 37 and name HA) (resid 38 and name HN) 2.7 0.9 0.2 ! 317  
assign (resid 53 and name HD#) (resid 39 and name HN) 3.3 1.5 1.7 ! 322  321  
assign (resid 52 and name HA) (resid 39 and name HN) 5.0 3.2 0.2 ! 323  
assign (resid 39 and name HG2#) (resid 39 and name HN) 3.3 1.5 1.7 ! 324  
assign (resid 39 and name HB*) (resid 39 and name HN) 2.7 0.9 1.2 ! 325  
assign (resid 39 and name HA) (resid 39 and name HN) 3.3 1.5 0.2 ! 326  
assign (resid 38 and name HA) (resid 39 and name HN) 2.7 0.9 0.2 ! 327  
assign (resid 38 and name HB*) (resid 39 and name HN) 2.7 0.9 1.2 ! 328  
assign (resid 39 and name HG1#) (resid 39 and name HN) 5.0 3.2 1.7 ! 329  
assign (resid 29 and name HA) (resid 40 and name HN) 5.0 3.2 0.2 ! 332  
assign (resid 28 and name HG#) (resid 40 and name HN) 5.0 3.2 1.7 ! 334  333  
assign (resid 40 and name HG2#) (resid 40 and name HN) 2.7 0.9 1.7 ! 335  
assign (resid 40 and name HD#) (resid 40 and name HN) 3.3 1.5 1.7 ! 336  
assign (resid 40 and name HB*) (resid 40 and name HN) 2.7 0.9 0.2 ! 337  
assign (resid 40 and name HA) (resid 40 and name HN) 3.3 1.5 0.2 ! 338  
assign (resid 39 and name HG2#) (resid 40 and name HN) 5.0 3.2 1.7 ! 339  
assign (resid 39 and name HG1#) (resid 40 and name HN) 2.7 0.9 1.7 ! 340  
assign (resid 40 and name HG1#) (resid 40 and name HN) 5.0 3.2 1.7 ! 341  
assign (resid 39 and name HA) (resid 40 and name HN) 2.7 0.9 0.2 ! 342  
assign (resid 48 and name HA) (resid 41 and name HN) 5.0 3.2 0.2 ! 344  
assign (resid 49 and name HB*) (resid 41 and name HN) 5.0 3.2 0.2 ! 345  
assign (resid 41 and name HD#) (resid 41 and name HN) 3.3 1.5 2.2 ! 349  
assign (resid 40 and name HN) (resid 41 and name HN) 5.0 3.2 0.4 ! 350  330  
assign (resid 41 and name HB*) (resid 41 and name HN) 2.7 0.9 1.2 ! 353  352  
assign (resid 41 and name HA) (resid 41 and name HN) 3.3 1.5 0.2 ! 354  
assign (resid 39 and name HG1#) (resid 41 and name HN) 5.0 3.2 1.7 ! 355  
assign (resid 40 and name HG2#) (resid 41 and name HN) 5.0 3.2 1.7 ! 357  
assign (resid 43 and name HN) (resid 42 and name HN) 5.0 3.2 0.4 ! 360  
assign (resid 41 and name HN) (resid 42 and name HN) 5.0 3.2 0.4 ! 361  351  
assign (resid 25 and name HN) (resid 42 and name HN) 5.0 3.2 0.4 ! 362  177  
assign (resid 24 and name HG1#) (resid 42 and name HN) 5.0 3.2 1.7 ! 363  
assign (resid 26 and name HN) (resid 42 and name HN) 2.7 0.9 0.4 ! 364  188  
assign (resid 41 and name HD#) (resid 42 and name HN) 3.3 1.5 2.2 ! 365  
assign (resid 42 and name HG2#) (resid 42 and name HN) 5.0 3.2 1.7 ! 366  
assign (resid 42 and name HB*) (resid 42 and name HN) 2.7 0.9 0.2 ! 367  
assign (resid 41 and name HB*) (resid 42 and name HN) 3.3 1.5 1.2 ! 370  369  
assign (resid 48 and name HA) (resid 43 and name HN) 3.3 1.5 0.2 ! 371  
assign (resid 43 and name HG2#) (resid 43 and name HN) 2.7 0.9 1.7 ! 374  
assign (resid 42 and name HG2#) (resid 43 and name HN) 2.7 0.9 1.7 ! 375  
assign (resid 43 and name HB*) (resid 43 and name HN) 5.0 3.2 0.2 ! 377  
assign (resid 42 and name HB*) (resid 43 and name HN) 5.0 3.2 0.2 ! 378  
assign (resid 24 and name HA) (resid 43 and name HN) 5.0 3.2 0.2 ! 379  
assign (resid 43 and name HG2#) (resid 44 and name HN) 2.7 0.9 1.7 ! 388  
assign (resid 43 and name HB*) (resid 44 and name HN) 2.7 0.9 0.2 ! 390  
assign (resid 43 and name HN) (resid 44 and name HN) 5.0 3.2 0.4 ! 391  380  
assign (resid 44 and name HG#) (resid 44 and name HN) 2.7 0.9 1.7 ! 392  
assign (resid 44 and name HB*) (resid 44 and name HN) 2.7 0.9 1.2 ! 393  
assign (resid 44 and name HA) (resid 44 and name HN) 3.3 1.5 0.2 ! 394  
assign (resid 45 and name HA) (resid 44 and name HN) 5.0 3.2 0.2 ! 395  
assign (resid 43 and name HA) (resid 45 and name HN) 5.0 3.2 0.2 ! 403  
assign (resid 43 and name HB*) (resid 45 and name HN) 5.0 3.2 0.2 ! 404  
assign (resid 44 and name HA) (resid 45 and name HN) 5.0 3.2 0.2 ! 408  
assign (resid 46 and name HA*) (resid 45 and name HN) 5.0 3.2 1.2 ! 409  407  
assign (resid 44 and name HN) (resid 45 and name HN) 5.0 3.2 0.4 ! 412  385  
assign (resid 45 and name HB*) (resid 45 and name HN) 2.7 0.9 1.2 ! 414  413  
assign (resid 45 and name HA) (resid 45 and name HN) 3.3 1.5 0.2 ! 415  
assign (resid 43 and name HB*) (resid 46 and name HN) 5.0 3.2 0.2 ! 418  
assign (resid 43 and name HA) (resid 46 and name HN) 5.0 3.2 0.2 ! 419  
assign (resid 43 and name HN) (resid 46 and name HN) 5.0 3.2 0.4 ! 420  381  
assign (resid 44 and name HN) (resid 46 and name HN) 5.0 3.2 0.4 ! 421  384  
assign (resid 45 and name HN) (resid 46 and name HN) 3.3 1.5 0.4 ! 422  411  
assign (resid 46 and name HA*) (resid 46 and name HN) 2.7 0.9 1.2 ! 425  424  
assign (resid 44 and name HA) (resid 46 and name HN) 5.0 3.2 0.2 ! 426  
assign (resid 45 and name HB*) (resid 46 and name HN) 5.0 3.2 1.2 ! 428  427  
assign (resid 45 and name HN) (resid 47 and name HN) 3.3 1.5 0.4 ! 429  401  
assign (resid 42 and name HA) (resid 47 and name HN) 5.0 3.2 0.2 ! 432  
assign (resid 43 and name HB*) (resid 47 and name HN) 5.0 3.2 0.2 ! 433  
assign (resid 43 and name HN) (resid 47 and name HN) 3.3 1.5 0.4 ! 435  382  
assign (resid 46 and name HN) (resid 47 and name HN) 2.7 0.9 0.4 ! 437  423  
assign (resid 47 and name HG#) (resid 47 and name HN) 3.3 1.5 1.7 ! 439  438  
assign (resid 47 and name HD#) (resid 47 and name HN) 3.3 1.5 1.7 ! 440  
assign (resid 47 and name HA) (resid 47 and name HN) 2.7 0.9 0.2 ! 441  
assign (resid 46 and name HA*) (resid 47 and name HN) 2.7 0.9 1.2 ! 443  442  
assign (resid 48 and name HA) (resid 48 and name HN) 3.3 1.5 0.2 ! 448  
assign (resid 47 and name HA) (resid 48 and name HN) 2.7 0.9 0.2 ! 449  
assign (resid 47 and name HG#) (resid 48 and name HN) 5.0 3.2 1.7 ! 450  
assign (resid 41 and name HB*) (resid 49 and name HN) 5.0 3.2 1.2 ! 453  452  
assign (resid 48 and name HB*) (resid 49 and name HN) 5.0 3.2 1.2 ! 455  
assign (resid 48 and name HN) (resid 49 and name HN) 5.0 3.2 0.4 ! 457  444  
assign (resid 49 and name HG2#) (resid 49 and name HN) 2.7 0.9 1.7 ! 458  
assign (resid 49 and name HG1#) (resid 49 and name HN) 5.0 3.2 1.7 ! 459  
assign (resid 49 and name HB*) (resid 49 and name HN) 2.7 0.9 0.2 ! 460  
assign (resid 49 and name HA) (resid 49 and name HN) 3.3 1.5 0.2 ! 461  
assign (resid 48 and name HA) (resid 49 and name HN) 2.7 0.9 0.2 ! 462  
assign (resid 49 and name HN) (resid 50 and name HN) 5.0 3.2 0.4 ! 469  
assign (resid 50 and name HB2) (resid 50 and name HN) 2.7 0.9 0.2 ! 471
assign (resid 50 and name HB1) (resid 50 and name HN) 3.3 1.8 0.2       ! 470
assign (resid 50 and name HA) (resid 50 and name HN) 3.3 1.5 0.2 ! 472  
assign (resid 49 and name HB*) (resid 50 and name HN) 5.0 3.2 0.2 ! 473  
assign (resid 49 and name HG1#) (resid 50 and name HN) 3.3 1.5 1.7 ! 475  474  
assign (resid 49 and name HA) (resid 50 and name HN) 2.7 0.9 0.2 ! 476  
assign (resid 39 and name HN) (resid 51 and name HN) 3.3 1.5 0.4 ! 477  319  
assign (resid 40 and name HD#) (resid 51 and name HN) 5.0 3.2 1.7 ! 481  480  
assign (resid 39 and name HG1#) (resid 51 and name HN) 5.0 3.2 1.7 ! 482  
assign (resid 51 and name HG2#) (resid 51 and name HN) 2.7 0.9 1.7 ! 483  
assign (resid 50 and name HN) (resid 51 and name HN) 5.0 3.2 0.4 ! 484  
assign (resid 51 and name HA) (resid 51 and name HN) 3.3 1.5 0.2 ! 486  
assign (resid 51 and name HB*) (resid 51 and name HN) 5.0 3.2 0.2 ! 488  
assign (resid 50 and name HB1) (resid 51 and name HN) 5.0 3.2 0.2      ! 485
assign (resid 52 and name HD#) (resid 52 and name HN) 3.3 1.5 2.2 ! 490  
assign (resid 14 and name HB*) (resid 52 and name HN) 5.0 3.2 1.2 ! 493  492  
assign (resid 51 and name HG2#) (resid 52 and name HN) 3.3 1.5 1.7 ! 495  
assign (resid 52 and name HB*) (resid 52 and name HN) 2.7 0.9 1.2 ! 497  496  
assign (resid 52 and name HA) (resid 52 and name HN) 2.7 0.9 0.2 ! 498  
assign (resid 51 and name HA) (resid 52 and name HN) 2.7 0.9 0.2 ! 499  
assign (resid 51 and name HB*) (resid 52 and name HN) 2.7 0.9 0.2 ! 500  
assign (resid 53 and name HD#) (resid 52 and name HN) 5.0 3.2 1.7 ! 501  
assign (resid 54 and name HG#) (resid 54 and name HN) 2.7 0.9 1.7 ! 505  
assign (resid 54 and name HB*) (resid 54 and name HN) 2.7 0.9 1.2 ! 507  506  
assign (resid 54 and name HA) (resid 54 and name HN) 3.3 1.5 0.2 ! 508  
assign (resid 52 and name HB*) (resid 54 and name HN) 5.0 3.2 1.2 ! 510  509  
assign (resid 52 and name HA) (resid 54 and name HN) 5.0 3.2 0.2 ! 511  
assign (resid 53 and name HD#) (resid 54 and name HN) 5.0 3.2 1.7 ! 513  512  
assign (resid 53 and name HA) (resid 54 and name HN) 5.0 3.2 0.2 ! 514  
assign (resid 58 and name HG2#) (resid 55 and name HN) 5.0 3.2 1.7 ! 515  
assign (resid 58 and name HN) (resid 55 and name HN) 5.0 3.2 0.4 ! 517  
assign (resid 54 and name HB*) (resid 55 and name HN) 5.0 3.2 1.2 ! 518  
assign (resid 54 and name HN) (resid 55 and name HN) 2.7 0.9 0.4 ! 521  504  
assign (resid 55 and name HA) (resid 55 and name HN) 2.7 0.9 0.2 ! 523  
assign (resid 52 and name HB*) (resid 55 and name HN) 5.0 3.2 1.2 ! 525  524  
assign (resid 53 and name HA) (resid 55 and name HN) 5.0 3.2 0.2 ! 526  
assign (resid 55 and name HN) (resid 56 and name HN) 5.0 3.2 0.4 ! 528  
assign (resid 55 and name HA) (resid 56 and name HN) 2.7 0.9 0.2 ! 530  
assign (resid 56 and name HA) (resid 56 and name HN) 5.0 3.2 0.2 ! 534  
assign (resid 57 and name HE1) (resid 57 and name HN) 5.0 3.2 2.2 ! 535  
assign (resid 57 and name HD#) (resid 57 and name HN) 2.7 0.9 2.2 ! 539  
assign (resid 57 and name HD#) (resid 57 and name HE1) 2.7 0.9 4.0 ! 541  
assign (resid 57 and name HZ2) (resid 57 and name HE1) 2.7 0.9 4.0 ! 542  
assign (resid 57 and name HB*) (resid 57 and name HE1) 5.0 3.2 3.0 ! 543  
assign (resid 58 and name HG2#) (resid 57 and name HE1) 5.0 3.2 3.5 ! 549  
assign (resid 56 and name HN) (resid 57 and name HN) 5.0 3.2 0.4 ! 550  527  
assign (resid 57 and name HB*) (resid 57 and name HN) 2.7 0.9 1.2 ! 551  
assign (resid 56 and name HA) (resid 57 and name HN) 5.0 3.2 0.2 ! 553  
assign (resid 58 and name HG2#) (resid 57 and name HN) 5.0 3.2 1.7 ! 554  
assign (resid 57 and name HD#) (resid 58 and name HN) 5.0 3.2 2.2 ! 556  
assign (resid 57 and name HB*) (resid 58 and name HN) 5.0 3.2 1.2 ! 560  
assign (resid 57 and name HE3) (resid 58 and name HN) 5.0 3.2 2.2 ! 561  
assign (resid 58 and name HG2#) (resid 58 and name HN) 2.7 0.9 1.7 ! 564  
assign (resid 58 and name HG1#) (resid 58 and name HN) 5.0 3.2 1.7 ! 565  
assign (resid 58 and name HB*) (resid 58 and name HN) 2.7 0.9 0.2 ! 566  
assign (resid 58 and name HA) (resid 58 and name HN) 5.0 3.2 0.2 ! 567  
assign (resid 56 and name HA) (resid 58 and name HN) 5.0 3.2 0.2 ! 568  
assign (resid 57 and name HA) (resid 58 and name HN) 5.0 3.2 0.2 ! 569  
assign (resid 60 and name HA) (resid 59 and name HN) 5.0 3.2 0.2 ! 571  
assign (resid 57 and name HN) (resid 59 and name HN) 5.0 3.2 0.4 ! 573  540  
assign (resid 58 and name HN) (resid 59 and name HN) 2.7 0.9 0.4 ! 574  563  
assign (resid 59 and name HG#) (resid 59 and name HN) 2.7 0.9 1.7 ! 577  576  
assign (resid 59 and name HB*) (resid 59 and name HN) 2.7 0.9 1.2 ! 579  578  
assign (resid 59 and name HA) (resid 59 and name HN) 2.7 0.9 0.2 ! 580  
assign (resid 58 and name HB*) (resid 59 and name HN) 2.7 0.9 0.2 ! 581  
assign (resid 57 and name HA) (resid 59 and name HN) 5.0 3.2 0.2 ! 583  
assign (resid 58 and name HA) (resid 59 and name HN) 5.0 3.2 0.2 ! 585  584  
assign (resid 58 and name HG2#) (resid 59 and name HN) 5.0 3.2 1.7 ! 586  
assign (resid 58 and name HG1#) (resid 59 and name HN) 3.3 1.5 1.7 ! 587  
assign (resid 61 and name HD#) (resid 60 and name HN) 5.0 3.2 2.2 ! 588  
assign (resid 59 and name HN) (resid 60 and name HN) 2.7 0.9 0.4 ! 589  575  
assign (resid 60 and name HG#) (resid 60 and name HN) 3.3 1.5 1.7 ! 591  
assign (resid 60 and name HB*) (resid 60 and name HN) 2.7 0.9 1.2 ! 593  592  
assign (resid 60 and name HA) (resid 60 and name HN) 2.7 0.9 0.2 ! 594  
assign (resid 59 and name HA) (resid 60 and name HN) 5.0 3.2 0.2 ! 596  
assign (resid 57 and name HA) (resid 60 and name HN) 3.3 1.5 0.2 ! 598  
assign (resid 60 and name HB*) (resid 61 and name HN) 2.7 0.9 1.2 ! 604  603  
assign (resid 61 and name HB2) (resid 61 and name HN) 2.7 0.9 0.2      ! 606
assign (resid 61 and name HB1) (resid 61 and name HN) 5.0 3.2 0.2      ! 599
assign (resid 61 and name HA) (resid 61 and name HN) 2.7 0.9 0.2 ! 607  
assign (resid 58 and name HB*) (resid 61 and name HN) 5.0 3.2 0.2 ! 608  
assign (resid 57 and name HA) (resid 61 and name HN) 5.0 3.2 0.2 ! 609  
assign (resid 60 and name HA) (resid 61 and name HN) 5.0 3.2 0.2 ! 610  
assign (resid 58 and name HA) (resid 61 and name HN) 5.0 3.2 0.2 ! 611  
assign (resid 61 and name HD#) (resid 62 and name HN) 5.0 3.2 2.2 ! 612  
assign (resid 61 and name HN) (resid 62 and name HN) 2.7 0.9 0.4 ! 617  
assign (resid 62 and name HG1#) (resid 62 and name HN) 2.7 0.9 1.7 ! 618  
assign (resid 62 and name HG2#) (resid 62 and name HN) 2.7 0.9 1.7 ! 619  
assign (resid 62 and name HA) (resid 62 and name HN) 2.7 0.9 0.2 ! 621  
assign (resid 59 and name HA) (resid 62 and name HN) 3.3 1.5 0.2 ! 622  
assign (resid 58 and name HA) (resid 62 and name HN) 5.0 3.2 0.2 ! 623  
assign (resid 61 and name HA) (resid 62 and name HN) 3.3 1.5 0.2 ! 624  
assign (resid 61 and name HN) (resid 63 and name HN) 5.0 3.2 0.4 ! 625  
assign (resid 62 and name HN) (resid 63 and name HN) 2.7 0.9 0.4 ! 626  616  
assign (resid 62 and name HA) (resid 63 and name HN) 5.0 3.2 0.2 ! 628  
assign (resid 62 and name HG2#) (resid 63 and name HN) 3.3 1.5 1.7 ! 633  
assign (resid 62 and name HG1#) (resid 63 and name HN) 5.0 3.2 1.7 ! 634  
assign (resid 63 and name HB*) (resid 63 and name HN) 2.7 0.9 1.2 ! 635  
assign (resid 63 and name HA) (resid 63 and name HN) 2.7 0.9 0.2 ! 636  
assign (resid 59 and name HA) (resid 63 and name HN) 5.0 3.2 0.2 ! 637  
assign (resid 61 and name HA) (resid 63 and name HN) 5.0 3.2 0.2 ! 638  
assign (resid 21 and name HH2) (resid 64 and name HN) 5.0 3.2 2.2 ! 639  
assign (resid 21 and name HZ3) (resid 64 and name HN) 5.0 3.2 2.2 ! 640  
assign (resid 64 and name HD1#) (resid 64 and name HN) 5.0 3.2 1.7 ! 644  
assign (resid 64 and name HD2#) (resid 64 and name HN) 5.0 3.2 1.7 ! 646  
assign (resid 64 and name HG#) (resid 64 and name HN) 2.7 0.9 1.7 ! 648  
assign (resid 64 and name HB2) (resid 64 and name HN) 2.7 0.9 0.2      ! 649
assign (resid 64 and name HB1) (resid 64 and name HN) 5.0 3.3 0.2      ! 647
assign (resid 61 and name HA) (resid 64 and name HN) 3.3 1.5 0.2 ! 651  
assign (resid 63 and name HB*) (resid 64 and name HN) 3.3 1.5 1.2 ! 652  
assign (resid 21 and name HH2) (resid 65 and name HN) 5.0 3.2 2.2 ! 653  
assign (resid 27 and name HD#) (resid 65 and name HN) 5.0 3.2 2.2 ! 654  
assign (resid 64 and name HB2) (resid 65 and name HN) 3.3 1.5 0.2      ! 656
assign (resid 64 and name HB1) (resid 65 and name HN) 5.0 3.2 0.2      ! 658
assign (resid 65 and name HG#) (resid 65 and name HN) 2.7 0.9 1.7 ! 655  
assign (resid 65 and name HD1#) (resid 65 and name HN) 3.3 1.5 1.7 ! 659
assign (resid 65 and name HD2#) (resid 65 and name HN) 5.0 3.2 1.7 ! 660  
assign (resid 64 and name HN) (resid 65 and name HN) 2.7 0.9 0.4 ! 662  645  
assign (resid 65 and name HB*) (resid 65 and name HN) 2.7 0.9 1.2 ! 664  663  
assign (resid 65 and name HA) (resid 65 and name HN) 2.7 0.9 0.2 ! 665  
assign (resid 61 and name HA) (resid 65 and name HN) 3.3 1.5 0.2 ! 666  
assign (resid 63 and name HB*) (resid 65 and name HN) 5.0 3.2 1.2 ! 667  
assign (resid 27 and name HE#) (resid 66 and name HN) 5.0 3.2 2.2 ! 672  
assign (resid 65 and name HA) (resid 66 and name HN) 3.3 1.5 0.2 ! 675  
assign (resid 27 and name HE#) (resid 67 and name HN) 5.0 3.2 2.2 ! 677  
assign (resid 67 and name HG2#) (resid 67 and name HN) 5.0 3.2 1.7 ! 679  
assign (resid 67 and name HB*) (resid 67 and name HN) 2.7 0.9 0.2 ! 680  
assign (resid 67 and name HA) (resid 67 and name HN) 2.7 0.9 0.2 ! 681  
assign (resid 69 and name HG#) (resid 69 and name HN) 5.0 3.2 1.7 ! 682  
assign (resid 69 and name HB*) (resid 69 and name HN) 2.7 0.9 1.2 ! 683  
assign (resid 69 and name HA) (resid 69 and name HN) 2.7 0.9 0.2 ! 684  
assign (resid 70 and name HB*) (resid 70 and name HN) 5.0 3.2 1.2 ! 689  688  
assign (resid 71 and name HB*) (resid 71 and name HN) 5.0 3.2 1.2 ! 691  
assign (resid 71 and name HA) (resid 71 and name HN) 5.0 3.2 0.2 ! 692  
assign (resid 58 and name HN) (resid 57 and name HN) 3.3 1.5 0.4 ! 693  562  
assign (resid 61 and name HD#) (resid 61 and name HN) 2.7 0.9 2.2 ! 694  
assign (resid 59 and name HN) (resid 61 and name HN) 5.0 3.2 0.4 ! 695  570  
assign (resid 57 and name HZ2) (resid 61 and name HN) 5.0 3.2 2.2 ! 696  
assign (resid 60 and name HN) (resid 61 and name HN) 2.7 0.9 0.4 ! 698  590  
assign (resid 52 and name HN) (resid 51 and name HN) 5.0 3.2 0.4 ! 702  
assign (resid 23 and name HN) (resid 21 and name HN) 5.0 3.2 0.4 ! 706  140  
assign (resid 27 and name HD#) (resid 40 and name HN) 5.0 3.2 2.2 ! 707  
assign (resid 47 and name HN) (resid 48 and name HN) 5.0 3.2 0.4 ! 716  430  
assign (resid 61 and name HN) (resid 64 and name HN) 5.0 3.2 0.4 ! 717  697  
assign (resid 25 and name HN) (resid 43 and name HN) 5.0 3.2 0.4 ! 724  176  
assign (resid 28 and name HN) (resid 42 and name HN) 5.0 3.2 0.4 ! 725  216  
assign (resid 44 and name HN) (resid 23 and name HN) 5.0 3.2 0.4 ! 729  
assign (resid 23 and name HE1) (resid 23 and name HN) 5.0 3.2 2.2 ! 731  
assign (resid 10 and name HN) (resid 11 and name HN) 5.0 3.2 0.4 ! 732  
assign (resid 41 and name HD#) (resid 26 and name HN) 5.0 3.2 2.2 ! 747  
assign (resid 43 and name HN) (resid 26 and name HN) 5.0 3.2 0.4 ! 748  
assign (resid 31 and name HN) (resid 30 and name HN) 5.0 3.2 0.4 ! 750  
assign (resid 3 and name HA*) (resid 3 and name HN) 5.0 3.2 1.2 ! 751  
assign (resid 2 and name HA) (resid 3 and name HN) 5.0 3.2 0.2 ! 752  
assign (resid 50 and name HN) (resid 15 and name HN) 5.0 3.2 0.4 ! 757  463  
assign (resid 57 and name HE1) (resid 58 and name HN) 5.0 3.2 2.2 ! 758  
assign (resid 58 and name HN) (resid 60 and name HN) 5.0 3.2 0.4 ! 759  555  
assign (resid 28 and name HN) (resid 27 and name HN) 5.0 3.2 0.4  ! 762  222  
assign (resid 40 and name HD#) (resid 39 and name HN) 5.0 3.2 1.7 ! 764  
assign (resid 14 and name HE#) (resid 14 and name HN) 5.0 3.2 2.2 ! 769  
assign (resid 45 and name HA) (resid 46 and name HN) 3.3 1.5 0.2 ! 774  
assign (resid 4 and name HB*) (resid 5 and name HN) 5.0 3.2 1.2 ! 775  
assign (resid 57 and name HE3) (resid 57 and name HN) 5.0 3.2 2.2 ! 776  
assign (resid 41 and name HD#) (resid 27 and name HN) 5.0 3.2 2.2 ! 778  
assign (resid 42 and name HA) (resid 49 and name HN) 2.7 0.9 0.2 ! 779  
assign (resid 16 and name HA) (resid 17 and name HN) 3.3 1.5 0.2 ! 88  
assign (resid 18 and name HD#) (resid 17 and name HN) 5.0 3.2 1.7 ! 90  
assign (resid 16 and name HB*) (resid 17 and name HN) 5.0 3.2 1.2 ! 92  91  
assign (resid 57 and name HZ2) (resid 19 and name HN) 5.0 3.2 2.2 ! 98  
assign (resid 57 and name HH2) (resid 19 and name HN) 3.3 1.5 2.2 ! 99  
assign (resid 57 and name HZ3) (resid 19 and name HN) 5.0 3.2 2.2 ! 101  
assign (resid 57 and name HE3) (resid 19 and name HN) 5.0 3.2 2.2 ! 102  
assign (resid 20 and name HB*) (resid 23 and name HE1) 5.0 3.2 3.0 ! 143  
assign (resid 20 and name HG#) (resid 23 and name HE1) 5.0 3.2 3.5 ! 144  
assign (resid 44 and name HA) (resid 25 and name HN) 5.0 3.2 0.2 ! 171  
assign (resid 43 and name HB*) (resid 25 and name HN) 5.0 3.2 0.2 ! 173  
assign (resid 24 and name HA) (resid 25 and name HN) 2.7 0.9 0.2 ! 186  
assign (resid 58 and name HG1#) (resid 61 and name HN) 5.0 3.2 1.7 ! 600  
assign (resid 62 and name HG1#) (resid 61 and name HN) 5.0 3.2 1.7 ! 602  
assign (resid 60 and name HG#) (resid 61 and name HN) 3.3 1.5 1.7 ! 605  
assign (resid 59 and name HB*) (resid 62 and name HN) 5.0 3.2 1.2 ! 615  
assign (resid 60 and name HB*) (resid 63 and name HN) 5.0 3.2 1.2 ! 630  629  
assign (resid 64 and name HG#) (resid 65 and name HN) 5.0 3.2 1.7 ! 657  
assign (resid 64 and name HD1#) (resid 65 and name HN) 5.0 3.2 1.7 ! 661  
assign (resid 65 and name HD2#) (resid 66 and name HN) 5.0 3.2 1.7 ! 668  
assign (resid 66 and name HB*) (resid 66 and name HN) 2.7 0.9 1.2 ! 670  669  
assign (resid 66 and name HA) (resid 66 and name HN) 2.7 0.9 0.2 ! 673  
assign (resid 63 and name HA) (resid 66 and name HN) 5.0 3.2 0.2 ! 674  
assign (resid 60 and name HN) (resid 58 and name HA) 5.0 3.2 0.2 ! 780  
assign (resid 58 and name HG1#) (resid 62 and name HN) 5.0 3.2 1.7 ! 781  
assign (resid 15 and name HB*) (resid 17 and name HN) 5.0 3.2 1.2 ! 783  
assign (resid 50 and name HB2) (resid 15 and name HN) 5.0 3.2 0.2      ! 79
assign (resid 24 and name HG2#) (resid 23 and name HN) 3.3 1.5 1.7 ! 139  
assign (resid 43 and name HB*) (resid 25 and name HN) 5.0 3.2 1.2 ! 173  
assign (resid 28 and name HG#) (resid 27 and name HN) 5.0 3.2 1.7 ! 206  
assign (resid 40 and name HD#) (resid 28 and name HN) 5.0 3.2 1.7 ! 215  
assign (resid 40 and name HB*) (resid 28 and name HN) 3.3 1.5 0.2 ! 214  
assign (resid 38 and name HB*) (resid 30 and name HN) 5.0 3.2 1.2 ! 245  
assign (resid 36 and name HG#) (resid 36 and name HN) 3.3 1.5 1.7 ! 294  
assign (resid 34 and name HB*) (resid 36 and name HN) 2.7 0.9 1.2 ! 293  302  
assign (resid 29 and name HA) (resid 38 and name HN) 5.0 3.2 0.2 ! 768  
assign (resid 42 and name HG2#) (resid 41 and name HN) 5.0 3.2 1.7 ! 347  
assign (resid 27 and name HA) (resid 42 and name HN) 3.3 1.5 0.2 ! 728  
assign (resid 43 and name HG2#) (resid 42 and name HN) 5.0 3.2 1.7 ! 359  
assign (resid 48 and name HB*) (resid 43 and name HN) 5.0 3.2 1.2 ! 373  
assign (resid 23 and name HA) (resid 44 and name HN) 3.3 1.5 0.2 ! 786  
assign (resid 43 and name HA) (resid 44 and name HN) 2.7 0.9 0.2 ! 389  
assign (resid 40 and name HD#) (resid 50 and name HN) 5.0 3.2 1.7 ! 467  
assign (resid 14 and name HA) (resid 50 and name HN) 5.0 3.2 0.2 ! 465  
assign (resid 56 and name HB*) (resid 56 and name HN) 3.3 1.5 1.2 ! 531  
assign (resid 56 and name HB*) (resid 58 and name HN) 5.0 3.2 1.2 ! 558  
assign (resid 6 and name HG1#) (resid 6 and name HN) 5.0 3.2 1.7 ! 6  
assign (resid 6 and name HD#) (resid 6 and name HN) 5.0 3.2 1.7 ! 7  
assign (resid 6 and name HB*) (resid 7 and name HN) 5.0 3.2 0.2 ! 11  
assign (resid 6 and name HD#) (resid 7 and name HN) 5.0 3.2 1.7 ! 12  
assign (resid 8 and name HB*) (resid 9 and name HN) 5.0 3.2 1.2 ! 26  
assign (resid 8 and name HG#) (resid 9 and name HN) 5.0 3.2 1.7 ! 27  
assign (resid 38 and name HB*) (resid 11 and name HN) 5.0 3.2 1.2 ! 40  
assign (resid 30 and name HG2#) (resid 11 and name HN) 3.3 1.5 1.7 ! 42  
assign (resid 11 and name HB*) (resid 12 and name HN) 5.0 3.2 1.2 ! 50  
assign (resid 50 and name HB*) (resid 13 and name HN) 5.0 3.2 1.2 ! 57  
assign (resid 13 and name HG#) (resid 14 and name HN) 5.0 3.2 1.7 ! 72  
assign (resid 13 and name HB*) (resid 14 and name HN) 3.3 1.5 1.2 ! 74  73  
assign (resid 51 and name HG2#) (resid 15 and name HN) 5.0 3.2 1.7 ! 82  
assign (resid 49 and name HG1#) (resid 15 and name HN) 5.0 3.2 1.7 ! 83  
assign (resid 64 and name HD1#) (resid 21 and name HE1) 5.0 3.2 3.5 ! 112  
assign (resid 61 and name HE#) (resid 21 and name HN) 5.0 3.2 2.2 ! 114  
assign (resid 24 and name HG2#) (resid 21 and name HN) 5.0 3.2 1.7 ! 116  
assign (resid 48 and name HD#) (resid 43 and name HN) 5.0 3.2 1.7 ! 372  
assign (resid 44 and name HB*) (resid 45 and name HN) 5.0 3.2 1.2 ! 398  397  
assign (resid 43 and name HG2#) (resid 45 and name HN) 5.0 3.2 1.7 ! 399  
assign (resid 44 and name HG#) (resid 45 and name HN) 5.0 3.2 1.7 ! 400  
assign (resid 45 and name HG#) (resid 45 and name HN) 5.0 3.2 1.7 ! 410  
assign (resid 62 and name HA) (resid 65 and name HN) 5.0 3.2 0.2 ! 2398  
assign (resid 59 and name HN) (resid 59 and name HE2#) 5.0 3.2 1.7 ! 2402  
assign (resid 60 and name HA) (resid 63 and name HN) 5.0 3.2 0.2 ! 2408  
assign (resid 57 and name HA) (resid 57 and name HN) 3.3 1.5 0.2 ! 2413  
assign (resid 56 and name HA) (resid 59 and name HN) 3.3 1.5 0.2 ! 2421  
assign (resid 56 and name HA) (resid 60 and name HN) 5.0 3.2 0.2 ! 2423  
assign (resid 43 and name HA) (resid 43 and name HN) 3.3 1.5 0.2 ! 2428  
assign (resid 21 and name HA) (resid 21 and name HN) 3.3 1.5 0.2 ! 2436  
assign (resid 42 and name HA) (resid 42 and name HN) 5.0 3.2 0.2 ! 2495  
assign (resid 48 and name HB*) (resid 48 and name HN) 5.0 3.2 1.2 ! 2508  2506  
assign (resid 28 and name HB*) (resid 29 and name HN) 5.0 3.2 1.2 ! 2513  2512  
assign (resid 59 and name HG#) (resid 59 and name HE2#) 5.0 3.2 3.0 ! 2520  2517  2515  2514  
assign (resid 27 and name HA) (resid 40 and name HN) 5.0 3.2 0.2 ! 2585  
assign (resid 40 and name HD#) (resid 41 and name HN) 5.0 3.2 1.7 ! 2610  
assign (resid 28 and name HG#) (resid 28 and name HN) 5.0 3.2 1.7 ! 2612  2611  
assign (resid 28 and name HG#) (resid 29 and name HN) 5.0 3.2 1.7 ! 2614  2613  
assign (resid 24 and name HG1#) (resid 25 and name HN) 3.3 1.5 1.7 ! 2616  
assign (resid 43 and name HG#) (resid 25 and name HN) 5.0 3.2 1.7 ! 2619  
assign (resid 46 and name HA*) (resid 43 and name HN) 5.0 3.2 1.2 ! 2628  
assign (resid 30 and name HN) (resid 38 and name O) 2.3 0.6 0.0
assign (resid 61 and name HN) (resid 57 and name O) 2.3 0.6 0.0
assign (resid 65 and name HN) (resid 61 and name O) 2.3 0.6 0.0
assign (resid 25 and name HN) (resid 42 and name O) 2.3 0.6 0.0
assign (resid 62 and name HN) (resid 58 and name O) 2.3 0.6 0.0
assign (resid 28 and name HN) (resid 40 and name O) 2.3 0.6 0.0
assign (resid 39 and name HN) (resid 51 and name O) 2.3 0.6 0.0
assign (resid 42 and name HN) (resid 26 and name O) 2.3 0.6 0.0
assign (resid 26 and name HN) (resid 42 and name O) 2.3 0.6 0.0
assign (resid 40 and name HN) (resid 28 and name O) 2.3 0.6 0.0
assign (resid 41 and name HN) (resid 49 and name O) 2.3 0.6 0.0
assign (resid 49 and name HN) (resid 41 and name O) 2.3 0.6 0.0
assign (resid 58 and name HN) (resid 55 and name O) 2.3 0.6 0.0
assign (resid 23 and name HN) (resid 20 and name O) 2.3 0.6 0.0
assign (resid 24 and name HN) (resid 21 and name O) 2.3 0.6 0.0
assign (resid 63 and name HN) (resid 59 and name O) 2.3 0.6 0.0
assign (resid 64 and name HN) (resid 60 and name O) 2.3 0.6 0.0
restraints
  dihedral
      reset
assign (resid  2  and name c ) (resid  3  and name n )
  (resid  3   and name ca) (resid  3   and name c )   1.0 -120.0 60.0 2  ! 7.894
assign (resid  3  and name c ) (resid  4  and name n )
  (resid  4   and name ca) (resid  4   and name c )   1.0 -120.0 60.0 2  ! 7.325
assign (resid  4  and name c ) (resid  5  and name n )
  (resid  5   and name ca) (resid  5   and name c )   1.0 -120.0 60.0 2  ! 7.331
assign (resid  5  and name c ) (resid  6  and name n )
  (resid  6   and name ca) (resid  6   and name c )   1.0 -120.0 60.0 2  ! 7.381
assign (resid  6  and name c ) (resid  7  and name n )
  (resid  7   and name ca) (resid  7   and name c )   1.0 -100.0 80.0 2  ! *6.909
assign (resid  7  and name c ) (resid  8  and name n )
  (resid  8   and name ca) (resid  8   and name c )   1.0 -120.0 60.0 2  ! 7.762
assign (resid  8  and name c ) (resid  9  and name n )
  (resid  9   and name ca) (resid  9   and name c )   1.0 -120.0 50.0 2  ! 8.962
assign (resid  10  and name c ) (resid  11  and name n )
  (resid  11   and name ca) (resid  11   and name c )   1.0 -120.0 40.0 2  ! 9.221
assign (resid  11  and name c ) (resid  12  and name n )
  (resid  12   and name ca) (resid  12   and name c )   1.0 -120.0 40.0 2  ! 9.565
assign (resid  12  and name c ) (resid  13  and name n )
  (resid  13   and name ca) (resid  13   and name c )   1.0 -120.0 50.0 2  ! 8.633
assign (resid  13  and name c ) (resid  14  and name n )
  (resid  14   and name ca) (resid  14   and name c )   1.0 -120.0 40.0 2  ! 9.307
assign (resid  14  and name c ) (resid  15  and name n )
  (resid  15   and name ca) (resid  15   and name c )   1.0 -120.0 60.0 2  ! 7.156
assign (resid  16  and name c ) (resid  17  and name n )
  (resid  17   and name ca) (resid  17   and name c )   1.0 -120.0 60.0 2  ! 7.935
assign (resid  18  and name c ) (resid  19  and name n )
  (resid  19   and name ca) (resid  19   and name c )   1.0 -120.0 50.0 2  ! 8.098
assign (resid  20  and name c ) (resid  21  and name n )
  (resid  21   and name ca) (resid  21   and name c )   1.0 -60.0 30.0 2  ! 2.530
assign (resid  21  and name c ) (resid  22  and name n )
  (resid  22   and name ca) (resid  22   and name c )   1.0 -60.0 30.0 2  ! 5.061
assign (resid  22  and name c ) (resid  23  and name n )
  (resid  23   and name ca) (resid  23   and name c )   1.0 -120.0 50.0 2  ! 8.374
assign (resid  24  and name c ) (resid  25  and name n )
  (resid  25   and name ca) (resid  25   and name c )   1.0 -120.0 40.0 2  ! 9.940
assign (resid  25  and name c ) (resid  26  and name n )
  (resid  26   and name ca) (resid  26   and name c )   1.0 -120.0 60.0 2  ! 7.093
assign (resid  26  and name c ) (resid  27  and name n )
  (resid  27   and name ca) (resid  27   and name c )   1.0 -120.0 50.0 2  ! 8.899
assign (resid  27  and name c ) (resid  28  and name n )
  (resid  28   and name ca) (resid  28   and name c )   1.0 -120.0 60.0 2  ! 7.484
assign (resid  28  and name c ) (resid  29  and name n )
  (resid  29   and name ca) (resid  29   and name c )   1.0 -120.0 40.0 2  ! 9.078
assign (resid  29  and name c ) (resid  30  and name n )
  (resid  30   and name ca) (resid  30   and name c )   1.0 -100.0 80.0 2  ! *T30 5.921
assign (resid  30  and name c ) (resid  31  and name n )
  (resid  31   and name ca) (resid  31   and name c )   1.0 -60.0 30.0 2  ! 3.534
assign (resid  31  and name c ) (resid  32  and name n )
  (resid  32   and name ca) (resid  32   and name c )   1.0 -60.0 30.0 2  ! 4.374
assign (resid  32  and name c ) (resid  33  and name n )
  (resid  33   and name ca) (resid  33   and name c )   1.0 -120.0 60.0 2  ! 7.430
assign (resid  34  and name c ) (resid  35  and name n )
  (resid  35   and name ca) (resid  35   and name c )   1.0 -60.0 30.0 2  ! 4.376
assign (resid  35  and name c ) (resid  36  and name n )
  (resid  36   and name ca) (resid  36   and name c )   1.0 -120.0 40.0 2  ! 9.442
assign (resid  36  and name c ) (resid  37  and name n )
  (resid  37   and name ca) (resid  37   and name c )   1.0 -100.0 80.0 2  !*R37 6.920
assign (resid  37  and name c ) (resid  38  and name n )
  (resid  38   and name ca) (resid  38   and name c )   1.0 -120.0 50.0 2  ! 8.773
assign (resid  38  and name c ) (resid  39  and name n )
  (resid  39   and name ca) (resid  39   and name c )   1.0 -120.0 40.0 2  ! 9.919
assign (resid  39  and name c ) (resid  40  and name n )
  (resid  40   and name ca) (resid  40   and name c )   1.0 -120.0 40.0 2  ! 10.079
assign (resid  40  and name c ) (resid  41  and name n )
  (resid  41   and name ca) (resid  41   and name c )   1.0 -120.0 40.0 2  ! 9.776
assign (resid  41  and name c ) (resid  42  and name n )
  (resid  42   and name ca) (resid  42   and name c )   1.0 -120.0 40.0 2  ! 10.234
assign (resid  42  and name c ) (resid  43  and name n )
  (resid  43   and name ca) (resid  43   and name c )   1.0 -120.0 50.0 2  ! 8.473
assign (resid  43  and name c ) (resid  44  and name n )
  (resid  44   and name ca) (resid  44   and name c )   1.0 -60.0 30.0 2  ! 3.636
assign (resid  44  and name c ) (resid  45  and name n )
  (resid  45   and name ca) (resid  45   and name c )   1.0 -120.0 40.0 2  ! 9.366
assign (resid  47  and name c ) (resid  48  and name n )
  (resid  48   and name ca) (resid  48   and name c )   1.0 -120.0 40.0 2  ! 9.088
assign (resid  48  and name c ) (resid  49  and name n )
  (resid  49   and name ca) (resid  49   and name c )   1.0 -120.0 40.0 2  ! 10.067
assign (resid  49  and name c ) (resid  50  and name n )
  (resid  50   and name ca) (resid  50   and name c )   1.0 -120.0 60.0 2  ! 7.563
assign (resid  50  and name c ) (resid  51  and name n )
  (resid  51   and name ca) (resid  51   and name c )   1.0 -120.0 40.0 2  ! 9.832
assign (resid  51  and name c ) (resid  52  and name n )
  (resid  52   and name ca) (resid  52   and name c )   1.0 -100.0 80.0 2  ! *H52 6.976
assign (resid  53  and name c ) (resid  54  and name n )
  (resid  54   and name ca) (resid  54   and name c )   1.0 -120.0 60.0 2  ! 7.722
assign (resid  55  and name c ) (resid  56  and name n )
  (resid  56   and name ca) (resid  56   and name c )   1.0 -60.0 30.0 2  ! 2.830
assign (resid  56  and name c ) (resid  57  and name n )
  (resid  57   and name ca) (resid  57   and name c )   1.0 -60.0 30.0 2  ! 4.067
assign (resid  58  and name c ) (resid  59  and name n )
  (resid  59   and name ca) (resid  59   and name c )   1.0 -60.0 30.0 2  ! 4.781
assign (resid  60  and name c ) (resid  61  and name n )
  (resid  61   and name ca) (resid  61   and name c )   1.0 -60.0 30.0 2  ! 4.447
assign (resid  61  and name c ) (resid  62  and name n )
  (resid  62   and name ca) (resid  62   and name c )   1.0 -60.0 30.0 2  ! 4.477
assign (resid  62  and name c ) (resid  63  and name n )
  (resid  63   and name ca) (resid  63   and name c )   1.0 -60.0 30.0 2  ! 4.784
assign (resid  66  and name c ) (resid  67  and name n )
  (resid  67   and name ca) (resid  67   and name c )   1.0 -120.0 60.0 2  ! 7.653
assign (resid  68  and name c ) (resid  69  and name n )
  (resid  69   and name ca) (resid  69   and name c )   1.0 -120.0 60.0 2  ! 7.104
assign (resid  69  and name c ) (resid  70  and name n )
  (resid  70   and name ca) (resid  70   and name c )   1.0 -120.0 60.0 2  ! 7.778
assign (resid  70  and name c ) (resid  71  and name n )
  (resid  71   and name ca) (resid  71   and name c )   1.0 -120.0 50.0 2  ! 8.292
assign (resid  26  and name n ) (resid  26  and name ca)
        (resid  26  and name cb) (resid  26  and name og) 1.0 60 60.0 2
 assign (resid  28  and name n ) (resid  28  and name ca)
        (resid  28  and name cb) (resid  28  and name cg) 1.0 60 60.0 2
 assign (resid  10  and name n ) (resid  10  and name ca)
        (resid  10  and name cb) (resid  10  and name sg) 1.0 -60 60.0 2
 assign (resid  14  and name n ) (resid  14  and name ca)
        (resid  14  and name cb) (resid  14  and name cg) 1.0 -120 120.0 2
 assign (resid  23  and name n ) (resid  23  and name ca)
        (resid  23  and name cb) (resid  23  and name cg) 1.0 -120 120.0 2
 assign (resid  29  and name n ) (resid  29  and name ca)
        (resid  29  and name cb) (resid  29  and name cg) 1.0 -120 120.0 2
 assign (resid  41  and name n ) (resid  41  and name ca)
        (resid  41  and name cb) (resid  41  and name cg) 1.0 -120 120.0 2
 assign (resid  48  and name n ) (resid  48  and name ca)
        (resid  48  and name cb) (resid  48  and name cg) 1.0 -120 120.0 2
 assign (resid  64  and name n ) (resid  64  and name ca)
        (resid  64  and name cb) (resid  64  and name cg) 1.0 -60 60.0 2
 assign (resid  61  and name n ) (resid  61  and name ca)
        (resid  61  and name cb) (resid  61  and name cg) 1.0 -60 60.0 2
 assign (resid  44  and name n ) (resid  44  and name ca)
        (resid  44  and name cb) (resid  44  and name cg) 1.0 -120 120.0 2
 assign (resid  45  and name n ) (resid  45  and name ca)
        (resid  45  and name cb) (resid  45  and name cg) 1.0 -120 120.0 2
 assign (resid  50  and name n ) (resid  50  and name ca)
        (resid  50  and name cb) (resid  50  and name sg) 1.0 -60 60.0 2
 assign (resid  1  and name n ) (resid  1  and name ca) 
        (resid  1  and name cb) (resid  1  and name og1) 1.0 -60 60.0 2
 assign (resid  22  and name n ) (resid  22  and name ca)
        (resid  22  and name cb) (resid  22  and name og1) 1.0 120 120.0 2
 assign (resid  58  and name n ) (resid  58  and name ca)
        (resid  58  and name cb) (resid  58  and name cg1) 1.0 120 120.0 2
 
 end
 


    


  Entry H atom name         Submitted Coord H atom name
  Start of MODEL    1
    1   1H    THR   1          HT1       THR   1  14.333  17.054  11.258
    2   2H    THR   1          HT2       THR   1  14.860  18.039   9.977
    3   3H    THR   1          HT3       THR   1  15.280  16.393  10.016
    4    HA   THR   1           HA       THR   1  12.536  17.491   9.651
    5    HB   THR   1           HB       THR   1  14.171  15.830   7.743
    6    HG1  THR   1           HG1      THR   1  14.293  18.630   8.152
    7   1HG2  THR   1          HG2       THR   1  12.209  16.089   6.649
    8   2HG2  THR   1          HG2       THR   1  12.737  17.747   6.365
    9   3HG2  THR   1          HG2       THR   1  11.682  17.379   7.729
   10    H    ARG   2           HN       ARG   2  11.425  16.104  11.085
   11    HA   ARG   2           HA       ARG   2  12.068  13.210  11.077
   12   1HB   ARG   2          HB2       ARG   2  10.545  15.164  12.733
   13   2HB   ARG   2          HB1       ARG   2   9.974  13.495  12.757
   14   1HG   ARG   2          HG2       ARG   2  11.625  12.978  14.192
   15   2HG   ARG   2          HG1       ARG   2  12.804  13.394  12.948
   16   1HD   ARG   2          HD2       ARG   2  13.463  15.057  14.359
   17   2HD   ARG   2          HD1       ARG   2  11.957  15.877  13.903
   18    HE   ARG   2           HE       ARG   2  11.976  13.892  16.139
   19   1HH1  ARG   2          HH2       ARG   2  12.594  17.085  16.006
   20   2HH1  ARG   2          HH2       ARG   2  11.184  17.624  16.856
   21   1HH2  ARG   2          HH1       ARG   2   9.602  14.540  16.725
   22   2HH2  ARG   2          HH1       ARG   2   9.489  16.183  17.263
   23    H    GLY   3           HN       GLY   3  11.293  13.433   8.631
   24   1HA   GLY   3          HA2       GLY   3   8.332  13.016   8.541
   25   2HA   GLY   3          HA1       GLY   3   9.283  13.609   7.178
   26    H    SER   4           HN       SER   4   8.723  11.893   5.776
   27    HA   SER   4           HA       SER   4  10.023   9.285   6.455
   28   1HB   SER   4          HB2       SER   4   7.276   9.819   6.436
   29   2HB   SER   4          HB1       SER   4   7.574   9.037   4.887
   30    HG   SER   4           HG       SER   4   7.774   7.243   5.943
   31    H    ASP   5           HN       ASP   5  11.085   8.354   4.689
   32    HA   ASP   5           HA       ASP   5  10.477   9.077   1.933
   33   1HB   ASP   5          HB2       ASP   5  12.302  10.664   3.539
   34   2HB   ASP   5          HB1       ASP   5  13.140   9.960   2.155
   35    H    ILE   6           HN       ILE   6  11.008   6.676   3.668
   36    HA   ILE   6           HA       ILE   6  13.275   5.514   2.076
   37    HB   ILE   6           HB       ILE   6  12.412   4.767   4.890
   38   1HG1  ILE   6          HG1       ILE   6  13.203   7.110   4.841
   39   2HG1  ILE   6          HG1       ILE   6  14.368   6.069   5.660
   40   1HG2  ILE   6          HG2       ILE   6  14.882   4.180   3.232
   41   2HG2  ILE   6          HG2       ILE   6  13.655   3.019   3.738
   42   3HG2  ILE   6          HG2       ILE   6  14.708   3.767   4.937
   43   1HD1  ILE   6          HD1       ILE   6  15.959   6.657   4.186
   44   2HD1  ILE   6          HD1       ILE   6  14.810   7.736   3.394
   45   3HD1  ILE   6          HD1       ILE   6  14.963   6.064   2.857
   46    H    SER   7           HN       SER   7  10.554   5.469   1.211
   47    HA   SER   7           HA       SER   7   9.469   2.818   1.932
   48   1HB   SER   7          HB2       SER   7   8.365   5.237   1.357
   49   2HB   SER   7          HB1       SER   7   8.280   4.469  -0.226
   50    HG   SER   7           HG       SER   7   7.381   2.617   1.025
   51    H    LYS   8           HN       LYS   8  11.994   2.703   0.586
   52    HA   LYS   8           HA       LYS   8  11.553   2.234  -2.265
   53   1HB   LYS   8          HB2       LYS   8  13.762   2.117  -0.267
   54   2HB   LYS   8          HB1       LYS   8  13.961   1.144  -1.725
   55   1HG   LYS   8          HG2       LYS   8  14.886   3.206  -2.359
   56   2HG   LYS   8          HG1       LYS   8  13.238   3.316  -2.980
   57   1HD   LYS   8          HD2       LYS   8  12.618   4.428  -0.769
   58   2HD   LYS   8          HD1       LYS   8  14.349   4.550  -0.452
   59   1HE   LYS   8          HE2       LYS   8  14.683   6.128  -2.123
   60   2HE   LYS   8          HE1       LYS   8  13.320   5.535  -3.094
   61   1HZ   LYS   8          HZ1       LYS   8  12.978   7.685  -1.776
   62   2HZ   LYS   8          HZ2       LYS   8  12.901   6.685  -0.405
   63   3HZ   LYS   8          HZ3       LYS   8  11.776   6.494  -1.664
   64    H    THR   9           HN       THR   9  10.017   0.564  -2.478
   65    HA   THR   9           HA       THR   9  11.028  -2.153  -2.017
   66    HB   THR   9           HB       THR   9   8.598  -1.064  -0.559
   67    HG1  THR   9           HG1      THR   9  11.131  -1.980   0.325
   68   1HG2  THR   9          HG2       THR   9   7.990  -3.191  -0.083
   69   2HG2  THR   9          HG2       THR   9   9.660  -3.716   0.129
   70   3HG2  THR   9          HG2       THR   9   8.965  -3.617  -1.489
   71    H    CYS  10           HN       CYS  10  10.505  -3.044  -3.981
   72    HA   CYS  10           HA       CYS  10   8.314  -2.086  -5.632
   73   1HB   CYS  10          HB2       CYS  10  10.004  -4.607  -5.771
   74   2HB   CYS  10          HB1       CYS  10   9.082  -3.906  -7.098
   75    H    CYS  11           HN       CYS  11   7.296  -4.592  -6.578
   76    HA   CYS  11           HA       CYS  11   6.023  -5.852  -4.203
   77   1HB   CYS  11          HB2       CYS  11   4.749  -4.132  -6.296
   78   2HB   CYS  11          HB1       CYS  11   3.823  -5.491  -5.661
   79    H    PHE  12           HN       PHE  12   5.270  -7.976  -4.645
   80    HA   PHE  12           HA       PHE  12   5.245  -9.012  -7.392
   81   1HB   PHE  12          HB2       PHE  12   7.539  -9.220  -5.561
   82   2HB   PHE  12          HB1       PHE  12   7.023 -10.772  -6.222
   83    HD1  PHE  12           HD1      PHE  12   6.224 -10.435  -8.870
   84    HD2  PHE  12           HD2      PHE  12   9.250  -8.222  -6.773
   85    HE1  PHE  12           HE1      PHE  12   7.314  -9.879 -11.028
   86    HE2  PHE  12           HE2      PHE  12  10.340  -7.667  -8.930
   87    HZ   PHE  12           HZ       PHE  12   9.372  -8.495 -11.058
   88    H    GLN  13           HN       GLN  13   3.426  -8.837  -5.033
   89    HA   GLN  13           HA       GLN  13   2.392 -11.553  -5.108
   90   1HB   GLN  13          HB2       GLN  13   4.435 -11.538  -3.532
   91   2HB   GLN  13          HB1       GLN  13   3.436 -10.575  -2.442
   92   1HG   GLN  13          HG2       GLN  13   1.687 -12.392  -2.576
   93   2HG   GLN  13          HG1       GLN  13   2.860 -13.370  -3.459
   94   1HE2  GLN  13          HE2       GLN  13   2.028 -14.426  -1.049
   95   2HE2  GLN  13          HE2       GLN  13   3.241 -14.267   0.128
   96    H    TYR  14           HN       TYR  14   0.459 -10.384  -5.681
   97    HA   TYR  14           HA       TYR  14  -0.631  -8.374  -3.832
   98   1HB   TYR  14          HB2       TYR  14  -1.883  -9.702  -6.254
   99   2HB   TYR  14          HB1       TYR  14  -2.340  -8.158  -5.539
  100    HD1  TYR  14           HD1      TYR  14   0.382  -7.006  -5.007
  101    HD2  TYR  14           HD2      TYR  14  -1.181  -9.081  -8.429
  102    HE1  TYR  14           HE1      TYR  14   2.032  -5.857  -6.459
  103    HE2  TYR  14           HE2      TYR  14   0.469  -7.931  -9.880
  104    HH   TYR  14           HH       TYR  14   1.807  -5.525  -9.590
  105    H    SER  15           HN       SER  15  -2.178  -8.799  -2.277
  106    HA   SER  15           HA       SER  15  -3.088 -11.616  -1.984
  107   1HB   SER  15          HB2       SER  15  -3.430  -9.375   0.000
  108   2HB   SER  15          HB1       SER  15  -3.265 -11.100   0.312
  109    HG   SER  15           HG       SER  15  -1.200 -10.786   0.416
  110    H    HIS  16           HN       HIS  16  -5.217 -12.117  -2.378
  111    HA   HIS  16           HA       HIS  16  -7.087  -9.901  -3.036
  112   1HB   HIS  16          HB2       HIS  16  -6.543 -12.020  -4.442
  113   2HB   HIS  16          HB1       HIS  16  -7.577 -12.867  -3.292
  114    HD1  HIS  16           HD1      HIS  16 -10.031 -12.788  -3.766
  115    HD2  HIS  16           HD2      HIS  16  -7.988  -9.708  -5.694
  116    HE1  HIS  16           HE1      HIS  16 -11.739 -11.579  -5.194
  117    H    LYS  17           HN       LYS  17  -7.615  -9.215  -0.853
  118    HA   LYS  17           HA       LYS  17  -9.848 -10.558   0.352
  119   1HB   LYS  17          HB2       LYS  17  -7.357 -11.711   0.897
  120   2HB   LYS  17          HB1       LYS  17  -7.710 -10.750   2.333
  121   1HG   LYS  17          HG2       LYS  17 -10.038 -12.237   1.345
  122   2HG   LYS  17          HG1       LYS  17  -8.701 -13.282   1.828
  123   1HD   LYS  17          HD2       LYS  17  -8.571 -12.034   3.993
  124   2HD   LYS  17          HD1       LYS  17 -10.004 -11.125   3.513
  125   1HE   LYS  17          HE2       LYS  17 -10.605 -13.883   3.116
  126   2HE   LYS  17          HE1       LYS  17  -9.895 -13.719   4.735
  127   1HZ   LYS  17          HZ1       LYS  17 -11.932 -11.837   3.692
  128   2HZ   LYS  17          HZ2       LYS  17 -11.409 -12.031   5.297
  129   3HZ   LYS  17          HZ3       LYS  17 -12.355 -13.233   4.557
  130    HA   PRO  18           HA       PRO  18  -9.849  -6.390   1.939
  131   1HB   PRO  18          HB2       PRO  18 -12.109  -6.570   3.466
  132   2HB   PRO  18          HB1       PRO  18 -12.151  -6.426   1.697
  133   1HG   PRO  18          HG2       PRO  18 -12.479  -8.837   3.406
  134   2HG   PRO  18          HG1       PRO  18 -13.327  -8.383   1.920
  135   1HD   PRO  18          HD2       PRO  18 -11.308 -10.216   2.001
  136   2HD   PRO  18          HD1       PRO  18 -11.686  -9.234   0.569
  137    H    LEU  19           HN       LEU  19  -8.254  -6.048   3.458
  138    HA   LEU  19           HA       LEU  19  -7.863  -7.689   5.802
  139   1HB   LEU  19          HB2       LEU  19  -6.442  -5.866   4.330
  140   2HB   LEU  19          HB1       LEU  19  -6.833  -4.915   5.763
  141    HG   LEU  19           HG       LEU  19  -5.970  -7.643   6.403
  142   1HD1  LEU  19          HD1       LEU  19  -3.498  -6.771   5.953
  143   2HD1  LEU  19          HD1       LEU  19  -4.298  -5.870   4.665
  144   3HD1  LEU  19          HD1       LEU  19  -4.397  -7.631   4.703
  145   1HD2  LEU  19          HD2       LEU  19  -5.005  -6.566   8.210
  146   2HD2  LEU  19          HD2       LEU  19  -6.214  -5.360   7.773
  147   3HD2  LEU  19          HD2       LEU  19  -4.541  -5.158   7.255
  148    HA   PRO  20           HA       PRO  20 -10.813  -5.824   8.498
  149   1HB   PRO  20          HB2       PRO  20  -9.571  -6.231  10.913
  150   2HB   PRO  20          HB1       PRO  20 -10.392  -7.521  10.011
  151   1HG   PRO  20          HG2       PRO  20  -7.485  -6.874  10.161
  152   2HG   PRO  20          HG1       PRO  20  -8.291  -8.451  10.179
  153   1HD   PRO  20          HD2       PRO  20  -7.097  -7.461   7.967
  154   2HD   PRO  20          HD1       PRO  20  -8.535  -8.505   7.889
  155    H    TRP  21           HN       TRP  21 -10.910  -3.616   8.330
  156    HA   TRP  21           HA       TRP  21  -8.876  -1.727   8.347
  157   1HB   TRP  21          HB2       TRP  21 -11.742  -1.664   9.304
  158   2HB   TRP  21          HB1       TRP  21 -10.762  -0.199   9.173
  159    HD1  TRP  21           HD1      TRP  21 -12.737  -2.633   7.137
  160    HE1  TRP  21           HE1      TRP  21 -12.573  -2.025   4.636
  161    HE3  TRP  21           HE3      TRP  21  -9.028   0.868   7.324
  162    HZ2  TRP  21           HZ2      TRP  21 -11.057  -0.288   2.941
  163    HZ3  TRP  21           HZ3      TRP  21  -8.245   1.981   5.253
  164    HH2  TRP  21           HH2      TRP  21  -9.254   1.409   3.067
  165    H    THR  22           HN       THR  22 -10.237  -3.388  11.126
  166    HA   THR  22           HA       THR  22  -9.314  -1.596  13.172
  167    HB   THR  22           HB       THR  22  -9.431  -3.818  14.500
  168    HG1  THR  22           HG1      THR  22  -9.069  -5.165  12.707
  169   1HG2  THR  22          HG2       THR  22 -11.322  -2.038  13.847
  170   2HG2  THR  22          HG2       THR  22 -11.700  -3.513  14.736
  171   3HG2  THR  22          HG2       THR  22 -11.976  -3.438  12.996
  172    H    TRP  23           HN       TRP  23  -7.790  -4.166  11.313
  173    HA   TRP  23           HA       TRP  23  -5.253  -3.845  12.840
  174   1HB   TRP  23          HB2       TRP  23  -6.720  -6.007  11.726
  175   2HB   TRP  23          HB1       TRP  23  -5.228  -5.873  10.796
  176    HD1  TRP  23           HD1      TRP  23  -5.699  -5.129  14.548
  177    HE1  TRP  23           HE1      TRP  23  -4.098  -6.649  15.879
  178    HE3  TRP  23           HE3      TRP  23  -3.776  -7.930  10.738
  179    HZ2  TRP  23           HZ2      TRP  23  -2.244  -8.774  15.390
  180    HZ3  TRP  23           HZ3      TRP  23  -2.095  -9.693  11.197
  181    HH2  TRP  23           HH2      TRP  23  -1.327 -10.118  13.515
  182    H    VAL  24           HN       VAL  24  -6.624  -2.285  10.344
  183    HA   VAL  24           HA       VAL  24  -4.344  -2.444   8.471
  184    HB   VAL  24           HB       VAL  24  -6.978  -0.947   8.471
  185   1HG1  VAL  24          HG1       VAL  24  -6.169  -0.897   5.899
  186   2HG1  VAL  24          HG1       VAL  24  -4.593  -0.850   6.688
  187   3HG1  VAL  24          HG1       VAL  24  -5.790   0.397   7.034
  188   1HG2  VAL  24          HG2       VAL  24  -7.766  -2.639   7.048
  189   2HG2  VAL  24          HG2       VAL  24  -6.769  -3.549   8.182
  190   3HG2  VAL  24          HG2       VAL  24  -6.140  -3.141   6.586
  191    H    ARG  25           HN       ARG  25  -3.100  -0.496   7.945
  192    HA   ARG  25           HA       ARG  25  -3.244   1.629  10.058
  193   1HB   ARG  25          HB2       ARG  25  -1.435   0.015  10.467
  194   2HB   ARG  25          HB1       ARG  25  -0.819   0.275   8.836
  195   1HG   ARG  25          HG2       ARG  25   0.058   2.339   9.347
  196   2HG   ARG  25          HG1       ARG  25  -1.191   2.689  10.543
  197   1HD   ARG  25          HD2       ARG  25   0.042   0.588  11.757
  198   2HD   ARG  25          HD1       ARG  25   1.414   1.311  10.894
  199    HE   ARG  25           HE       ARG  25  -0.315   2.757  12.855
  200   1HH1  ARG  25          HH2       ARG  25   1.936   3.173  10.360
  201   2HH1  ARG  25          HH2       ARG  25   2.968   4.244  11.249
  202   1HH2  ARG  25          HH1       ARG  25   1.246   3.851  14.234
  203   2HH2  ARG  25          HH1       ARG  25   2.576   4.628  13.443
  204    H    SER  26           HN       SER  26  -1.727   0.906   6.872
  205    HA   SER  26           HA       SER  26  -2.813   3.374   5.723
  206   1HB   SER  26          HB2       SER  26  -0.612   4.470   5.499
  207   2HB   SER  26          HB1       SER  26  -0.986   4.177   7.195
  208    HG   SER  26           HG       SER  26   1.180   3.512   6.186
  209    H    TYR  27           HN       TYR  27  -0.804   3.700   3.728
  210    HA   TYR  27           HA       TYR  27  -0.322   1.082   2.475
  211   1HB   TYR  27          HB2       TYR  27  -1.882   1.364   0.693
  212   2HB   TYR  27          HB1       TYR  27  -2.776   1.840   2.128
  213    HD1  TYR  27           HD1      TYR  27  -1.604   2.843  -1.105
  214    HD2  TYR  27           HD2      TYR  27  -2.853   4.353   2.715
  215    HE1  TYR  27           HE1      TYR  27  -2.003   5.068  -2.118
  216    HE2  TYR  27           HE2      TYR  27  -3.256   6.579   1.703
  217    HH   TYR  27           HH       TYR  27  -2.421   7.862  -0.303
  218    H    GLU  28           HN       GLU  28   0.393   1.751  -0.019
  219    HA   GLU  28           HA       GLU  28   1.654   4.323  -0.349
  220   1HB   GLU  28          HB2       GLU  28   3.979   3.626   0.053
  221   2HB   GLU  28          HB1       GLU  28   3.014   3.391   1.509
  222   1HG   GLU  28          HG2       GLU  28   2.734   1.004   0.938
  223   2HG   GLU  28          HG1       GLU  28   3.713   1.242  -0.510
  224    H    PHE  29           HN       PHE  29   2.489   4.534  -2.455
  225    HA   PHE  29           HA       PHE  29   1.869   2.320  -4.307
  226   1HB   PHE  29          HB2       PHE  29   2.263   5.238  -4.341
  227   2HB   PHE  29          HB1       PHE  29   2.934   4.422  -5.753
  228    HD1  PHE  29           HD1      PHE  29   1.528   3.648  -7.485
  229    HD2  PHE  29           HD2      PHE  29  -0.164   4.718  -3.685
  230    HE1  PHE  29           HE1      PHE  29  -0.752   3.407  -8.432
  231    HE2  PHE  29           HE2      PHE  29  -2.443   4.477  -4.631
  232    HZ   PHE  29           HZ       PHE  29  -2.737   3.821  -7.005
  233    H    THR  30           HN       THR  30   3.500   1.552  -5.865
  234    HA   THR  30           HA       THR  30   6.066   0.982  -4.682
  235    HB   THR  30           HB       THR  30   6.387   0.363  -7.285
  236    HG1  THR  30           HG1      THR  30   4.408   1.513  -7.761
  237   1HG2  THR  30          HG2       THR  30   5.978  -1.751  -6.569
  238   2HG2  THR  30          HG2       THR  30   4.348  -1.351  -6.027
  239   3HG2  THR  30          HG2       THR  30   5.732  -0.994  -4.995
  240    H    SER  31           HN       SER  31   8.167   1.724  -5.473
  241    HA   SER  31           HA       SER  31   8.209   4.577  -6.113
  242   1HB   SER  31          HB2       SER  31   9.783   2.849  -4.713
  243   2HB   SER  31          HB1       SER  31  10.677   2.936  -6.228
  244    HG   SER  31           HG       SER  31  10.669   5.206  -6.009
  245    H    ASN  32           HN       ASN  32   9.501   5.408  -7.983
  246    HA   ASN  32           HA       ASN  32   8.724   4.144 -10.474
  247   1HB   ASN  32          HB2       ASN  32  10.021   6.052 -11.419
  248   2HB   ASN  32          HB1       ASN  32   8.907   6.572 -10.153
  249   1HD2  ASN  32          HD2       ASN  32  12.354   5.729 -10.708
  250   2HD2  ASN  32          HD2       ASN  32  12.949   6.671  -9.428
  251    H    SER  33           HN       SER  33  11.501   3.882  -8.406
  252    HA   SER  33           HA       SER  33  13.260   2.840 -10.532
  253   1HB   SER  33          HB2       SER  33  14.821   2.641  -8.555
  254   2HB   SER  33          HB1       SER  33  14.187   4.266  -8.801
  255    HG   SER  33           HG       SER  33  13.534   2.344  -6.855
  256    H    CYS  34           HN       CYS  34  10.831   1.322 -10.079
  257    HA   CYS  34           HA       CYS  34  11.927  -1.168  -8.818
  258   1HB   CYS  34          HB2       CYS  34   9.328   0.266  -8.773
  259   2HB   CYS  34          HB1       CYS  34   9.226  -1.492  -8.870
  260    H    SER  35           HN       SER  35  11.765  -3.084 -10.030
  261    HA   SER  35           HA       SER  35  11.664  -2.932 -12.882
  262   1HB   SER  35          HB2       SER  35  11.562  -5.445 -12.630
  263   2HB   SER  35          HB1       SER  35  12.834  -4.684 -11.678
  264    HG   SER  35           HG       SER  35  10.398  -5.816 -10.870
  265    H    GLN  36           HN       GLN  36   9.174  -3.390 -10.461
  266    HA   GLN  36           HA       GLN  36   7.146  -3.683 -12.654
  267   1HB   GLN  36          HB2       GLN  36   5.914  -5.135 -11.111
  268   2HB   GLN  36          HB1       GLN  36   7.563  -5.735 -11.278
  269   1HG   GLN  36          HG2       GLN  36   7.530  -5.729  -8.998
  270   2HG   GLN  36          HG1       GLN  36   7.863  -4.007  -9.189
  271   1HE2  GLN  36          HE2       GLN  36   4.993  -6.206  -9.187
  272   2HE2  GLN  36          HE2       GLN  36   3.996  -5.135  -8.328
  273    H    ARG  37           HN       ARG  37   4.846  -3.220 -11.313
  274    HA   ARG  37           HA       ARG  37   5.183  -0.786  -9.647
  275   1HB   ARG  37          HB2       ARG  37   3.619   0.421 -11.181
  276   2HB   ARG  37          HB1       ARG  37   5.129  -0.028 -11.973
  277   1HG   ARG  37          HG2       ARG  37   3.975  -2.102 -12.825
  278   2HG   ARG  37          HG1       ARG  37   2.463  -1.450 -12.190
  279   1HD   ARG  37          HD2       ARG  37   3.290   0.708 -13.586
  280   2HD   ARG  37          HD1       ARG  37   4.049  -0.571 -14.554
  281    HE   ARG  37           HE       ARG  37   1.804  -1.621 -14.763
  282   1HH1  ARG  37          HH2       ARG  37   1.796   1.325 -15.773
  283   2HH1  ARG  37          HH2       ARG  37   0.258   1.845 -15.168
  284   1HH2  ARG  37          HH1       ARG  37  -0.102  -0.845 -13.011
  285   2HH2  ARG  37          HH1       ARG  37  -0.816   0.616 -13.606
  286    H    ALA  38           HN       ALA  38   3.680  -0.819  -8.001
  287    HA   ALA  38           HA       ALA  38   0.977  -1.858  -8.387
  288   1HB   ALA  38          HB1       ALA  38   1.644  -4.012  -8.059
  289   2HB   ALA  38          HB2       ALA  38   1.781  -3.547  -6.363
  290   3HB   ALA  38          HB3       ALA  38   3.204  -3.515  -7.403
  291    H    VAL  39           HN       VAL  39  -0.171  -1.933  -6.154
  292    HA   VAL  39           HA       VAL  39   0.724   0.424  -4.560
  293    HB   VAL  39           HB       VAL  39  -1.876  -1.151  -4.583
  294   1HG1  VAL  39          HG1       VAL  39  -0.921   1.334  -3.201
  295   2HG1  VAL  39          HG1       VAL  39  -1.935   0.031  -2.581
  296   3HG1  VAL  39          HG1       VAL  39  -2.613   1.226  -3.686
  297   1HG2  VAL  39          HG2       VAL  39  -2.350  -0.094  -6.514
  298   2HG2  VAL  39          HG2       VAL  39  -0.770   0.689  -6.490
  299   3HG2  VAL  39          HG2       VAL  39  -2.146   1.456  -5.699
  300    H    ILE  40           HN       ILE  40   0.281   0.158  -2.099
  301    HA   ILE  40           HA       ILE  40   0.726  -2.644  -1.174
  302    HB   ILE  40           HB       ILE  40   2.463  -0.201  -0.804
  303   1HG1  ILE  40          HG1       ILE  40   3.336  -3.027  -1.344
  304   2HG1  ILE  40          HG1       ILE  40   2.740  -2.013  -2.657
  305   1HG2  ILE  40          HG2       ILE  40   3.740  -1.504   0.891
  306   2HG2  ILE  40          HG2       ILE  40   2.472  -2.730   0.866
  307   3HG2  ILE  40          HG2       ILE  40   2.113  -1.101   1.440
  308   1HD1  ILE  40          HD1       ILE  40   5.344  -2.036  -1.586
  309   2HD1  ILE  40          HD1       ILE  40   4.611  -0.534  -1.023
  310   3HD1  ILE  40          HD1       ILE  40   4.684  -0.886  -2.750
  311    H    PHE  41           HN       PHE  41  -0.364  -3.057   0.730
  312    HA   PHE  41           HA       PHE  41  -1.654  -0.736   2.126
  313   1HB   PHE  41          HB2       PHE  41  -2.407  -3.633   1.658
  314   2HB   PHE  41          HB1       PHE  41  -3.204  -2.667   2.900
  315    HD1  PHE  41           HD1      PHE  41  -3.452  -0.029   1.736
  316    HD2  PHE  41           HD2      PHE  41  -3.879  -3.868  -0.145
  317    HE1  PHE  41           HE1      PHE  41  -4.924   0.978   0.012
  318    HE2  PHE  41           HE2      PHE  41  -5.350  -2.860  -1.868
  319    HZ   PHE  41           HZ       PHE  41  -5.873  -0.439  -1.789
  320    H    THR  42           HN       THR  42  -1.443  -0.716   4.454
  321    HA   THR  42           HA       THR  42   0.520  -2.710   5.513
  322    HB   THR  42           HB       THR  42   0.368   0.005   6.699
  323    HG1  THR  42           HG1      THR  42   0.731   1.011   4.913
  324   1HG2  THR  42          HG2       THR  42   2.915  -0.343   6.343
  325   2HG2  THR  42          HG2       THR  42   2.474  -1.999   5.926
  326   3HG2  THR  42          HG2       THR  42   2.093  -1.360   7.526
  327    H    THR  43           HN       THR  43   0.126  -3.517   7.593
  328    HA   THR  43           HA       THR  43  -2.595  -3.058   8.671
  329    HB   THR  43           HB       THR  43  -2.034  -5.083   9.989
  330    HG1  THR  43           HG1      THR  43  -0.042  -5.921   9.909
  331   1HG2  THR  43          HG2       THR  43  -1.054  -5.799   7.282
  332   2HG2  THR  43          HG2       THR  43  -2.598  -4.948   7.348
  333   3HG2  THR  43          HG2       THR  43  -2.393  -6.473   8.211
  334    H    LYS  44           HN       LYS  44  -2.497  -3.342  11.274
  335    HA   LYS  44           HA       LYS  44  -1.136  -0.943  12.251
  336   1HB   LYS  44          HB2       LYS  44  -3.411  -2.482  12.848
  337   2HB   LYS  44          HB1       LYS  44  -2.364  -2.632  14.261
  338   1HG   LYS  44          HG2       LYS  44  -2.614  -0.446  14.832
  339   2HG   LYS  44          HG1       LYS  44  -2.529   0.097  13.156
  340   1HD   LYS  44          HD2       LYS  44  -4.866  -0.789  12.830
  341   2HD   LYS  44          HD1       LYS  44  -4.933  -1.088  14.568
  342   1HE   LYS  44          HE2       LYS  44  -5.377   1.094  14.987
  343   2HE   LYS  44          HE1       LYS  44  -3.996   1.616  14.000
  344   1HZ   LYS  44          HZ1       LYS  44  -5.858   2.368  12.826
  345   2HZ   LYS  44          HZ2       LYS  44  -6.739   0.945  13.113
  346   3HZ   LYS  44          HZ3       LYS  44  -5.429   0.934  12.030
  347    H    ARG  45           HN       ARG  45  -0.347  -4.289  12.069
  348    HA   ARG  45           HA       ARG  45   1.441  -4.221  14.430
  349   1HB   ARG  45          HB2       ARG  45   0.089  -6.161  12.738
  350   2HB   ARG  45          HB1       ARG  45   1.789  -6.583  12.951
  351   1HG   ARG  45          HG2       ARG  45   0.830  -5.725  15.484
  352   2HG   ARG  45          HG1       ARG  45  -0.366  -6.847  14.833
  353   1HD   ARG  45          HD2       ARG  45   1.874  -8.214  14.200
  354   2HD   ARG  45          HD1       ARG  45   2.453  -7.359  15.644
  355    HE   ARG  45           HE       ARG  45   0.150  -9.241  15.568
  356   1HH1  ARG  45          HH1       ARG  45   0.279  -6.602  17.350
  357   2HH1  ARG  45          HH1       ARG  45   0.657  -7.333  18.874
  358   1HH2  ARG  45          HH2       ARG  45   1.481 -10.406  17.491
  359   2HH2  ARG  45          HH2       ARG  45   1.339  -9.488  18.954
  360    H    GLY  46           HN       GLY  46   1.612  -3.587  11.044
  361   1HA   GLY  46          HA2       GLY  46   3.702  -2.494  10.255
  362   2HA   GLY  46          HA1       GLY  46   4.595  -3.675  11.212
  363    H    LYS  47           HN       LYS  47   1.983  -5.249   9.815
  364    HA   LYS  47           HA       LYS  47   3.720  -6.649   7.927
  365   1HB   LYS  47          HB2       LYS  47   1.846  -7.572   9.428
  366   2HB   LYS  47          HB1       LYS  47   0.721  -6.873   8.263
  367   1HG   LYS  47          HG2       LYS  47   2.006  -8.148   6.461
  368   2HG   LYS  47          HG1       LYS  47   2.796  -9.019   7.777
  369   1HD   LYS  47          HD2       LYS  47   0.075  -9.088   8.428
  370   2HD   LYS  47          HD1       LYS  47   0.122  -9.373   6.688
  371   1HE   LYS  47          HE2       LYS  47   1.735 -11.200   6.998
  372   2HE   LYS  47          HE1       LYS  47   1.764 -10.895   8.746
  373   1HZ   LYS  47          HZ1       LYS  47  -0.483 -11.457   8.955
  374   2HZ   LYS  47          HZ2       LYS  47   0.140 -12.651   7.919
  375   3HZ   LYS  47          HZ3       LYS  47  -0.767 -11.362   7.285
  376    H    LYS  48           HN       LYS  48   4.230  -5.190   6.231
  377    HA   LYS  48           HA       LYS  48   2.082  -3.687   4.879
  378   1HB   LYS  48          HB2       LYS  48   4.394  -2.820   5.335
  379   2HB   LYS  48          HB1       LYS  48   5.022  -4.031   4.216
  380   1HG   LYS  48          HG2       LYS  48   4.407  -2.826   2.406
  381   2HG   LYS  48          HG1       LYS  48   2.808  -2.499   3.075
  382   1HD   LYS  48          HD2       LYS  48   3.826  -0.366   2.945
  383   2HD   LYS  48          HD1       LYS  48   4.008  -0.830   4.637
  384   1HE   LYS  48          HE2       LYS  48   6.243  -1.879   3.161
  385   2HE   LYS  48          HE1       LYS  48   6.081  -0.145   2.816
  386   1HZ   LYS  48          HZ1       LYS  48   6.071   0.375   5.089
  387   2HZ   LYS  48          HZ2       LYS  48   7.327  -0.757   4.921
  388   3HZ   LYS  48          HZ3       LYS  48   5.826  -1.237   5.557
  389    H    VAL  49           HN       VAL  49   0.905  -4.611   3.258
  390    HA   VAL  49           HA       VAL  49   2.094  -6.950   1.801
  391    HB   VAL  49           HB       VAL  49  -0.790  -6.094   2.207
  392   1HG1  VAL  49          HG1       VAL  49   0.466  -8.603   1.056
  393   2HG1  VAL  49          HG1       VAL  49  -0.518  -7.425   0.188
  394   3HG1  VAL  49          HG1       VAL  49  -1.248  -8.434   1.436
  395   1HG2  VAL  49          HG2       VAL  49  -0.063  -6.765   4.339
  396   2HG2  VAL  49          HG2       VAL  49   1.052  -7.965   3.685
  397   3HG2  VAL  49          HG2       VAL  49  -0.685  -8.269   3.659
  398    H    CYS  50           HN       CYS  50   1.868  -7.013  -0.508
  399    HA   CYS  50           HA       CYS  50   1.701  -4.348  -1.792
  400   1HB   CYS  50          HB2       CYS  50   2.690  -7.101  -2.448
  401   2HB   CYS  50          HB1       CYS  50   2.316  -6.014  -3.783
  402    H    THR  51           HN       THR  51   0.365  -4.096  -3.770
  403    HA   THR  51           HA       THR  51  -1.794  -6.028  -4.283
  404    HB   THR  51           HB       THR  51  -3.452  -4.045  -3.780
  405    HG1  THR  51           HG1      THR  51  -2.691  -2.521  -2.503
  406   1HG2  THR  51          HG2       THR  51  -2.290  -5.197  -1.281
  407   2HG2  THR  51          HG2       THR  51  -2.911  -6.315  -2.496
  408   3HG2  THR  51          HG2       THR  51  -3.974  -5.096  -1.793
  409    H    HIS  52           HN       HIS  52  -3.335  -4.994  -6.003
  410    HA   HIS  52           HA       HIS  52  -1.658  -3.423  -7.900
  411   1HB   HIS  52          HB2       HIS  52  -2.835  -5.826  -8.199
  412   2HB   HIS  52          HB1       HIS  52  -4.170  -4.798  -8.719
  413    HD1  HIS  52           HD1      HIS  52  -0.475  -4.136  -9.293
  414    HD2  HIS  52           HD2      HIS  52  -3.902  -5.040 -11.488
  415    HE1  HIS  52           HE1      HIS  52   0.161  -3.924 -11.736
  416    HA   PRO  53           HA       PRO  53  -4.501  -0.068  -7.319
  417   1HB   PRO  53          HB2       PRO  53  -3.826   1.424  -9.509
  418   2HB   PRO  53          HB1       PRO  53  -2.809   1.325  -8.058
  419   1HG   PRO  53          HG2       PRO  53  -2.515  -0.054 -10.673
  420   2HG   PRO  53          HG1       PRO  53  -1.274   0.592  -9.588
  421   1HD   PRO  53          HD2       PRO  53  -1.918  -2.067  -9.782
  422   2HD   PRO  53          HD1       PRO  53  -1.188  -1.317  -8.346
  423    H    ARG  54           HN       ARG  54  -4.473  -2.135 -10.098
  424    HA   ARG  54           HA       ARG  54  -6.670  -0.957 -11.556
  425   1HB   ARG  54          HB2       ARG  54  -5.022  -3.411 -11.528
  426   2HB   ARG  54          HB1       ARG  54  -6.634  -3.615 -12.214
  427   1HG   ARG  54          HG2       ARG  54  -5.730  -2.796 -14.125
  428   2HG   ARG  54          HG1       ARG  54  -5.818  -1.225 -13.326
  429   1HD   ARG  54          HD2       ARG  54  -3.538  -1.345 -12.613
  430   2HD   ARG  54          HD1       ARG  54  -3.432  -3.070 -13.013
  431    HE   ARG  54           HE       ARG  54  -3.921  -1.004 -15.126
  432   1HH1  ARG  54          HH1       ARG  54  -3.937  -4.050 -15.586
  433   2HH1  ARG  54          HH1       ARG  54  -2.361  -4.277 -16.266
  434   1HH2  ARG  54          HH2       ARG  54  -1.187  -1.174 -15.263
  435   2HH2  ARG  54          HH2       ARG  54  -0.806  -2.651 -16.084
  436    H    LYS  55           HN       LYS  55  -6.499  -3.723  -9.273
  437    HA   LYS  55           HA       LYS  55  -9.195  -4.504  -9.284
  438   1HB   LYS  55          HB2       LYS  55  -6.855  -4.648  -7.517
  439   2HB   LYS  55          HB1       LYS  55  -8.386  -4.732  -6.644
  440   1HG   LYS  55          HG2       LYS  55  -8.331  -6.937  -7.193
  441   2HG   LYS  55          HG1       LYS  55  -8.889  -6.382  -8.771
  442   1HD   LYS  55          HD2       LYS  55  -5.951  -6.528  -8.081
  443   2HD   LYS  55          HD1       LYS  55  -6.821  -7.906  -8.757
  444   1HE   LYS  55          HE2       LYS  55  -7.556  -5.718 -10.374
  445   2HE   LYS  55          HE1       LYS  55  -5.805  -5.564 -10.132
  446   1HZ   LYS  55          HZ1       LYS  55  -6.218  -7.073 -11.947
  447   2HZ   LYS  55          HZ2       LYS  55  -7.263  -8.009 -10.989
  448   3HZ   LYS  55          HZ3       LYS  55  -5.603  -7.950 -10.632
  449    H    LYS  56           HN       LYS  56 -10.986  -3.275  -8.935
  450    HA   LYS  56           HA       LYS  56 -11.118  -0.640  -8.006
  451   1HB   LYS  56          HB2       LYS  56 -12.844  -2.286  -9.086
  452   2HB   LYS  56          HB1       LYS  56 -13.270  -2.662  -7.416
  453   1HG   LYS  56          HG2       LYS  56 -14.269  -0.646  -7.084
  454   2HG   LYS  56          HG1       LYS  56 -13.039   0.222  -8.004
  455   1HD   LYS  56          HD2       LYS  56 -14.052  -0.421 -10.100
  456   2HD   LYS  56          HD1       LYS  56 -15.175  -1.507  -9.280
  457   1HE   LYS  56          HE2       LYS  56 -16.347   0.328  -8.259
  458   2HE   LYS  56          HE1       LYS  56 -15.095   1.483  -8.759
  459   1HZ   LYS  56          HZ1       LYS  56 -17.158   1.271 -10.235
  460   2HZ   LYS  56          HZ2       LYS  56 -16.495  -0.212 -10.734
  461   3HZ   LYS  56          HZ3       LYS  56 -15.642   1.235 -10.993
  462    H    TRP  57           HN       TRP  57 -11.539  -3.632  -6.073
  463    HA   TRP  57           HA       TRP  57 -12.143  -2.455  -3.591
  464   1HB   TRP  57          HB2       TRP  57 -11.852  -4.618  -2.829
  465   2HB   TRP  57          HB1       TRP  57 -11.849  -4.951  -4.555
  466    HD1  TRP  57           HD1      TRP  57  -9.792  -6.155  -5.480
  467    HE1  TRP  57           HE1      TRP  57  -7.440  -6.719  -4.583
  468    HE3  TRP  57           HE3      TRP  57  -9.885  -3.572  -1.075
  469    HZ2  TRP  57           HZ2      TRP  57  -5.816  -6.143  -2.299
  470    HZ3  TRP  57           HZ3      TRP  57  -7.924  -3.600   0.439
  471    HH2  TRP  57           HH2      TRP  57  -5.892  -4.882  -0.166
  472    H    VAL  58           HN       VAL  58  -9.000  -2.833  -5.181
  473    HA   VAL  58           HA       VAL  58  -7.375  -2.042  -2.929
  474    HB   VAL  58           HB       VAL  58  -6.917  -1.831  -5.921
  475   1HG1  VAL  58          HG1       VAL  58  -4.984  -0.850  -5.284
  476   2HG1  VAL  58          HG1       VAL  58  -4.521  -2.419  -4.623
  477   3HG1  VAL  58          HG1       VAL  58  -5.281  -1.214  -3.584
  478   1HG2  VAL  58          HG2       VAL  58  -6.097  -4.056  -4.036
  479   2HG2  VAL  58          HG2       VAL  58  -6.004  -4.052  -5.797
  480   3HG2  VAL  58          HG2       VAL  58  -7.573  -4.112  -4.997
  481    H    GLN  59           HN       GLN  59  -8.562  -0.234  -5.792
  482    HA   GLN  59           HA       GLN  59  -7.519   2.313  -5.095
  483   1HB   GLN  59          HB2       GLN  59 -10.064   1.478  -6.532
  484   2HB   GLN  59          HB1       GLN  59  -9.377   3.102  -6.586
  485   1HG   GLN  59          HG2       GLN  59  -7.186   1.715  -7.280
  486   2HG   GLN  59          HG1       GLN  59  -8.412   0.593  -7.871
  487   1HE2  GLN  59          HE2       GLN  59 -10.415   2.313  -8.781
  488   2HE2  GLN  59          HE2       GLN  59  -9.815   3.290 -10.033
  489    H    LYS  60           HN       LYS  60 -10.247   0.482  -3.899
  490    HA   LYS  60           HA       LYS  60 -11.578   2.692  -2.579
  491   1HB   LYS  60          HB2       LYS  60 -12.140   0.082  -3.275
  492   2HB   LYS  60          HB1       LYS  60 -11.947  -0.032  -1.525
  493   1HG   LYS  60          HG2       LYS  60 -13.707   1.443  -1.099
  494   2HG   LYS  60          HG1       LYS  60 -13.600   2.187  -2.694
  495   1HD   LYS  60          HD2       LYS  60 -14.333  -0.719  -2.430
  496   2HD   LYS  60          HD1       LYS  60 -15.561   0.529  -2.215
  497   1HE   LYS  60          HE2       LYS  60 -13.838   0.902  -4.595
  498   2HE   LYS  60          HE1       LYS  60 -14.903  -0.518  -4.651
  499   1HZ   LYS  60          HZ1       LYS  60 -16.782   0.801  -4.189
  500   2HZ   LYS  60          HZ2       LYS  60 -15.932   1.649  -5.391
  501   3HZ   LYS  60          HZ3       LYS  60 -15.845   2.151  -3.770
  502    H    TYR  61           HN       TYR  61  -9.155   0.256  -1.643
  503    HA   TYR  61           HA       TYR  61  -9.190   1.046   1.171
  504   1HB   TYR  61          HB2       TYR  61  -7.695  -0.814  -0.626
  505   2HB   TYR  61          HB1       TYR  61  -6.929  -0.369   0.900
  506    HD1  TYR  61           HD1      TYR  61 -10.409  -1.188  -0.262
  507    HD2  TYR  61           HD2      TYR  61  -7.318  -1.859   2.646
  508    HE1  TYR  61           HE1      TYR  61 -11.890  -2.767   0.948
  509    HE2  TYR  61           HE2      TYR  61  -8.800  -3.439   3.855
  510    HH   TYR  61           HH       TYR  61 -10.796  -4.914   3.254
  511    H    ILE  62           HN       ILE  62  -7.346   1.899  -1.709
  512    HA   ILE  62           HA       ILE  62  -5.173   3.254  -0.407
  513    HB   ILE  62           HB       ILE  62  -6.518   3.730  -3.092
  514   1HG1  ILE  62          HG1       ILE  62  -4.013   2.128  -2.640
  515   2HG1  ILE  62          HG1       ILE  62  -5.587   1.372  -2.398
  516   1HG2  ILE  62          HG2       ILE  62  -3.648   4.151  -2.955
  517   2HG2  ILE  62          HG2       ILE  62  -4.490   5.185  -1.801
  518   3HG2  ILE  62          HG2       ILE  62  -4.908   5.252  -3.513
  519   1HD1  ILE  62          HD1       ILE  62  -5.844   1.133  -4.619
  520   2HD1  ILE  62          HD1       ILE  62  -4.236   1.817  -4.859
  521   3HD1  ILE  62          HD1       ILE  62  -5.649   2.871  -4.845
  522    H    SER  63           HN       SER  63  -8.258   4.480  -1.762
  523    HA   SER  63           HA       SER  63  -7.869   7.198  -0.875
  524   1HB   SER  63          HB2       SER  63  -9.400   6.596  -2.672
  525   2HB   SER  63          HB1       SER  63 -10.307   5.537  -1.597
  526    HG   SER  63           HG       SER  63 -10.719   8.083  -2.051
  527    H    LEU  64           HN       LEU  64  -9.601   4.394   0.495
  528    HA   LEU  64           HA       LEU  64 -10.700   5.693   2.785
  529   1HB   LEU  64          HB2       LEU  64  -9.923   2.910   1.974
  530   2HB   LEU  64          HB1       LEU  64 -10.371   3.202   3.655
  531    HG   LEU  64           HG       LEU  64 -12.080   4.052   1.306
  532   1HD1  LEU  64          HD1       LEU  64 -13.432   2.093   1.700
  533   2HD1  LEU  64          HD1       LEU  64 -12.471   1.650   3.110
  534   3HD1  LEU  64          HD1       LEU  64 -11.767   1.548   1.496
  535   1HD2  LEU  64          HD2       LEU  64 -13.446   4.967   2.863
  536   2HD2  LEU  64          HD2       LEU  64 -12.097   4.805   3.988
  537   3HD2  LEU  64          HD2       LEU  64 -13.330   3.546   3.902
  538    H    LEU  65           HN       LEU  65  -7.589   3.991   2.312
  539    HA   LEU  65           HA       LEU  65  -6.644   4.536   5.009
  540   1HB   LEU  65          HB2       LEU  65  -5.522   3.486   2.421
  541   2HB   LEU  65          HB1       LEU  65  -4.425   3.877   3.744
  542    HG   LEU  65           HG       LEU  65  -6.791   1.987   3.931
  543   1HD1  LEU  65          HD1       LEU  65  -4.908   0.306   4.310
  544   2HD1  LEU  65          HD1       LEU  65  -3.803   1.547   3.726
  545   3HD1  LEU  65          HD1       LEU  65  -5.058   0.914   2.662
  546   1HD2  LEU  65          HD2       LEU  65  -4.854   1.753   6.039
  547   2HD2  LEU  65          HD2       LEU  65  -6.562   2.172   6.166
  548   3HD2  LEU  65          HD2       LEU  65  -5.358   3.436   5.921
  549    H    LYS  66           HN       LYS  66  -7.442   6.996   4.333
  550    HA   LYS  66           HA       LYS  66  -6.706   9.229   4.162
  551   1HB   LYS  66          HB2       LYS  66  -4.651   7.670   5.297
  552   2HB   LYS  66          HB1       LYS  66  -3.858   8.676   4.084
  553   1HG   LYS  66          HG2       LYS  66  -5.148  10.647   5.075
  554   2HG   LYS  66          HG1       LYS  66  -5.557   9.577   6.417
  555   1HD   LYS  66          HD2       LYS  66  -2.723  10.137   5.501
  556   2HD   LYS  66          HD1       LYS  66  -3.512  10.971   6.841
  557   1HE   LYS  66          HE2       LYS  66  -3.965   8.261   7.376
  558   2HE   LYS  66          HE1       LYS  66  -2.284   8.328   6.808
  559   1HZ   LYS  66          HZ1       LYS  66  -3.538   9.888   8.993
  560   2HZ   LYS  66          HZ2       LYS  66  -2.072  10.359   8.274
  561   3HZ   LYS  66          HZ3       LYS  66  -2.185   8.868   9.080
  562    H    THR  67           HN       THR  67  -6.302  10.603   2.426
  563    HA   THR  67           HA       THR  67  -5.844   9.380  -0.190
  564    HB   THR  67           HB       THR  67  -6.184  12.249   0.744
  565    HG1  THR  67           HG1      THR  67  -8.155  11.619   0.980
  566   1HG2  THR  67          HG2       THR  67  -5.122  11.782  -1.570
  567   2HG2  THR  67          HG2       THR  67  -6.518  12.859  -1.509
  568   3HG2  THR  67          HG2       THR  67  -6.718  11.184  -2.024
  569    HA   PRO  68           HA       PRO  68  -1.488  10.162  -0.244
  570   1HB   PRO  68          HB2       PRO  68  -1.056   9.988  -2.937
  571   2HB   PRO  68          HB1       PRO  68  -1.360   8.568  -1.917
  572   1HG   PRO  68          HG2       PRO  68  -3.193  10.003  -3.757
  573   2HG   PRO  68          HG1       PRO  68  -3.086   8.277  -3.385
  574   1HD   PRO  68          HD2       PRO  68  -4.983   9.986  -2.355
  575   2HD   PRO  68          HD1       PRO  68  -4.494   8.451  -1.607
  576    H    LYS  69           HN       LYS  69  -2.583  12.528   0.263
  577    HA   LYS  69           HA       LYS  69  -2.371  14.446  -1.933
  578   1HB   LYS  69          HB2       LYS  69  -3.770  14.330   0.356
  579   2HB   LYS  69          HB1       LYS  69  -2.383  15.249   0.942
  580   1HG   LYS  69          HG2       LYS  69  -2.973  17.104  -0.222
  581   2HG   LYS  69          HG1       LYS  69  -3.398  16.173  -1.659
  582   1HD   LYS  69          HD2       LYS  69  -5.422  17.195  -0.817
  583   2HD   LYS  69          HD1       LYS  69  -5.511  15.466  -0.481
  584   1HE   LYS  69          HE2       LYS  69  -4.178  16.796   1.710
  585   2HE   LYS  69          HE1       LYS  69  -5.747  17.565   1.400
  586   1HZ   LYS  69          HZ1       LYS  69  -5.182  14.699   1.891
  587   2HZ   LYS  69          HZ2       LYS  69  -6.631  15.220   1.173
  588   3HZ   LYS  69          HZ3       LYS  69  -6.231  15.720   2.747
  589    H    GLN  70           HN       GLN  70   0.010  13.550  -2.266
  590    HA   GLN  70           HA       GLN  70   1.931  14.932  -0.441
  591   1HB   GLN  70          HB2       GLN  70   2.096  12.473  -0.947
  592   2HB   GLN  70          HB1       GLN  70   2.379  12.887  -2.637
  593   1HG   GLN  70          HG2       GLN  70   4.556  13.254  -2.214
  594   2HG   GLN  70          HG1       GLN  70   4.134  14.460  -0.998
  595   1HE2  GLN  70          HE2       GLN  70   6.137  13.451   0.113
  596   2HE2  GLN  70          HE2       GLN  70   5.877  12.088   1.090
  597    H    LEU  71           HN       LEU  71   2.171  17.040  -1.197
  598    HA   LEU  71           HA       LEU  71   2.357  17.521  -4.126
  599   1HB   LEU  71          HB2       LEU  71   1.491  18.924  -1.745
  600   2HB   LEU  71          HB1       LEU  71   2.661  19.900  -2.634
  601    HG   LEU  71           HG       LEU  71   0.367  20.337  -3.429
  602   1HD1  LEU  71          HD1       LEU  71   2.589  19.871  -4.965
  603   2HD1  LEU  71          HD1       LEU  71   1.070  20.517  -5.585
  604   3HD1  LEU  71          HD1       LEU  71   1.413  18.792  -5.715
  605   1HD2  LEU  71          HD2       LEU  71  -0.031  17.824  -4.819
  606   2HD2  LEU  71          HD2       LEU  71  -1.121  18.666  -3.717
  607   3HD2  LEU  71          HD2       LEU  71   0.091  17.554  -3.080
  Start of MODEL    2
    1   1H    THR   1          HT1       THR   1   9.060  -5.517  16.156
    2   2H    THR   1          HT2       THR   1  10.396  -6.343  15.506
    3   3H    THR   1          HT3       THR   1   8.961  -6.197  14.605
    4    HA   THR   1           HA       THR   1   9.322  -3.692  14.718
    5    HB   THR   1           HB       THR   1  12.096  -4.694  15.423
    6    HG1  THR   1           HG1      THR   1  10.065  -3.571  17.050
    7   1HG2  THR   1          HG2       THR   1  10.866  -1.923  15.446
    8   2HG2  THR   1          HG2       THR   1  11.946  -2.542  14.196
    9   3HG2  THR   1          HG2       THR   1  12.538  -2.321  15.843
   10    H    ARG   2           HN       ARG   2  11.980  -5.943  13.850
   11    HA   ARG   2           HA       ARG   2  11.344  -5.479  10.967
   12   1HB   ARG   2          HB2       ARG   2  13.356  -4.185  12.376
   13   2HB   ARG   2          HB1       ARG   2  14.204  -5.530  11.611
   14   1HG   ARG   2          HG2       ARG   2  12.853  -4.808   9.478
   15   2HG   ARG   2          HG1       ARG   2  12.704  -3.268  10.328
   16   1HD   ARG   2          HD2       ARG   2  15.429  -4.189  10.527
   17   2HD   ARG   2          HD1       ARG   2  14.930  -4.169   8.824
   18    HE   ARG   2           HE       ARG   2  14.090  -1.807   9.284
   19   1HH1  ARG   2          HH2       ARG   2  17.138  -2.071   9.272
   20   2HH1  ARG   2          HH2       ARG   2  17.554  -1.133  10.667
   21   1HH2  ARG   2          HH1       ARG   2  14.334  -1.123  11.951
   22   2HH2  ARG   2          HH1       ARG   2  15.967  -0.595  12.182
   23    H    GLY   3           HN       GLY   3  12.769  -7.045   9.604
   24   1HA   GLY   3          HA2       GLY   3  13.907  -9.379  10.824
   25   2HA   GLY   3          HA1       GLY   3  12.248  -9.719  10.329
   26    H    SER   4           HN       SER   4  13.072 -11.221   8.725
   27    HA   SER   4           HA       SER   4  14.534  -9.963   6.437
   28   1HB   SER   4          HB2       SER   4  14.313 -12.656   7.684
   29   2HB   SER   4          HB1       SER   4  14.516 -12.622   5.935
   30    HG   SER   4           HG       SER   4  16.304 -11.130   6.386
   31    H    ASP   5           HN       ASP   5  11.904  -9.177   6.498
   32    HA   ASP   5           HA       ASP   5  10.209 -11.042   4.992
   33   1HB   ASP   5          HB2       ASP   5   9.962  -8.180   5.953
   34   2HB   ASP   5          HB1       ASP   5   8.669  -9.021   5.099
   35    H    ILE   6           HN       ILE   6   8.967  -9.644   3.091
   36    HA   ILE   6           HA       ILE   6  11.126  -8.582   1.294
   37    HB   ILE   6           HB       ILE   6   8.739 -10.349   0.662
   38   1HG1  ILE   6          HG1       ILE   6  10.554 -11.515   1.871
   39   2HG1  ILE   6          HG1       ILE   6  10.458 -12.061   0.196
   40   1HG2  ILE   6          HG2       ILE   6  10.725 -10.264  -1.399
   41   2HG2  ILE   6          HG2       ILE   6  10.278  -8.608  -0.992
   42   3HG2  ILE   6          HG2       ILE   6   9.037  -9.760  -1.488
   43   1HD1  ILE   6          HD1       ILE   6  12.415 -10.044   1.330
   44   2HD1  ILE   6          HD1       ILE   6  12.260 -10.419  -0.386
   45   3HD1  ILE   6          HD1       ILE   6  12.792 -11.664   0.745
   46    H    SER   7           HN       SER   7   9.465  -6.921   2.943
   47    HA   SER   7           HA       SER   7   7.402  -5.854   1.089
   48   1HB   SER   7          HB2       SER   7   6.619  -4.695   3.101
   49   2HB   SER   7          HB1       SER   7   6.875  -6.399   3.467
   50    HG   SER   7           HG       SER   7   8.236  -5.752   4.917
   51    H    LYS   8           HN       LYS   8  10.163  -5.422   0.384
   52    HA   LYS   8           HA       LYS   8  11.254  -2.945   1.271
   53   1HB   LYS   8          HB2       LYS   8  11.864  -4.980  -0.510
   54   2HB   LYS   8          HB1       LYS   8  11.627  -3.591  -1.571
   55   1HG   LYS   8          HG2       LYS   8  13.158  -2.288  -0.009
   56   2HG   LYS   8          HG1       LYS   8  13.546  -3.828   0.757
   57   1HD   LYS   8          HD2       LYS   8  15.013  -4.302  -0.878
   58   2HD   LYS   8          HD1       LYS   8  13.741  -4.142  -2.090
   59   1HE   LYS   8          HE2       LYS   8  15.273  -2.473  -2.747
   60   2HE   LYS   8          HE1       LYS   8  14.134  -1.553  -1.744
   61   1HZ   LYS   8          HZ1       LYS   8  16.771  -2.657  -0.977
   62   2HZ   LYS   8          HZ2       LYS   8  15.607  -2.237   0.188
   63   3HZ   LYS   8          HZ3       LYS   8  16.230  -1.054  -0.861
   64    H    THR   9           HN       THR   9  11.528  -1.458  -1.141
   65    HA   THR   9           HA       THR   9   9.087   0.117  -1.073
   66    HB   THR   9           HB       THR   9  11.168   0.374  -3.212
   67    HG1  THR   9           HG1      THR   9  11.608   1.011  -0.484
   68   1HG2  THR   9          HG2       THR   9   9.337   2.021  -2.950
   69   2HG2  THR   9          HG2       THR   9  10.918   2.750  -2.666
   70   3HG2  THR   9          HG2       THR   9   9.877   2.341  -1.303
   71    H    CYS  10           HN       CYS  10  10.560  -2.133  -3.410
   72    HA   CYS  10           HA       CYS  10   8.439  -1.739  -5.390
   73   1HB   CYS  10          HB2       CYS  10  10.619  -3.834  -5.110
   74   2HB   CYS  10          HB1       CYS  10   9.710  -3.480  -6.576
   75    H    CYS  11           HN       CYS  11   7.417  -3.951  -6.219
   76    HA   CYS  11           HA       CYS  11   6.686  -5.726  -3.940
   77   1HB   CYS  11          HB2       CYS  11   4.872  -3.953  -5.583
   78   2HB   CYS  11          HB1       CYS  11   4.253  -5.372  -4.740
   79    H    PHE  12           HN       PHE  12   5.544  -7.702  -4.735
   80    HA   PHE  12           HA       PHE  12   5.929  -8.229  -7.644
   81   1HB   PHE  12          HB2       PHE  12   7.195  -9.462  -5.265
   82   2HB   PHE  12          HB1       PHE  12   6.627 -10.598  -6.489
   83    HD1  PHE  12           HD1      PHE  12   7.597 -10.645  -8.722
   84    HD2  PHE  12           HD2      PHE  12   8.931  -7.802  -5.792
   85    HE1  PHE  12           HE1      PHE  12   9.570 -10.120 -10.130
   86    HE2  PHE  12           HE2      PHE  12  10.904  -7.276  -7.200
   87    HZ   PHE  12           HZ       PHE  12  11.224  -8.436  -9.369
   88    H    GLN  13           HN       GLN  13   4.817  -9.961  -4.709
   89    HA   GLN  13           HA       GLN  13   2.574 -11.136  -6.208
   90   1HB   GLN  13          HB2       GLN  13   2.235 -12.325  -4.056
   91   2HB   GLN  13          HB1       GLN  13   3.917 -12.416  -4.577
   92   1HG   GLN  13          HG2       GLN  13   4.501 -11.550  -2.581
   93   2HG   GLN  13          HG1       GLN  13   3.740 -10.041  -3.086
   94   1HE2  GLN  13          HE2       GLN  13   3.779 -11.811  -0.439
   95   2HE2  GLN  13          HE2       GLN  13   2.149 -11.779   0.032
   96    H    TYR  14           HN       TYR  14   0.331 -10.979  -5.192
   97    HA   TYR  14           HA       TYR  14  -0.121  -8.402  -3.768
   98   1HB   TYR  14          HB2       TYR  14  -1.539  -9.370  -6.268
   99   2HB   TYR  14          HB1       TYR  14  -1.889  -7.873  -5.404
  100    HD1  TYR  14           HD1      TYR  14   0.501  -6.563  -4.818
  101    HD2  TYR  14           HD2      TYR  14  -0.332  -9.042  -8.226
  102    HE1  TYR  14           HE1      TYR  14   2.282  -5.405  -6.098
  103    HE2  TYR  14           HE2      TYR  14   1.449  -7.884  -9.504
  104    HH   TYR  14           HH       TYR  14   2.556  -5.444  -9.314
  105    H    SER  15           HN       SER  15  -1.543  -8.697  -2.096
  106    HA   SER  15           HA       SER  15  -2.977 -11.272  -1.870
  107   1HB   SER  15          HB2       SER  15  -2.952  -8.975   0.087
  108   2HB   SER  15          HB1       SER  15  -3.126 -10.694   0.426
  109    HG   SER  15           HG       SER  15  -1.045 -10.430   0.822
  110    H    HIS  16           HN       HIS  16  -4.962 -11.300  -2.886
  111    HA   HIS  16           HA       HIS  16  -6.554  -8.813  -3.102
  112   1HB   HIS  16          HB2       HIS  16  -7.911 -10.197  -4.613
  113   2HB   HIS  16          HB1       HIS  16  -6.203 -10.371  -5.012
  114    HD1  HIS  16           HD1      HIS  16  -5.046 -12.633  -4.375
  115    HD2  HIS  16           HD2      HIS  16  -9.138 -12.535  -3.585
  116    HE1  HIS  16           HE1      HIS  16  -5.747 -15.026  -3.927
  117    H    LYS  17           HN       LYS  17  -6.247  -9.875  -0.424
  118    HA   LYS  17           HA       LYS  17  -8.974 -10.956   0.128
  119   1HB   LYS  17          HB2       LYS  17  -6.436 -11.826   0.841
  120   2HB   LYS  17          HB1       LYS  17  -6.992 -10.985   2.289
  121   1HG   LYS  17          HG2       LYS  17  -8.809 -12.417   2.588
  122   2HG   LYS  17          HG1       LYS  17  -8.843 -12.892   0.890
  123   1HD   LYS  17          HD2       LYS  17  -7.971 -14.745   2.206
  124   2HD   LYS  17          HD1       LYS  17  -6.664 -14.076   1.227
  125   1HE   LYS  17          HE2       LYS  17  -6.581 -12.569   3.585
  126   2HE   LYS  17          HE1       LYS  17  -6.872 -14.233   4.129
  127   1HZ   LYS  17          HZ1       LYS  17  -5.121 -14.902   2.472
  128   2HZ   LYS  17          HZ2       LYS  17  -4.551 -14.050   3.827
  129   3HZ   LYS  17          HZ3       LYS  17  -4.722 -13.259   2.334
  130    HA   PRO  18           HA       PRO  18  -9.907  -7.105   2.073
  131   1HB   PRO  18          HB2       PRO  18 -11.871  -7.910   3.798
  132   2HB   PRO  18          HB1       PRO  18 -12.126  -7.759   2.048
  133   1HG   PRO  18          HG2       PRO  18 -11.631 -10.191   3.684
  134   2HG   PRO  18          HG1       PRO  18 -12.703  -9.963   2.294
  135   1HD   PRO  18          HD2       PRO  18 -10.264 -11.184   2.140
  136   2HD   PRO  18          HD1       PRO  18 -11.031 -10.336   0.778
  137    H    LEU  19           HN       LEU  19  -8.106  -6.552   3.332
  138    HA   LEU  19           HA       LEU  19  -7.265  -7.991   5.692
  139   1HB   LEU  19          HB2       LEU  19  -5.955  -6.441   4.132
  140   2HB   LEU  19          HB1       LEU  19  -6.753  -5.096   4.947
  141    HG   LEU  19           HG       LEU  19  -5.889  -6.088   7.136
  142   1HD1  LEU  19          HD1       LEU  19  -5.361  -8.312   5.843
  143   2HD1  LEU  19          HD1       LEU  19  -4.256  -7.769   7.105
  144   3HD1  LEU  19          HD1       LEU  19  -3.862  -7.490   5.408
  145   1HD2  LEU  19          HD2       LEU  19  -4.690  -4.393   5.241
  146   2HD2  LEU  19          HD2       LEU  19  -3.404  -5.482   5.764
  147   3HD2  LEU  19          HD2       LEU  19  -4.281  -4.519   6.952
  148    HA   PRO  20           HA       PRO  20 -10.243  -6.396   8.549
  149   1HB   PRO  20          HB2       PRO  20  -8.787  -6.628  10.868
  150   2HB   PRO  20          HB1       PRO  20  -9.548  -8.011  10.053
  151   1HG   PRO  20          HG2       PRO  20  -6.716  -7.067   9.921
  152   2HG   PRO  20          HG1       PRO  20  -7.344  -8.716  10.092
  153   1HD   PRO  20          HD2       PRO  20  -6.479  -7.794   7.730
  154   2HD   PRO  20          HD1       PRO  20  -7.872  -8.892   7.842
  155    H    TRP  21           HN       TRP  21 -10.585  -4.214   8.399
  156    HA   TRP  21           HA       TRP  21  -8.721  -2.146   8.238
  157   1HB   TRP  21          HB2       TRP  21 -11.500  -2.244   9.440
  158   2HB   TRP  21          HB1       TRP  21 -10.660  -0.747   9.025
  159    HD1  TRP  21           HD1      TRP  21 -12.602  -3.585   7.519
  160    HE1  TRP  21           HE1      TRP  21 -12.806  -3.245   4.972
  161    HE3  TRP  21           HE3      TRP  21  -9.315   0.270   6.878
  162    HZ2  TRP  21           HZ2      TRP  21 -11.713  -1.563   2.934
  163    HZ3  TRP  21           HZ3      TRP  21  -8.915   1.219   4.624
  164    HH2  TRP  21           HH2      TRP  21 -10.110   0.309   2.652
  165    H    THR  22           HN       THR  22  -9.795  -3.861  11.112
  166    HA   THR  22           HA       THR  22  -9.054  -2.012  13.135
  167    HB   THR  22           HB       THR  22  -8.623  -4.252  14.389
  168    HG1  THR  22           HG1      THR  22  -9.252  -6.062  13.244
  169   1HG2  THR  22          HG2       THR  22 -11.135  -3.293  13.096
  170   2HG2  THR  22          HG2       THR  22 -10.731  -3.422  14.809
  171   3HG2  THR  22          HG2       THR  22 -11.174  -4.865  13.896
  172    H    TRP  23           HN       TRP  23  -7.103  -4.421  11.378
  173    HA   TRP  23           HA       TRP  23  -4.637  -3.505  12.734
  174   1HB   TRP  23          HB2       TRP  23  -5.367  -5.728  10.811
  175   2HB   TRP  23          HB1       TRP  23  -3.712  -5.435  11.334
  176    HD1  TRP  23           HD1      TRP  23  -6.192  -4.707  14.022
  177    HE1  TRP  23           HE1      TRP  23  -6.194  -6.605  15.765
  178    HE3  TRP  23           HE3      TRP  23  -3.444  -8.212  11.517
  179    HZ2  TRP  23           HZ2      TRP  23  -5.171  -9.259  16.058
  180    HZ3  TRP  23           HZ3      TRP  23  -2.976 -10.414  12.553
  181    HH2  TRP  23           HH2      TRP  23  -3.835 -10.942  14.818
  182    H    VAL  24           HN       VAL  24  -6.419  -2.679   9.948
  183    HA   VAL  24           HA       VAL  24  -4.101  -2.103   8.239
  184    HB   VAL  24           HB       VAL  24  -7.015  -1.284   8.027
  185   1HG1  VAL  24          HG1       VAL  24  -4.960  -1.650   5.836
  186   2HG1  VAL  24          HG1       VAL  24  -5.276  -0.091   6.596
  187   3HG1  VAL  24          HG1       VAL  24  -6.557  -0.913   5.704
  188   1HG2  VAL  24          HG2       VAL  24  -6.223  -3.430   6.275
  189   2HG2  VAL  24          HG2       VAL  24  -7.487  -3.430   7.502
  190   3HG2  VAL  24          HG2       VAL  24  -5.836  -3.869   7.939
  191    H    ARG  25           HN       ARG  25  -3.112  -0.072   8.044
  192    HA   ARG  25           HA       ARG  25  -4.196   2.097   9.813
  193   1HB   ARG  25          HB2       ARG  25  -1.963   0.773  10.270
  194   2HB   ARG  25          HB1       ARG  25  -1.310   1.836   9.024
  195   1HG   ARG  25          HG2       ARG  25  -2.954   3.185  11.080
  196   2HG   ARG  25          HG1       ARG  25  -1.437   2.502  11.665
  197   1HD   ARG  25          HD2       ARG  25  -0.526   3.670   9.405
  198   2HD   ARG  25          HD1       ARG  25  -1.881   4.755   9.770
  199    HE   ARG  25           HE       ARG  25  -0.612   5.547  11.586
  200   1HH1  ARG  25          HH1       ARG  25   0.732   2.600  10.434
  201   2HH1  ARG  25          HH1       ARG  25   1.743   2.363  11.818
  202   1HH2  ARG  25          HH2       ARG  25   0.515   5.109  13.536
  203   2HH2  ARG  25          HH2       ARG  25   1.624   3.779  13.568
  204    H    SER  26           HN       SER  26  -2.324   1.491   6.801
  205    HA   SER  26           HA       SER  26  -3.708   3.678   5.443
  206   1HB   SER  26          HB2       SER  26  -1.701   5.112   5.248
  207   2HB   SER  26          HB1       SER  26  -2.151   4.885   6.936
  208    HG   SER  26           HG       SER  26   0.123   4.575   6.438
  209    H    TYR  27           HN       TYR  27  -1.722   4.231   3.505
  210    HA   TYR  27           HA       TYR  27  -0.859   1.588   2.466
  211   1HB   TYR  27          HB2       TYR  27  -2.221   1.723   0.534
  212   2HB   TYR  27          HB1       TYR  27  -3.284   2.262   1.830
  213    HD1  TYR  27           HD1      TYR  27  -3.593   4.757   2.215
  214    HD2  TYR  27           HD2      TYR  27  -1.661   3.156  -1.270
  215    HE1  TYR  27           HE1      TYR  27  -3.922   6.915   1.041
  216    HE2  TYR  27           HE2      TYR  27  -1.990   5.313  -2.445
  217    HH   TYR  27           HH       TYR  27  -4.107   7.630  -1.468
  218    H    GLU  28           HN       GLU  28  -0.007   2.234  -0.004
  219    HA   GLU  28           HA       GLU  28   1.266   4.791  -0.320
  220   1HB   GLU  28          HB2       GLU  28   3.568   4.102   0.257
  221   2HB   GLU  28          HB1       GLU  28   2.508   3.946   1.657
  222   1HG   GLU  28          HG2       GLU  28   2.190   1.514   1.018
  223   2HG   GLU  28          HG1       GLU  28   3.474   1.736  -0.172
  224    H    PHE  29           HN       PHE  29   2.517   4.845  -2.310
  225    HA   PHE  29           HA       PHE  29   1.959   2.508  -4.079
  226   1HB   PHE  29          HB2       PHE  29   1.669   5.287  -4.283
  227   2HB   PHE  29          HB1       PHE  29   3.054   4.912  -5.309
  228    HD1  PHE  29           HD1      PHE  29   2.835   3.311  -7.189
  229    HD2  PHE  29           HD2      PHE  29  -0.552   4.514  -4.836
  230    HE1  PHE  29           HE1      PHE  29   1.309   2.429  -8.933
  231    HE2  PHE  29           HE2      PHE  29  -2.077   3.632  -6.581
  232    HZ   PHE  29           HZ       PHE  29  -1.146   2.589  -8.629
  233    H    THR  30           HN       THR  30   3.653   1.530  -5.278
  234    HA   THR  30           HA       THR  30   6.246   1.400  -4.082
  235    HB   THR  30           HB       THR  30   6.668   0.385  -6.517
  236    HG1  THR  30           HG1      THR  30   4.812   1.230  -7.439
  237   1HG2  THR  30          HG2       THR  30   5.875  -0.609  -4.063
  238   2HG2  THR  30          HG2       THR  30   6.331  -1.585  -5.459
  239   3HG2  THR  30          HG2       THR  30   4.632  -1.223  -5.153
  240    H    SER  31           HN       SER  31   8.310   2.027  -5.204
  241    HA   SER  31           HA       SER  31   8.250   4.824  -6.007
  242   1HB   SER  31          HB2       SER  31  10.022   3.090  -4.823
  243   2HB   SER  31          HB1       SER  31  10.693   3.224  -6.445
  244    HG   SER  31           HG       SER  31  11.337   4.851  -4.798
  245    H    ASN  32           HN       ASN  32   9.452   5.503  -8.064
  246    HA   ASN  32           HA       ASN  32   8.251   4.175 -10.376
  247   1HB   ASN  32          HB2       ASN  32   8.609   6.672  -9.954
  248   2HB   ASN  32          HB1       ASN  32  10.318   6.390 -10.292
  249   1HD2  ASN  32          HD2       ASN  32  10.167   7.715 -12.276
  250   2HD2  ASN  32          HD2       ASN  32   9.402   7.107 -13.664
  251    H    SER  33           HN       SER  33  11.365   4.175  -8.775
  252    HA   SER  33           HA       SER  33  12.957   3.190 -10.970
  253   1HB   SER  33          HB2       SER  33  13.453   4.206  -8.540
  254   2HB   SER  33          HB1       SER  33  13.545   2.497  -8.121
  255    HG   SER  33           HG       SER  33  15.185   4.052  -9.736
  256    H    CYS  34           HN       CYS  34  10.761   1.677  -8.703
  257    HA   CYS  34           HA       CYS  34  11.673  -1.005  -8.737
  258   1HB   CYS  34          HB2       CYS  34   8.941   0.290  -8.581
  259   2HB   CYS  34          HB1       CYS  34   9.182  -1.441  -8.341
  260    H    SER  35           HN       SER  35  10.763  -2.832 -10.005
  261    HA   SER  35           HA       SER  35  10.561  -2.141 -12.872
  262   1HB   SER  35          HB2       SER  35  11.280  -4.423 -11.161
  263   2HB   SER  35          HB1       SER  35  10.385  -4.880 -12.608
  264    HG   SER  35           HG       SER  35  12.711  -4.723 -12.866
  265    H    GLN  36           HN       GLN  36   8.335  -2.413 -10.389
  266    HA   GLN  36           HA       GLN  36   6.146  -2.946 -12.317
  267   1HB   GLN  36          HB2       GLN  36   7.240  -4.859 -10.468
  268   2HB   GLN  36          HB1       GLN  36   5.591  -4.468  -9.977
  269   1HG   GLN  36          HG2       GLN  36   5.376  -4.691 -12.727
  270   2HG   GLN  36          HG1       GLN  36   6.532  -5.958 -12.318
  271   1HE2  GLN  36          HE2       GLN  36   5.736  -7.823 -11.251
  272   2HE2  GLN  36          HE2       GLN  36   4.115  -8.022 -10.790
  273    H    ARG  37           HN       ARG  37   4.712  -1.309 -11.934
  274    HA   ARG  37           HA       ARG  37   4.735   0.202  -9.435
  275   1HB   ARG  37          HB2       ARG  37   2.914   0.251 -11.864
  276   2HB   ARG  37          HB1       ARG  37   3.009   1.511 -10.633
  277   1HG   ARG  37          HG2       ARG  37   5.523   1.620 -11.191
  278   2HG   ARG  37          HG1       ARG  37   5.115   0.696 -12.637
  279   1HD   ARG  37          HD2       ARG  37   4.602   2.679 -13.620
  280   2HD   ARG  37          HD1       ARG  37   3.199   2.757 -12.536
  281    HE   ARG  37           HE       ARG  37   5.881   3.756 -11.658
  282   1HH1  ARG  37          HH2       ARG  37   2.902   4.712 -12.907
  283   2HH1  ARG  37          HH2       ARG  37   2.594   5.922 -11.706
  284   1HH2  ARG  37          HH1       ARG  37   5.314   5.042  -9.742
  285   2HH2  ARG  37          HH1       ARG  37   3.959   6.107  -9.912
  286    H    ALA  38           HN       ALA  38   3.610  -0.473  -7.646
  287    HA   ALA  38           HA       ALA  38   0.933  -1.702  -8.017
  288   1HB   ALA  38          HB1       ALA  38   2.464  -3.058  -5.955
  289   2HB   ALA  38          HB2       ALA  38   3.294  -3.143  -7.508
  290   3HB   ALA  38          HB3       ALA  38   1.643  -3.746  -7.357
  291    H    VAL  39           HN       VAL  39  -0.434  -1.398  -6.182
  292    HA   VAL  39           HA       VAL  39   0.339   0.832  -4.419
  293    HB   VAL  39           HB       VAL  39  -2.172  -0.871  -4.603
  294   1HG1  VAL  39          HG1       VAL  39  -1.407   1.059  -2.710
  295   2HG1  VAL  39          HG1       VAL  39  -3.032   0.432  -2.978
  296   3HG1  VAL  39          HG1       VAL  39  -2.505   1.899  -3.804
  297   1HG2  VAL  39          HG2       VAL  39  -2.469   0.136  -6.600
  298   2HG2  VAL  39          HG2       VAL  39  -1.040   1.143  -6.364
  299   3HG2  VAL  39          HG2       VAL  39  -2.601   1.665  -5.731
  300    H    ILE  40           HN       ILE  40   0.364   0.634  -2.068
  301    HA   ILE  40           HA       ILE  40   0.550  -2.182  -1.067
  302    HB   ILE  40           HB       ILE  40   2.359   0.204  -0.603
  303   1HG1  ILE  40          HG1       ILE  40   3.230  -2.521  -1.498
  304   2HG1  ILE  40          HG1       ILE  40   2.477  -1.441  -2.673
  305   1HG2  ILE  40          HG2       ILE  40   2.377  -0.773   1.508
  306   2HG2  ILE  40          HG2       ILE  40   3.652  -1.687   0.702
  307   3HG2  ILE  40          HG2       ILE  40   2.042  -2.384   0.874
  308   1HD1  ILE  40          HD1       ILE  40   4.456  -0.048  -1.052
  309   2HD1  ILE  40          HD1       ILE  40   4.331  -0.161  -2.807
  310   3HD1  ILE  40          HD1       ILE  40   5.164  -1.423  -1.899
  311    H    PHE  41           HN       PHE  41  -0.402  -2.517   0.931
  312    HA   PHE  41           HA       PHE  41  -1.652  -0.149   2.283
  313   1HB   PHE  41          HB2       PHE  41  -2.508  -3.058   2.055
  314   2HB   PHE  41          HB1       PHE  41  -3.380  -1.826   2.967
  315    HD1  PHE  41           HD1      PHE  41  -3.240  -3.480  -0.115
  316    HD2  PHE  41           HD2      PHE  41  -3.794   0.432   1.558
  317    HE1  PHE  41           HE1      PHE  41  -4.399  -2.758  -2.185
  318    HE2  PHE  41           HE2      PHE  41  -4.953   1.158  -0.509
  319    HZ   PHE  41           HZ       PHE  41  -5.255  -0.440  -2.381
  320    H    THR  42           HN       THR  42  -0.840   0.184   4.354
  321    HA   THR  42           HA       THR  42   0.780  -2.016   5.543
  322    HB   THR  42           HB       THR  42   1.848   0.168   5.157
  323    HG1  THR  42           HG1      THR  42   2.749   0.258   7.120
  324   1HG2  THR  42          HG2       THR  42   1.026   2.090   6.603
  325   2HG2  THR  42          HG2       THR  42  -0.433   1.141   6.879
  326   3HG2  THR  42          HG2       THR  42  -0.015   1.660   5.247
  327    H    THR  43           HN       THR  43   0.545  -2.512   7.797
  328    HA   THR  43           HA       THR  43  -2.245  -2.105   8.775
  329    HB   THR  43           HB       THR  43  -1.700  -4.141  10.121
  330    HG1  THR  43           HG1      THR  43   0.318  -5.168   9.451
  331   1HG2  THR  43          HG2       THR  43  -2.465  -4.079   7.603
  332   2HG2  THR  43          HG2       THR  43  -1.970  -5.605   8.333
  333   3HG2  THR  43          HG2       THR  43  -0.849  -4.716   7.302
  334    H    LYS  44           HN       LYS  44  -1.967  -2.624  11.438
  335    HA   LYS  44           HA       LYS  44  -0.850  -0.130  12.466
  336   1HB   LYS  44          HB2       LYS  44  -2.229  -2.552  13.643
  337   2HB   LYS  44          HB1       LYS  44  -1.722  -1.179  14.628
  338   1HG   LYS  44          HG2       LYS  44  -3.290  -0.586  12.160
  339   2HG   LYS  44          HG1       LYS  44  -4.159  -1.287  13.527
  340   1HD   LYS  44          HD2       LYS  44  -2.878   0.536  14.918
  341   2HD   LYS  44          HD1       LYS  44  -2.707   1.336  13.356
  342   1HE   LYS  44          HE2       LYS  44  -5.285   0.904  13.130
  343   2HE   LYS  44          HE1       LYS  44  -5.223   0.731  14.896
  344   1HZ   LYS  44          HZ1       LYS  44  -5.554   3.057  14.177
  345   2HZ   LYS  44          HZ2       LYS  44  -4.053   3.006  13.384
  346   3HZ   LYS  44          HZ3       LYS  44  -4.130   2.844  15.074
  347    H    ARG  45           HN       ARG  45   0.217  -3.437  12.197
  348    HA   ARG  45           HA       ARG  45   2.216  -3.290  14.326
  349   1HB   ARG  45          HB2       ARG  45   1.784  -5.192  11.999
  350   2HB   ARG  45          HB1       ARG  45   2.850  -5.494  13.372
  351   1HG   ARG  45          HG2       ARG  45   0.794  -5.120  14.856
  352   2HG   ARG  45          HG1       ARG  45  -0.161  -5.240  13.377
  353   1HD   ARG  45          HD2       ARG  45   0.021  -7.499  13.375
  354   2HD   ARG  45          HD1       ARG  45   1.785  -7.402  13.542
  355    HE   ARG  45           HE       ARG  45   0.122  -6.869  15.949
  356   1HH1  ARG  45          HH2       ARG  45   3.118  -7.271  15.996
  357   2HH1  ARG  45          HH2       ARG  45   3.241  -8.907  16.551
  358   1HH2  ARG  45          HH1       ARG  45  -0.075  -9.664  15.875
  359   2HH2  ARG  45          HH1       ARG  45   1.434 -10.263  16.478
  360    H    GLY  46           HN       GLY  46   2.069  -2.225  11.047
  361   1HA   GLY  46          HA2       GLY  46   3.851  -0.765  10.209
  362   2HA   GLY  46          HA1       GLY  46   5.011  -1.738  11.113
  363    H    LYS  47           HN       LYS  47   2.980  -3.985   9.858
  364    HA   LYS  47           HA       LYS  47   4.874  -4.766   7.785
  365   1HB   LYS  47          HB2       LYS  47   2.431  -5.784   9.134
  366   2HB   LYS  47          HB1       LYS  47   2.715  -6.397   7.505
  367   1HG   LYS  47          HG2       LYS  47   5.200  -6.677   8.447
  368   2HG   LYS  47          HG1       LYS  47   4.336  -6.779   9.983
  369   1HD   LYS  47          HD2       LYS  47   2.799  -8.395   8.392
  370   2HD   LYS  47          HD1       LYS  47   4.410  -8.692   7.739
  371   1HE   LYS  47          HE2       LYS  47   5.255  -9.287   9.950
  372   2HE   LYS  47          HE1       LYS  47   3.698  -8.866  10.689
  373   1HZ   LYS  47          HZ1       LYS  47   3.908 -10.808   8.464
  374   2HZ   LYS  47          HZ2       LYS  47   2.608 -10.568   9.533
  375   3HZ   LYS  47          HZ3       LYS  47   4.042 -11.294  10.084
  376    H    LYS  48           HN       LYS  48   4.644  -4.442   5.570
  377    HA   LYS  48           HA       LYS  48   2.235  -2.894   4.699
  378   1HB   LYS  48          HB2       LYS  48   5.023  -3.091   3.518
  379   2HB   LYS  48          HB1       LYS  48   3.744  -2.007   2.970
  380   1HG   LYS  48          HG2       LYS  48   3.779  -1.338   5.580
  381   2HG   LYS  48          HG1       LYS  48   5.462  -1.838   5.394
  382   1HD   LYS  48          HD2       LYS  48   5.313  -0.356   3.199
  383   2HD   LYS  48          HD1       LYS  48   4.002   0.426   4.084
  384   1HE   LYS  48          HE2       LYS  48   5.578   1.628   5.185
  385   2HE   LYS  48          HE1       LYS  48   6.112   0.116   5.947
  386   1HZ   LYS  48          HZ1       LYS  48   6.957   1.042   3.253
  387   2HZ   LYS  48          HZ2       LYS  48   7.508  -0.346   4.062
  388   3HZ   LYS  48          HZ3       LYS  48   7.895   1.198   4.657
  389    H    VAL  49           HN       VAL  49   0.897  -3.855   3.233
  390    HA   VAL  49           HA       VAL  49   1.806  -6.401   1.947
  391    HB   VAL  49           HB       VAL  49  -0.974  -5.245   2.354
  392   1HG1  VAL  49          HG1       VAL  49  -0.757  -6.914   0.525
  393   2HG1  VAL  49          HG1       VAL  49  -1.718  -7.533   1.868
  394   3HG1  VAL  49          HG1       VAL  49  -0.045  -8.051   1.668
  395   1HG2  VAL  49          HG2       VAL  49   0.842  -6.846   4.096
  396   2HG2  VAL  49          HG2       VAL  49  -0.853  -7.333   4.055
  397   3HG2  VAL  49          HG2       VAL  49  -0.419  -5.695   4.543
  398    H    CYS  50           HN       CYS  50   2.120  -6.383  -0.255
  399    HA   CYS  50           HA       CYS  50   1.685  -3.915  -1.770
  400   1HB   CYS  50          HB2       CYS  50   2.708  -6.694  -2.424
  401   2HB   CYS  50          HB1       CYS  50   2.700  -5.364  -3.580
  402    H    THR  51           HN       THR  51   0.454  -3.893  -3.805
  403    HA   THR  51           HA       THR  51  -1.533  -6.001  -4.319
  404    HB   THR  51           HB       THR  51  -3.356  -4.131  -4.029
  405    HG1  THR  51           HG1      THR  51  -2.522  -2.354  -3.326
  406   1HG2  THR  51          HG2       THR  51  -3.866  -5.003  -1.926
  407   2HG2  THR  51          HG2       THR  51  -2.174  -5.081  -1.438
  408   3HG2  THR  51          HG2       THR  51  -2.813  -6.253  -2.589
  409    H    HIS  52           HN       HIS  52  -3.178  -4.888  -6.069
  410    HA   HIS  52           HA       HIS  52  -1.417  -3.469  -8.021
  411   1HB   HIS  52          HB2       HIS  52  -2.945  -5.864  -8.113
  412   2HB   HIS  52          HB1       HIS  52  -3.733  -4.710  -9.188
  413    HD1  HIS  52           HD1      HIS  52  -2.919  -5.475 -11.451
  414    HD2  HIS  52           HD2      HIS  52   0.198  -5.052  -8.716
  415    HE1  HIS  52           HE1      HIS  52  -0.771  -5.777 -12.760
  416    HA   PRO  53           HA       PRO  53  -4.335  -0.142  -7.691
  417   1HB   PRO  53          HB2       PRO  53  -3.645   1.230  -9.960
  418   2HB   PRO  53          HB1       PRO  53  -2.665   1.253  -8.480
  419   1HG   PRO  53          HG2       PRO  53  -2.278  -0.315 -10.980
  420   2HG   PRO  53          HG1       PRO  53  -1.078   0.476  -9.947
  421   1HD   PRO  53          HD2       PRO  53  -1.564  -2.203  -9.896
  422   2HD   PRO  53          HD1       PRO  53  -0.976  -1.288  -8.490
  423    H    ARG  54           HN       ARG  54  -4.161  -2.347 -10.370
  424    HA   ARG  54           HA       ARG  54  -6.409  -1.341 -11.895
  425   1HB   ARG  54          HB2       ARG  54  -4.423  -3.359 -12.026
  426   2HB   ARG  54          HB1       ARG  54  -5.977  -4.186 -12.129
  427   1HG   ARG  54          HG2       ARG  54  -6.461  -2.105 -13.787
  428   2HG   ARG  54          HG1       ARG  54  -4.722  -2.276 -14.025
  429   1HD   ARG  54          HD2       ARG  54  -5.608  -3.759 -15.636
  430   2HD   ARG  54          HD1       ARG  54  -5.289  -4.841 -14.265
  431    HE   ARG  54           HE       ARG  54  -7.772  -4.160 -13.628
  432   1HH1  ARG  54          HH2       ARG  54  -7.759  -2.990 -16.548
  433   2HH1  ARG  54          HH2       ARG  54  -8.667  -4.227 -17.353
  434   1HH2  ARG  54          HH1       ARG  54  -8.385  -6.499 -14.747
  435   2HH2  ARG  54          HH1       ARG  54  -9.022  -6.214 -16.333
  436    H    LYS  55           HN       LYS  55  -6.066  -3.549  -9.157
  437    HA   LYS  55           HA       LYS  55  -8.648  -4.776  -9.256
  438   1HB   LYS  55          HB2       LYS  55  -6.408  -4.378  -7.377
  439   2HB   LYS  55          HB1       LYS  55  -7.969  -4.622  -6.594
  440   1HG   LYS  55          HG2       LYS  55  -7.666  -6.833  -6.935
  441   2HG   LYS  55          HG1       LYS  55  -7.944  -6.510  -8.648
  442   1HD   LYS  55          HD2       LYS  55  -5.206  -6.024  -7.536
  443   2HD   LYS  55          HD1       LYS  55  -5.708  -7.689  -7.841
  444   1HE   LYS  55          HE2       LYS  55  -6.069  -5.554  -9.951
  445   2HE   LYS  55          HE1       LYS  55  -4.546  -6.451  -9.795
  446   1HZ   LYS  55          HZ1       LYS  55  -5.934  -8.516  -9.758
  447   2HZ   LYS  55          HZ2       LYS  55  -5.922  -7.699 -11.248
  448   3HZ   LYS  55          HZ3       LYS  55  -7.263  -7.567 -10.213
  449    H    LYS  56           HN       LYS  56 -10.599  -3.755  -9.071
  450    HA   LYS  56           HA       LYS  56 -10.984  -1.027  -8.418
  451   1HB   LYS  56          HB2       LYS  56 -12.505  -2.715  -9.595
  452   2HB   LYS  56          HB1       LYS  56 -12.974  -3.265  -7.986
  453   1HG   LYS  56          HG2       LYS  56 -13.078  -0.384  -8.096
  454   2HG   LYS  56          HG1       LYS  56 -14.029  -1.065  -9.416
  455   1HD   LYS  56          HD2       LYS  56 -14.279  -2.123  -6.600
  456   2HD   LYS  56          HD1       LYS  56 -15.217  -0.731  -7.143
  457   1HE   LYS  56          HE2       LYS  56 -15.269  -2.999  -9.031
  458   2HE   LYS  56          HE1       LYS  56 -16.027  -3.337  -7.462
  459   1HZ   LYS  56          HZ1       LYS  56 -17.412  -1.475  -7.650
  460   2HZ   LYS  56          HZ2       LYS  56 -17.469  -2.191  -9.189
  461   3HZ   LYS  56          HZ3       LYS  56 -16.512  -0.811  -8.926
  462    H    TRP  57           HN       TRP  57 -10.870  -3.879  -6.308
  463    HA   TRP  57           HA       TRP  57 -11.977  -2.563  -3.988
  464   1HB   TRP  57          HB2       TRP  57 -11.519  -4.607  -2.941
  465   2HB   TRP  57          HB1       TRP  57 -11.601  -5.094  -4.628
  466    HD1  TRP  57           HD1      TRP  57  -9.477  -6.118  -5.690
  467    HE1  TRP  57           HE1      TRP  57  -7.101  -6.629  -4.829
  468    HE3  TRP  57           HE3      TRP  57  -9.614  -3.664  -1.214
  469    HZ2  TRP  57           HZ2      TRP  57  -5.474  -6.061  -2.544
  470    HZ3  TRP  57           HZ3      TRP  57  -7.639  -3.672   0.283
  471    HH2  TRP  57           HH2      TRP  57  -5.573  -4.865  -0.375
  472    H    VAL  58           HN       VAL  58  -8.688  -2.923  -5.271
  473    HA   VAL  58           HA       VAL  58  -7.247  -1.898  -3.025
  474    HB   VAL  58           HB       VAL  58  -6.741  -1.741  -6.015
  475   1HG1  VAL  58          HG1       VAL  58  -4.592  -1.756  -3.921
  476   2HG1  VAL  58          HG1       VAL  58  -5.398  -0.237  -4.312
  477   3HG1  VAL  58          HG1       VAL  58  -4.539  -1.128  -5.568
  478   1HG2  VAL  58          HG2       VAL  58  -5.523  -3.804  -5.712
  479   2HG2  VAL  58          HG2       VAL  58  -7.101  -4.019  -4.961
  480   3HG2  VAL  58          HG2       VAL  58  -5.685  -3.702  -3.960
  481    H    GLN  59           HN       GLN  59  -8.700  -0.261  -5.854
  482    HA   GLN  59           HA       GLN  59  -7.870   2.396  -5.231
  483   1HB   GLN  59          HB2       GLN  59 -10.270   1.176  -6.626
  484   2HB   GLN  59          HB1       GLN  59 -10.010   2.919  -6.566
  485   1HG   GLN  59          HG2       GLN  59  -7.763   1.149  -7.468
  486   2HG   GLN  59          HG1       GLN  59  -9.072   1.511  -8.595
  487   1HE2  GLN  59          HE2       GLN  59  -6.369   2.492  -8.968
  488   2HE2  GLN  59          HE2       GLN  59  -6.413   4.183  -8.833
  489    H    LYS  60           HN       LYS  60 -10.351   0.296  -3.940
  490    HA   LYS  60           HA       LYS  60 -11.841   2.351  -2.536
  491   1HB   LYS  60          HB2       LYS  60 -11.983  -0.430  -3.130
  492   2HB   LYS  60          HB1       LYS  60 -12.055  -0.272  -1.375
  493   1HG   LYS  60          HG2       LYS  60 -13.684   1.701  -2.843
  494   2HG   LYS  60          HG1       LYS  60 -14.212   0.028  -3.034
  495   1HD   LYS  60          HD2       LYS  60 -14.463  -0.265  -0.677
  496   2HD   LYS  60          HD1       LYS  60 -13.599   1.233  -0.329
  497   1HE   LYS  60          HE2       LYS  60 -15.422   2.570  -0.869
  498   2HE   LYS  60          HE1       LYS  60 -16.081   1.382  -2.012
  499   1HZ   LYS  60          HZ1       LYS  60 -17.220   1.560   0.244
  500   2HZ   LYS  60          HZ2       LYS  60 -15.842   0.795   0.878
  501   3HZ   LYS  60          HZ3       LYS  60 -16.798   0.005  -0.285
  502    H    TYR  61           HN       TYR  61  -9.159   0.147  -1.754
  503    HA   TYR  61           HA       TYR  61  -9.116   0.893   1.070
  504   1HB   TYR  61          HB2       TYR  61  -7.596  -0.810  -0.840
  505   2HB   TYR  61          HB1       TYR  61  -6.733  -0.280   0.605
  506    HD1  TYR  61           HD1      TYR  61  -6.845  -1.700   2.438
  507    HD2  TYR  61           HD2      TYR  61 -10.172  -1.521  -0.275
  508    HE1  TYR  61           HE1      TYR  61  -8.036  -3.410   3.784
  509    HE2  TYR  61           HE2      TYR  61 -11.362  -3.229   1.073
  510    HH   TYR  61           HH       TYR  61 -11.065  -4.827   2.691
  511    H    ILE  62           HN       ILE  62  -7.389   1.865  -1.870
  512    HA   ILE  62           HA       ILE  62  -5.395   3.493  -0.572
  513    HB   ILE  62           HB       ILE  62  -6.679   3.663  -3.324
  514   1HG1  ILE  62          HG1       ILE  62  -4.054   2.365  -2.567
  515   2HG1  ILE  62          HG1       ILE  62  -5.569   1.464  -2.581
  516   1HG2  ILE  62          HG2       ILE  62  -3.898   4.453  -3.151
  517   2HG2  ILE  62          HG2       ILE  62  -4.879   5.422  -2.052
  518   3HG2  ILE  62          HG2       ILE  62  -5.273   5.367  -3.769
  519   1HD1  ILE  62          HD1       ILE  62  -4.275   1.309  -4.737
  520   2HD1  ILE  62          HD1       ILE  62  -4.527   3.041  -4.949
  521   3HD1  ILE  62          HD1       ILE  62  -5.909   1.946  -4.929
  522    H    SER  63           HN       SER  63  -8.725   4.031  -1.602
  523    HA   SER  63           HA       SER  63  -8.661   6.916  -1.089
  524   1HB   SER  63          HB2       SER  63 -11.078   6.684  -1.606
  525   2HB   SER  63          HB1       SER  63 -10.091   5.854  -2.805
  526    HG   SER  63           HG       SER  63 -11.437   4.286  -2.279
  527    H    LEU  64           HN       LEU  64  -9.651   3.968   0.592
  528    HA   LEU  64           HA       LEU  64 -10.909   5.381   2.825
  529   1HB   LEU  64          HB2       LEU  64 -10.295   2.598   1.956
  530   2HB   LEU  64          HB1       LEU  64 -10.497   2.849   3.689
  531    HG   LEU  64           HG       LEU  64 -12.485   3.762   1.591
  532   1HD1  LEU  64          HD1       LEU  64 -12.642   1.408   1.557
  533   2HD1  LEU  64          HD1       LEU  64 -13.866   1.885   2.733
  534   3HD1  LEU  64          HD1       LEU  64 -12.307   1.272   3.284
  535   1HD2  LEU  64          HD2       LEU  64 -13.381   3.390   4.350
  536   2HD2  LEU  64          HD2       LEU  64 -13.587   4.780   3.286
  537   3HD2  LEU  64          HD2       LEU  64 -12.102   4.598   4.219
  538    H    LEU  65           HN       LEU  65  -7.749   3.966   2.093
  539    HA   LEU  65           HA       LEU  65  -6.748   4.432   4.826
  540   1HB   LEU  65          HB2       LEU  65  -5.549   3.401   2.237
  541   2HB   LEU  65          HB1       LEU  65  -4.630   3.536   3.733
  542    HG   LEU  65           HG       LEU  65  -7.052   1.792   3.209
  543   1HD1  LEU  65          HD1       LEU  65  -5.035   0.314   4.407
  544   2HD1  LEU  65          HD1       LEU  65  -4.146   1.419   3.358
  545   3HD1  LEU  65          HD1       LEU  65  -5.378   0.358   2.678
  546   1HD2  LEU  65          HD2       LEU  65  -6.647   1.063   5.629
  547   2HD2  LEU  65          HD2       LEU  65  -7.403   2.641   5.418
  548   3HD2  LEU  65          HD2       LEU  65  -5.686   2.530   5.808
  549    H    LYS  66           HN       LYS  66  -7.524   6.624   2.669
  550    HA   LYS  66           HA       LYS  66  -5.301   8.058   1.786
  551   1HB   LYS  66          HB2       LYS  66  -6.841  10.054   2.114
  552   2HB   LYS  66          HB1       LYS  66  -7.552   8.703   1.235
  553   1HG   LYS  66          HG2       LYS  66  -8.941   8.104   2.999
  554   2HG   LYS  66          HG1       LYS  66  -7.874   8.807   4.215
  555   1HD   LYS  66          HD2       LYS  66  -8.731  10.918   3.951
  556   2HD   LYS  66          HD1       LYS  66  -9.041  10.688   2.230
  557   1HE   LYS  66          HE2       LYS  66 -10.915   9.078   2.924
  558   2HE   LYS  66          HE1       LYS  66 -10.718   9.731   4.563
  559   1HZ   LYS  66          HZ1       LYS  66 -12.288  11.118   3.505
  560   2HZ   LYS  66          HZ2       LYS  66 -11.367  11.217   2.081
  561   3HZ   LYS  66          HZ3       LYS  66 -10.833  11.991   3.497
  562    H    THR  67           HN       THR  67  -3.659   9.127   2.795
  563    HA   THR  67           HA       THR  67  -3.993  10.275   5.482
  564    HB   THR  67           HB       THR  67  -1.980   8.079   4.944
  565    HG1  THR  67           HG1      THR  67  -3.404   6.703   5.674
  566   1HG2  THR  67          HG2       THR  67  -2.536   9.935   7.165
  567   2HG2  THR  67          HG2       THR  67  -1.055   9.063   6.771
  568   3HG2  THR  67          HG2       THR  67  -2.350   8.251   7.650
  569    HA   PRO  68           HA       PRO  68  -0.700  11.946   2.492
  570   1HB   PRO  68          HB2       PRO  68  -1.992  14.221   1.687
  571   2HB   PRO  68          HB1       PRO  68  -2.114  12.680   0.816
  572   1HG   PRO  68          HG2       PRO  68  -4.022  13.922   2.735
  573   2HG   PRO  68          HG1       PRO  68  -4.345  13.041   1.233
  574   1HD   PRO  68          HD2       PRO  68  -4.615  11.926   3.694
  575   2HD   PRO  68          HD1       PRO  68  -4.182  10.991   2.246
  576    H    LYS  69           HN       LYS  69   0.317  12.282   4.617
  577    HA   LYS  69           HA       LYS  69  -0.443  14.709   6.123
  578   1HB   LYS  69          HB2       LYS  69   0.247  12.311   6.962
  579   2HB   LYS  69          HB1       LYS  69   1.889  12.910   6.718
  580   1HG   LYS  69          HG2       LYS  69   1.765  14.341   8.484
  581   2HG   LYS  69          HG1       LYS  69   0.090  14.774   8.138
  582   1HD   LYS  69          HD2       LYS  69  -0.005  13.586  10.194
  583   2HD   LYS  69          HD1       LYS  69  -0.515  12.419   8.973
  584   1HE   LYS  69          HE2       LYS  69   1.741  11.450   8.908
  585   2HE   LYS  69          HE1       LYS  69   2.306  12.655  10.082
  586   1HZ   LYS  69          HZ1       LYS  69   1.698  10.830  11.386
  587   2HZ   LYS  69          HZ2       LYS  69   0.303  10.511  10.470
  588   3HZ   LYS  69          HZ3       LYS  69   0.360  11.866  11.494
  589    H    GLN  70           HN       GLN  70   0.307  15.863   3.930
  590    HA   GLN  70           HA       GLN  70   3.120  16.750   4.397
  591   1HB   GLN  70          HB2       GLN  70   3.524  16.554   1.956
  592   2HB   GLN  70          HB1       GLN  70   3.121  14.991   2.667
  593   1HG   GLN  70          HG2       GLN  70   0.734  15.362   1.980
  594   2HG   GLN  70          HG1       GLN  70   1.252  16.822   1.137
  595   1HE2  GLN  70          HE2       GLN  70   1.752  16.494  -1.030
  596   2HE2  GLN  70          HE2       GLN  70   2.256  15.020  -1.704
  597    H    LEU  71           HN       LEU  71   3.522  18.743   2.858
  598    HA   LEU  71           HA       LEU  71   1.271  20.610   3.281
  599   1HB   LEU  71          HB2       LEU  71   2.989  22.282   2.736
  600   2HB   LEU  71          HB1       LEU  71   3.629  21.127   3.905
  601    HG   LEU  71           HG       LEU  71   4.098  20.117   1.257
  602   1HD1  LEU  71          HD1       LEU  71   4.641  23.028   1.707
  603   2HD1  LEU  71          HD1       LEU  71   4.177  22.192   0.224
  604   3HD1  LEU  71          HD1       LEU  71   5.834  22.081   0.817
  605   1HD2  LEU  71          HD2       LEU  71   5.315  19.903   3.601
  606   2HD2  LEU  71          HD2       LEU  71   6.233  21.289   3.010
  607   3HD2  LEU  71          HD2       LEU  71   6.239  19.775   2.104
  Start of MODEL    3
    1   1H    THR   1          HT1       THR   1  10.205  16.078  13.104
    2   2H    THR   1          HT2       THR   1   8.966  15.498  12.096
    3   3H    THR   1          HT3       THR   1   9.078  17.158  12.440
    4    HA   THR   1           HA       THR   1   9.973  16.998  10.299
    5    HB   THR   1           HB       THR   1  12.151  16.821  12.406
    6    HG1  THR   1           HG1      THR   1  11.943  19.137  12.223
    7   1HG2  THR   1          HG2       THR   1  12.957  16.556  10.043
    8   2HG2  THR   1          HG2       THR   1  13.562  18.010  10.838
    9   3HG2  THR   1          HG2       THR   1  12.242  18.125   9.674
   10    H    ARG   2           HN       ARG   2  10.828  15.679   8.674
   11    HA   ARG   2           HA       ARG   2  11.623  12.910   9.504
   12   1HB   ARG   2          HB2       ARG   2  10.046  14.131   7.280
   13   2HB   ARG   2          HB1       ARG   2  10.963  12.669   6.913
   14   1HG   ARG   2          HG2       ARG   2   9.193  11.542   7.764
   15   2HG   ARG   2          HG1       ARG   2   9.792  12.056   9.342
   16   1HD   ARG   2          HD2       ARG   2   8.345  14.004   9.334
   17   2HD   ARG   2          HD1       ARG   2   7.848  13.678   7.662
   18    HE   ARG   2           HE       ARG   2   7.177  11.335   8.798
   19   1HH1  ARG   2          HH1       ARG   2   7.437  13.166  11.362
   20   2HH1  ARG   2          HH1       ARG   2   5.756  13.441  11.674
   21   1HH2  ARG   2          HH2       ARG   2   4.720  12.286   8.573
   22   2HH2  ARG   2          HH2       ARG   2   4.217  12.943  10.094
   23    H    GLY   3           HN       GLY   3  13.708  12.311   9.043
   24   1HA   GLY   3          HA2       GLY   3  15.395  14.178   7.490
   25   2HA   GLY   3          HA1       GLY   3  15.976  12.822   8.457
   26    H    SER   4           HN       SER   4  14.188  10.846   7.328
   27    HA   SER   4           HA       SER   4  14.745  10.821   4.424
   28   1HB   SER   4          HB2       SER   4  15.860   8.641   6.192
   29   2HB   SER   4          HB1       SER   4  16.269   9.001   4.516
   30    HG   SER   4           HG       SER   4  17.473   9.870   6.672
   31    H    ASP   5           HN       ASP   5  13.787   8.837   3.409
   32    HA   ASP   5           HA       ASP   5  11.604   7.651   5.073
   33   1HB   ASP   5          HB2       ASP   5  11.567   9.295   2.688
   34   2HB   ASP   5          HB1       ASP   5  10.811   7.734   2.366
   35    H    ILE   6           HN       ILE   6  11.558   5.423   4.999
   36    HA   ILE   6           HA       ILE   6  13.260   4.083   2.923
   37    HB   ILE   6           HB       ILE   6  12.433   3.237   5.719
   38   1HG1  ILE   6          HG1       ILE   6  15.278   3.632   5.103
   39   2HG1  ILE   6          HG1       ILE   6  14.326   5.111   4.970
   40   1HG2  ILE   6          HG2       ILE   6  13.838   1.880   3.473
   41   2HG2  ILE   6          HG2       ILE   6  12.847   1.192   4.760
   42   3HG2  ILE   6          HG2       ILE   6  14.519   1.652   5.085
   43   1HD1  ILE   6          HD1       ILE   6  14.564   5.255   7.220
   44   2HD1  ILE   6          HD1       ILE   6  15.053   3.566   7.360
   45   3HD1  ILE   6          HD1       ILE   6  13.341   3.986   7.287
   46    H    SER   7           HN       SER   7  10.621   4.755   2.204
   47    HA   SER   7           HA       SER   7   8.955   2.353   2.654
   48   1HB   SER   7          HB2       SER   7   7.206   3.727   1.833
   49   2HB   SER   7          HB1       SER   7   8.244   4.844   2.714
   50    HG   SER   7           HG       SER   7   8.220   5.861   0.860
   51    H    LYS   8           HN       LYS   8  11.496   2.540   0.870
   52    HA   LYS   8           HA       LYS   8  10.503   2.146  -1.849
   53   1HB   LYS   8          HB2       LYS   8  13.138   1.872  -0.397
   54   2HB   LYS   8          HB1       LYS   8  12.977   1.428  -2.096
   55   1HG   LYS   8          HG2       LYS   8  11.806   3.837  -2.205
   56   2HG   LYS   8          HG1       LYS   8  12.866   4.122  -0.825
   57   1HD   LYS   8          HD2       LYS   8  14.281   2.716  -2.929
   58   2HD   LYS   8          HD1       LYS   8  13.584   4.217  -3.540
   59   1HE   LYS   8          HE2       LYS   8  15.158   5.432  -2.459
   60   2HE   LYS   8          HE1       LYS   8  14.750   4.652  -0.917
   61   1HZ   LYS   8          HZ1       LYS   8  17.064   4.216  -1.887
   62   2HZ   LYS   8          HZ2       LYS   8  16.269   3.215  -3.005
   63   3HZ   LYS   8          HZ3       LYS   8  16.172   2.881  -1.341
   64    H    THR   9           HN       THR   9   9.346   0.283  -2.257
   65    HA   THR   9           HA       THR   9  10.614  -2.316  -1.721
   66    HB   THR   9           HB       THR   9   7.946  -1.575  -0.484
   67    HG1  THR   9           HG1      THR   9   9.359  -0.576   0.777
   68   1HG2  THR   9          HG2       THR   9   7.792  -3.855  -0.607
   69   2HG2  THR   9          HG2       THR   9   8.810  -3.770   0.831
   70   3HG2  THR   9          HG2       THR   9   9.537  -4.067  -0.747
   71    H    CYS  10           HN       CYS  10  10.388  -3.017  -3.844
   72    HA   CYS  10           HA       CYS  10   8.255  -2.382  -5.622
   73   1HB   CYS  10          HB2       CYS  10  10.014  -4.855  -5.489
   74   2HB   CYS  10          HB1       CYS  10   9.185  -4.251  -6.921
   75    H    CYS  11           HN       CYS  11   7.148  -4.693  -6.567
   76    HA   CYS  11           HA       CYS  11   5.947  -6.178  -4.297
   77   1HB   CYS  11          HB2       CYS  11   4.583  -4.193  -6.099
   78   2HB   CYS  11          HB1       CYS  11   3.662  -5.524  -5.399
   79    H    PHE  12           HN       PHE  12   6.038  -8.283  -4.983
   80    HA   PHE  12           HA       PHE  12   5.881  -8.855  -7.899
   81   1HB   PHE  12          HB2       PHE  12   6.990 -10.228  -5.459
   82   2HB   PHE  12          HB1       PHE  12   6.704 -11.143  -6.941
   83    HD1  PHE  12           HD1      PHE  12   9.153  -9.415  -5.201
   84    HD2  PHE  12           HD2      PHE  12   7.496  -9.733  -9.150
   85    HE1  PHE  12           HE1      PHE  12  11.266  -8.537  -6.158
   86    HE2  PHE  12           HE2      PHE  12   9.608  -8.856 -10.107
   87    HZ   PHE  12           HZ       PHE  12  11.493  -8.257  -8.612
   88    H    GLN  13           HN       GLN  13   4.766 -10.372  -4.848
   89    HA   GLN  13           HA       GLN  13   2.558 -11.701  -6.262
   90   1HB   GLN  13          HB2       GLN  13   3.812 -11.690  -3.543
   91   2HB   GLN  13          HB1       GLN  13   2.170 -12.313  -3.697
   92   1HG   GLN  13          HG2       GLN  13   3.971 -13.292  -5.796
   93   2HG   GLN  13          HG1       GLN  13   4.478 -13.763  -4.174
   94   1HE2  GLN  13          HE2       GLN  13   3.741 -15.945  -5.427
   95   2HE2  GLN  13          HE2       GLN  13   2.143 -16.420  -5.107
   96    H    TYR  14           HN       TYR  14   0.322 -11.532  -5.100
   97    HA   TYR  14           HA       TYR  14  -0.213  -8.855  -3.955
   98   1HB   TYR  14          HB2       TYR  14  -1.396  -9.934  -6.532
   99   2HB   TYR  14          HB1       TYR  14  -1.948  -8.469  -5.719
  100    HD1  TYR  14           HD1      TYR  14   0.064  -6.807  -5.041
  101    HD2  TYR  14           HD2      TYR  14   0.164  -9.670  -8.241
  102    HE1  TYR  14           HE1      TYR  14   1.865  -5.509  -6.146
  103    HE2  TYR  14           HE2      TYR  14   1.965  -8.372  -9.346
  104    HH   TYR  14           HH       TYR  14   2.705  -5.840  -9.285
  105    H    SER  15           HN       SER  15  -2.270  -8.779  -2.861
  106    HA   SER  15           HA       SER  15  -3.373 -11.470  -2.233
  107   1HB   SER  15          HB2       SER  15  -2.600 -10.292  -0.316
  108   2HB   SER  15          HB1       SER  15  -3.304  -8.775  -0.869
  109    HG   SER  15           HG       SER  15  -4.763 -11.110  -0.162
  110    H    HIS  16           HN       HIS  16  -5.730 -11.683  -2.078
  111    HA   HIS  16           HA       HIS  16  -7.251  -9.646  -3.672
  112   1HB   HIS  16          HB2       HIS  16  -8.407 -11.614  -4.704
  113   2HB   HIS  16          HB1       HIS  16  -6.677 -11.588  -5.051
  114    HD1  HIS  16           HD1      HIS  16  -9.298 -13.509  -3.223
  115    HD2  HIS  16           HD2      HIS  16  -5.149 -13.563  -3.612
  116    HE1  HIS  16           HE1      HIS  16  -8.515 -15.708  -2.238
  117    H    LYS  17           HN       LYS  17  -7.484  -9.262  -1.075
  118    HA   LYS  17           HA       LYS  17 -10.205 -10.134  -0.426
  119   1HB   LYS  17          HB2       LYS  17  -9.471 -11.261   1.678
  120   2HB   LYS  17          HB1       LYS  17  -8.845 -12.072   0.241
  121   1HG   LYS  17          HG2       LYS  17  -6.746 -10.640   0.516
  122   2HG   LYS  17          HG1       LYS  17  -7.367 -10.210   2.110
  123   1HD   LYS  17          HD2       LYS  17  -7.634 -12.822   2.378
  124   2HD   LYS  17          HD1       LYS  17  -6.413 -12.869   1.106
  125   1HE   LYS  17          HE2       LYS  17  -5.155 -11.121   2.625
  126   2HE   LYS  17          HE1       LYS  17  -6.178 -11.800   3.906
  127   1HZ   LYS  17          HZ1       LYS  17  -4.732 -13.539   2.003
  128   2HZ   LYS  17          HZ2       LYS  17  -5.379 -13.940   3.522
  129   3HZ   LYS  17          HZ3       LYS  17  -3.982 -12.980   3.418
  130    HA   PRO  18           HA       PRO  18  -9.926  -6.247   1.640
  131   1HB   PRO  18          HB2       PRO  18 -12.076  -6.439   3.320
  132   2HB   PRO  18          HB1       PRO  18 -12.237  -6.172   1.573
  133   1HG   PRO  18          HG2       PRO  18 -12.581  -8.668   3.145
  134   2HG   PRO  18          HG1       PRO  18 -13.473  -8.091   1.730
  135   1HD   PRO  18          HD2       PRO  18 -11.518 -10.012   1.635
  136   2HD   PRO  18          HD1       PRO  18 -11.971  -8.979   0.262
  137    H    LEU  19           HN       LEU  19  -8.263  -5.991   3.087
  138    HA   LEU  19           HA       LEU  19  -7.703  -7.799   5.273
  139   1HB   LEU  19          HB2       LEU  19  -6.393  -5.874   3.834
  140   2HB   LEU  19          HB1       LEU  19  -6.698  -5.010   5.341
  141    HG   LEU  19           HG       LEU  19  -5.752  -7.763   5.745
  142   1HD1  LEU  19          HD1       LEU  19  -4.245  -7.610   4.009
  143   2HD1  LEU  19          HD1       LEU  19  -3.330  -6.730   5.233
  144   3HD1  LEU  19          HD1       LEU  19  -4.253  -5.847   4.018
  145   1HD2  LEU  19          HD2       LEU  19  -4.424  -6.697   7.444
  146   2HD2  LEU  19          HD2       LEU  19  -5.989  -5.885   7.452
  147   3HD2  LEU  19          HD2       LEU  19  -4.602  -5.118   6.679
  148    HA   PRO  20           HA       PRO  20 -10.466  -6.148   8.300
  149   1HB   PRO  20          HB2       PRO  20  -9.028  -6.636  10.589
  150   2HB   PRO  20          HB1       PRO  20  -9.888  -7.905   9.691
  151   1HG   PRO  20          HG2       PRO  20  -6.994  -7.174   9.625
  152   2HG   PRO  20          HG1       PRO  20  -7.750  -8.776   9.659
  153   1HD   PRO  20          HD2       PRO  20  -6.789  -7.706   7.383
  154   2HD   PRO  20          HD1       PRO  20  -8.230  -8.749   7.399
  155    H    TRP  21           HN       TRP  21 -10.578  -3.921   8.154
  156    HA   TRP  21           HA       TRP  21  -8.555  -2.015   8.178
  157   1HB   TRP  21          HB2       TRP  21 -11.397  -2.018   9.199
  158   2HB   TRP  21          HB1       TRP  21 -10.433  -0.541   9.140
  159    HD1  TRP  21           HD1      TRP  21 -12.241  -3.033   6.941
  160    HE1  TRP  21           HE1      TRP  21 -12.213  -2.193   4.501
  161    HE3  TRP  21           HE3      TRP  21  -9.017   0.900   7.400
  162    HZ2  TRP  21           HZ2      TRP  21 -10.981  -0.128   2.953
  163    HZ3  TRP  21           HZ3      TRP  21  -8.434   2.285   5.431
  164    HH2  TRP  21           HH2      TRP  21  -9.412   1.777   3.209
  165    H    THR  22           HN       THR  22  -9.823  -3.797  10.917
  166    HA   THR  22           HA       THR  22  -9.005  -2.127  13.062
  167    HB   THR  22           HB       THR  22  -8.815  -4.429  14.210
  168    HG1  THR  22           HG1      THR  22  -8.902  -6.120  12.979
  169   1HG2  THR  22          HG2       THR  22 -11.330  -3.865  12.616
  170   2HG2  THR  22          HG2       THR  22 -10.891  -3.037  14.109
  171   3HG2  THR  22          HG2       THR  22 -11.224  -4.768  14.127
  172    H    TRP  23           HN       TRP  23  -7.188  -4.436  11.082
  173    HA   TRP  23           HA       TRP  23  -4.695  -3.806  12.585
  174   1HB   TRP  23          HB2       TRP  23  -5.716  -6.005  10.818
  175   2HB   TRP  23          HB1       TRP  23  -3.977  -5.765  10.939
  176    HD1  TRP  23           HD1      TRP  23  -5.628  -4.815  14.111
  177    HE1  TRP  23           HE1      TRP  23  -5.342  -6.676  15.871
  178    HE3  TRP  23           HE3      TRP  23  -3.934  -8.596  11.126
  179    HZ2  TRP  23           HZ2      TRP  23  -4.507  -9.410  15.995
  180    HZ3  TRP  23           HZ3      TRP  23  -3.402 -10.816  12.089
  181    HH2  TRP  23           HH2      TRP  23  -3.687 -11.227  14.518
  182    H    VAL  24           HN       VAL  24  -6.320  -2.545   9.982
  183    HA   VAL  24           HA       VAL  24  -3.982  -2.296   8.196
  184    HB   VAL  24           HB       VAL  24  -6.805  -1.196   8.076
  185   1HG1  VAL  24          HG1       VAL  24  -6.118  -0.006   6.291
  186   2HG1  VAL  24          HG1       VAL  24  -5.536  -1.484   5.525
  187   3HG1  VAL  24          HG1       VAL  24  -4.464  -0.551   6.570
  188   1HG2  VAL  24          HG2       VAL  24  -5.975  -3.817   7.866
  189   2HG2  VAL  24          HG2       VAL  24  -5.929  -3.281   6.187
  190   3HG2  VAL  24          HG2       VAL  24  -7.427  -3.163   7.108
  191    H    ARG  25           HN       ARG  25  -2.602  -0.558   8.295
  192    HA   ARG  25           HA       ARG  25  -3.368   1.721  10.070
  193   1HB   ARG  25          HB2       ARG  25  -1.346   0.361  10.571
  194   2HB   ARG  25          HB1       ARG  25  -0.681   0.805   8.999
  195   1HG   ARG  25          HG2       ARG  25   0.109   2.725   9.858
  196   2HG   ARG  25          HG1       ARG  25  -1.525   3.198  10.327
  197   1HD   ARG  25          HD2       ARG  25  -1.184   1.610  12.357
  198   2HD   ARG  25          HD1       ARG  25   0.542   1.722  11.960
  199    HE   ARG  25           HE       ARG  25  -0.442   4.356  11.888
  200   1HH1  ARG  25          HH1       ARG  25   0.854   2.032  13.969
  201   2HH1  ARG  25          HH1       ARG  25   0.575   2.934  15.421
  202   1HH2  ARG  25          HH2       ARG  25  -1.241   5.427  13.837
  203   2HH2  ARG  25          HH2       ARG  25  -0.610   4.856  15.346
  204    H    SER  26           HN       SER  26  -1.613   1.153   6.973
  205    HA   SER  26           HA       SER  26  -2.979   3.453   5.750
  206   1HB   SER  26          HB2       SER  26  -1.034   4.848   5.595
  207   2HB   SER  26          HB1       SER  26  -1.118   4.321   7.271
  208    HG   SER  26           HG       SER  26   0.868   3.716   6.853
  209    H    TYR  27           HN       TYR  27  -0.957   3.898   3.761
  210    HA   TYR  27           HA       TYR  27  -0.340   1.260   2.590
  211   1HB   TYR  27          HB2       TYR  27  -1.832   1.473   0.748
  212   2HB   TYR  27          HB1       TYR  27  -2.788   1.953   2.144
  213    HD1  TYR  27           HD1      TYR  27  -3.544   4.238   2.428
  214    HD2  TYR  27           HD2      TYR  27  -0.937   3.172  -0.812
  215    HE1  TYR  27           HE1      TYR  27  -3.968   6.438   1.361
  216    HE2  TYR  27           HE2      TYR  27  -1.359   5.367  -1.880
  217    HH   TYR  27           HH       TYR  27  -2.220   7.863  -0.671
  218    H    GLU  28           HN       GLU  28   0.453   1.864   0.120
  219    HA   GLU  28           HA       GLU  28   1.692   4.439  -0.260
  220   1HB   GLU  28          HB2       GLU  28   4.012   3.766   0.255
  221   2HB   GLU  28          HB1       GLU  28   2.993   3.605   1.684
  222   1HG   GLU  28          HG2       GLU  28   2.646   1.153   0.867
  223   2HG   GLU  28          HG1       GLU  28   4.095   1.444  -0.097
  224    H    PHE  29           HN       PHE  29   2.374   4.578  -2.400
  225    HA   PHE  29           HA       PHE  29   1.924   2.261  -4.134
  226   1HB   PHE  29          HB2       PHE  29   2.411   5.179  -4.328
  227   2HB   PHE  29          HB1       PHE  29   2.988   4.232  -5.699
  228    HD1  PHE  29           HD1      PHE  29   0.017   3.930  -3.427
  229    HD2  PHE  29           HD2      PHE  29   1.456   4.314  -7.455
  230    HE1  PHE  29           HE1      PHE  29  -2.306   3.742  -4.273
  231    HE2  PHE  29           HE2      PHE  29  -0.867   4.126  -8.303
  232    HZ   PHE  29           HZ       PHE  29  -2.748   3.839  -6.712
  233    H    THR  30           HN       THR  30   3.578   1.286  -5.473
  234    HA   THR  30           HA       THR  30   6.070   0.735  -4.238
  235    HB   THR  30           HB       THR  30   6.560   0.194  -6.834
  236    HG1  THR  30           HG1      THR  30   4.848   1.153  -7.757
  237   1HG2  THR  30          HG2       THR  30   6.404  -1.633  -5.399
  238   2HG2  THR  30          HG2       THR  30   4.983  -1.867  -6.419
  239   3HG2  THR  30          HG2       THR  30   4.808  -1.163  -4.811
  240    H    SER  31           HN       SER  31   8.256   1.283  -5.319
  241    HA   SER  31           HA       SER  31   8.515   4.193  -5.461
  242   1HB   SER  31          HB2       SER  31  10.539   1.978  -5.903
  243   2HB   SER  31          HB1       SER  31  10.895   3.656  -5.502
  244    HG   SER  31           HG       SER  31  10.674   1.820  -3.792
  245    H    ASN  32           HN       ASN  32  10.139   4.958  -7.317
  246    HA   ASN  32           HA       ASN  32   8.794   4.348  -9.870
  247   1HB   ASN  32          HB2       ASN  32  10.175   6.269 -10.634
  248   2HB   ASN  32          HB1       ASN  32   9.284   6.653  -9.162
  249   1HD2  ASN  32          HD2       ASN  32  11.449   8.245  -9.517
  250   2HD2  ASN  32          HD2       ASN  32  12.745   7.779  -8.523
  251    H    SER  33           HN       SER  33  11.588   3.256  -8.194
  252    HA   SER  33           HA       SER  33  12.868   2.375 -10.740
  253   1HB   SER  33          HB2       SER  33  14.132   3.814  -9.110
  254   2HB   SER  33          HB1       SER  33  13.982   2.520  -7.925
  255    HG   SER  33           HG       SER  33  15.822   2.785  -9.763
  256    H    CYS  34           HN       CYS  34  10.634   0.892  -9.979
  257    HA   CYS  34           HA       CYS  34  11.810  -1.571  -8.729
  258   1HB   CYS  34          HB2       CYS  34   9.206  -0.139  -8.574
  259   2HB   CYS  34          HB1       CYS  34   9.125  -1.900  -8.563
  260    H    SER  35           HN       SER  35  11.621  -3.503  -9.896
  261    HA   SER  35           HA       SER  35  11.362  -3.487 -12.712
  262   1HB   SER  35          HB2       SER  35  12.443  -5.307 -11.628
  263   2HB   SER  35          HB1       SER  35  11.074  -5.586 -10.556
  264    HG   SER  35           HG       SER  35  11.420  -6.243 -13.261
  265    H    GLN  36           HN       GLN  36   8.918  -3.590 -10.223
  266    HA   GLN  36           HA       GLN  36   6.810  -3.728 -12.345
  267   1HB   GLN  36          HB2       GLN  36   7.458  -5.608 -10.255
  268   2HB   GLN  36          HB1       GLN  36   5.851  -4.939  -9.960
  269   1HG   GLN  36          HG2       GLN  36   6.269  -5.559 -12.780
  270   2HG   GLN  36          HG1       GLN  36   6.472  -6.981 -11.756
  271   1HE2  GLN  36          HE2       GLN  36   4.427  -7.940 -12.391
  272   2HE2  GLN  36          HE2       GLN  36   2.940  -7.270 -11.921
  273    H    ARG  37           HN       ARG  37   4.636  -2.955 -11.330
  274    HA   ARG  37           HA       ARG  37   5.146  -0.847  -9.278
  275   1HB   ARG  37          HB2       ARG  37   3.577   0.569 -10.661
  276   2HB   ARG  37          HB1       ARG  37   5.092   0.180 -11.473
  277   1HG   ARG  37          HG2       ARG  37   2.913  -1.780 -11.880
  278   2HG   ARG  37          HG1       ARG  37   2.637  -0.193 -12.595
  279   1HD   ARG  37          HD2       ARG  37   4.623  -0.334 -13.920
  280   2HD   ARG  37          HD1       ARG  37   5.223  -1.726 -12.996
  281    HE   ARG  37           HE       ARG  37   2.805  -2.641 -13.890
  282   1HH1  ARG  37          HH2       ARG  37   5.785  -2.883 -15.076
  283   2HH1  ARG  37          HH2       ARG  37   5.383  -2.823 -16.760
  284   1HH2  ARG  37          HH1       ARG  37   2.124  -1.774 -16.218
  285   2HH2  ARG  37          HH1       ARG  37   3.312  -2.195 -17.406
  286    H    ALA  38           HN       ALA  38   3.578  -0.740  -7.674
  287    HA   ALA  38           HA       ALA  38   0.856  -1.684  -8.063
  288   1HB   ALA  38          HB1       ALA  38   1.735  -3.860  -8.004
  289   2HB   ALA  38          HB2       ALA  38   1.310  -3.587  -6.314
  290   3HB   ALA  38          HB3       ALA  38   2.984  -3.422  -6.840
  291    H    VAL  39           HN       VAL  39  -0.430  -1.384  -6.110
  292    HA   VAL  39           HA       VAL  39   0.688   0.655  -4.291
  293    HB   VAL  39           HB       VAL  39  -2.051  -0.652  -4.432
  294   1HG1  VAL  39          HG1       VAL  39  -2.453   1.879  -3.560
  295   2HG1  VAL  39          HG1       VAL  39  -0.850   1.584  -2.890
  296   3HG1  VAL  39          HG1       VAL  39  -2.191   0.519  -2.469
  297   1HG2  VAL  39          HG2       VAL  39  -2.586   1.536  -5.682
  298   2HG2  VAL  39          HG2       VAL  39  -1.687   0.312  -6.577
  299   3HG2  VAL  39          HG2       VAL  39  -0.844   1.703  -5.895
  300    H    ILE  40           HN       ILE  40   0.678   0.339  -1.940
  301    HA   ILE  40           HA       ILE  40   0.588  -2.538  -1.115
  302    HB   ILE  40           HB       ILE  40   2.546  -0.330  -0.418
  303   1HG1  ILE  40          HG1       ILE  40   3.292  -2.971  -1.602
  304   2HG1  ILE  40          HG1       ILE  40   2.557  -1.770  -2.662
  305   1HG2  ILE  40          HG2       ILE  40   1.838  -2.151   1.379
  306   2HG2  ILE  40          HG2       ILE  40   3.530  -1.711   1.161
  307   3HG2  ILE  40          HG2       ILE  40   2.899  -3.181   0.420
  308   1HD1  ILE  40          HD1       ILE  40   5.254  -1.896  -1.874
  309   2HD1  ILE  40          HD1       ILE  40   4.567  -0.540  -0.979
  310   3HD1  ILE  40          HD1       ILE  40   4.464  -0.578  -2.740
  311    H    PHE  41           HN       PHE  41  -0.484  -2.930   0.806
  312    HA   PHE  41           HA       PHE  41  -1.646  -0.571   2.245
  313   1HB   PHE  41          HB2       PHE  41  -2.458  -3.475   1.899
  314   2HB   PHE  41          HB1       PHE  41  -3.262  -2.392   3.034
  315    HD1  PHE  41           HD1      PHE  41  -3.893  -3.823   0.084
  316    HD2  PHE  41           HD2      PHE  41  -3.400   0.146   1.649
  317    HE1  PHE  41           HE1      PHE  41  -5.295  -2.926  -1.752
  318    HE2  PHE  41           HE2      PHE  41  -4.801   1.044  -0.189
  319    HZ   PHE  41           HZ       PHE  41  -5.750  -0.493  -1.890
  320    H    THR  42           HN       THR  42  -0.749  -0.202   4.270
  321    HA   THR  42           HA       THR  42   0.898  -2.358   5.450
  322    HB   THR  42           HB       THR  42   0.871   0.251   6.761
  323    HG1  THR  42           HG1      THR  42   2.043   1.149   4.867
  324   1HG2  THR  42          HG2       THR  42   3.291   0.033   6.414
  325   2HG2  THR  42          HG2       THR  42   3.012  -1.326   5.326
  326   3HG2  THR  42          HG2       THR  42   2.615  -1.472   7.038
  327    H    THR  43           HN       THR  43   0.619  -2.984   7.658
  328    HA   THR  43           HA       THR  43  -2.160  -2.610   8.636
  329    HB   THR  43           HB       THR  43  -1.494  -4.607  10.045
  330    HG1  THR  43           HG1      THR  43   0.803  -4.005   9.817
  331   1HG2  THR  43          HG2       THR  43  -2.138  -5.964   8.340
  332   2HG2  THR  43          HG2       THR  43  -0.819  -5.433   7.296
  333   3HG2  THR  43          HG2       THR  43  -2.285  -4.462   7.427
  334    H    LYS  44           HN       LYS  44  -1.995  -3.039  11.276
  335    HA   LYS  44           HA       LYS  44  -0.777  -0.569  12.295
  336   1HB   LYS  44          HB2       LYS  44  -2.911  -2.407  12.926
  337   2HB   LYS  44          HB1       LYS  44  -1.919  -2.126  14.358
  338   1HG   LYS  44          HG2       LYS  44  -2.323   0.184  14.343
  339   2HG   LYS  44          HG1       LYS  44  -2.795   0.187  12.643
  340   1HD   LYS  44          HD2       LYS  44  -4.832  -1.105  13.221
  341   2HD   LYS  44          HD1       LYS  44  -4.369  -1.049  14.922
  342   1HE   LYS  44          HE2       LYS  44  -4.267   1.554  14.530
  343   2HE   LYS  44          HE1       LYS  44  -5.328   1.187  13.155
  344   1HZ   LYS  44          HZ1       LYS  44  -6.723   1.479  15.036
  345   2HZ   LYS  44          HZ2       LYS  44  -5.753   0.477  16.006
  346   3HZ   LYS  44          HZ3       LYS  44  -6.665  -0.190  14.736
  347    H    ARG  45           HN       ARG  45  -0.001  -3.956  12.215
  348    HA   ARG  45           HA       ARG  45   1.734  -3.935  14.570
  349   1HB   ARG  45          HB2       ARG  45   0.424  -5.867  13.448
  350   2HB   ARG  45          HB1       ARG  45   1.750  -5.910  12.286
  351   1HG   ARG  45          HG2       ARG  45   3.357  -6.188  14.160
  352   2HG   ARG  45          HG1       ARG  45   2.003  -6.221  15.291
  353   1HD   ARG  45          HD2       ARG  45   1.096  -8.152  13.769
  354   2HD   ARG  45          HD1       ARG  45   2.781  -8.271  13.226
  355    HE   ARG  45           HE       ARG  45   1.804  -8.995  15.869
  356   1HH1  ARG  45          HH1       ARG  45   3.772  -6.866  16.503
  357   2HH1  ARG  45          HH1       ARG  45   5.268  -7.738  16.565
  358   1HH2  ARG  45          HH2       ARG  45   4.027 -10.510  14.892
  359   2HH2  ARG  45          HH2       ARG  45   5.412  -9.801  15.653
  360    H    GLY  46           HN       GLY  46   2.091  -3.272  11.149
  361   1HA   GLY  46          HA2       GLY  46   4.081  -1.823  10.605
  362   2HA   GLY  46          HA1       GLY  46   5.033  -2.941  11.581
  363    H    LYS  47           HN       LYS  47   2.652  -4.599   9.818
  364    HA   LYS  47           HA       LYS  47   4.718  -5.632   7.973
  365   1HB   LYS  47          HB2       LYS  47   2.894  -6.855   9.509
  366   2HB   LYS  47          HB1       LYS  47   1.906  -6.634   8.065
  367   1HG   LYS  47          HG2       LYS  47   4.355  -7.525   7.073
  368   2HG   LYS  47          HG1       LYS  47   4.108  -8.490   8.528
  369   1HD   LYS  47          HD2       LYS  47   2.006  -9.306   7.752
  370   2HD   LYS  47          HD1       LYS  47   1.936  -8.109   6.458
  371   1HE   LYS  47          HE2       LYS  47   3.348  -9.311   5.095
  372   2HE   LYS  47          HE1       LYS  47   4.305  -9.922   6.459
  373   1HZ   LYS  47          HZ1       LYS  47   1.481 -10.710   6.102
  374   2HZ   LYS  47          HZ2       LYS  47   2.696 -11.490   6.997
  375   3HZ   LYS  47          HZ3       LYS  47   2.718 -11.545   5.298
  376    H    LYS  48           HN       LYS  48   4.750  -5.012   5.840
  377    HA   LYS  48           HA       LYS  48   2.483  -3.353   4.832
  378   1HB   LYS  48          HB2       LYS  48   5.186  -3.816   3.551
  379   2HB   LYS  48          HB1       LYS  48   4.091  -2.458   3.307
  380   1HG   LYS  48          HG2       LYS  48   4.545  -2.378   6.033
  381   2HG   LYS  48          HG1       LYS  48   6.114  -2.872   5.394
  382   1HD   LYS  48          HD2       LYS  48   4.544  -0.534   4.285
  383   2HD   LYS  48          HD1       LYS  48   5.764  -0.363   5.546
  384   1HE   LYS  48          HE2       LYS  48   6.844  -1.964   3.400
  385   2HE   LYS  48          HE1       LYS  48   6.216  -0.437   2.750
  386   1HZ   LYS  48          HZ1       LYS  48   7.843  -0.573   5.223
  387   2HZ   LYS  48          HZ2       LYS  48   7.447   0.803   4.308
  388   3HZ   LYS  48          HZ3       LYS  48   8.540  -0.345   3.694
  389    H    VAL  49           HN       VAL  49   1.239  -4.061   3.103
  390    HA   VAL  49           HA       VAL  49   1.972  -6.716   1.901
  391    HB   VAL  49           HB       VAL  49  -0.741  -5.453   2.419
  392   1HG1  VAL  49          HG1       VAL  49  -0.525  -8.353   1.961
  393   2HG1  VAL  49          HG1       VAL  49  -0.094  -7.376   0.557
  394   3HG1  VAL  49          HG1       VAL  49  -1.681  -7.193   1.305
  395   1HG2  VAL  49          HG2       VAL  49   0.468  -7.855   3.800
  396   2HG2  VAL  49          HG2       VAL  49  -0.935  -6.906   4.291
  397   3HG2  VAL  49          HG2       VAL  49   0.684  -6.220   4.425
  398    H    CYS  50           HN       CYS  50   1.863  -6.867  -0.361
  399    HA   CYS  50           HA       CYS  50   1.707  -4.320  -1.851
  400   1HB   CYS  50          HB2       CYS  50   2.527  -7.171  -2.390
  401   2HB   CYS  50          HB1       CYS  50   2.326  -6.037  -3.725
  402    H    THR  51           HN       THR  51   0.306  -4.111  -3.749
  403    HA   THR  51           HA       THR  51  -1.875  -6.041  -4.158
  404    HB   THR  51           HB       THR  51  -3.488  -3.993  -3.653
  405    HG1  THR  51           HG1      THR  51  -2.353  -2.393  -2.916
  406   1HG2  THR  51          HG2       THR  51  -3.089  -6.292  -2.432
  407   2HG2  THR  51          HG2       THR  51  -3.995  -5.013  -1.624
  408   3HG2  THR  51          HG2       THR  51  -2.300  -5.283  -1.220
  409    H    HIS  52           HN       HIS  52  -3.299  -5.294  -5.990
  410    HA   HIS  52           HA       HIS  52  -1.717  -3.722  -7.939
  411   1HB   HIS  52          HB2       HIS  52  -3.459  -5.994  -7.944
  412   2HB   HIS  52          HB1       HIS  52  -4.158  -4.765  -8.997
  413    HD1  HIS  52           HD1      HIS  52  -0.873  -6.605  -8.459
  414    HD2  HIS  52           HD2      HIS  52  -2.875  -4.505 -11.452
  415    HE1  HIS  52           HE1      HIS  52   0.510  -6.867 -10.565
  416    HA   PRO  53           HA       PRO  53  -4.417  -0.248  -7.325
  417   1HB   PRO  53          HB2       PRO  53  -3.683   1.215  -9.515
  418   2HB   PRO  53          HB1       PRO  53  -2.673   1.079  -8.063
  419   1HG   PRO  53          HG2       PRO  53  -2.422  -0.303 -10.679
  420   2HG   PRO  53          HG1       PRO  53  -1.162   0.284  -9.583
  421   1HD   PRO  53          HD2       PRO  53  -1.929  -2.347  -9.799
  422   2HD   PRO  53          HD1       PRO  53  -1.153  -1.640  -8.364
  423    H    ARG  54           HN       ARG  54  -4.391  -2.222 -10.206
  424    HA   ARG  54           HA       ARG  54  -6.559  -1.006 -11.641
  425   1HB   ARG  54          HB2       ARG  54  -4.763  -3.097 -11.949
  426   2HB   ARG  54          HB1       ARG  54  -6.315  -3.927 -11.817
  427   1HG   ARG  54          HG2       ARG  54  -7.237  -2.424 -13.575
  428   2HG   ARG  54          HG1       ARG  54  -5.644  -1.687 -13.747
  429   1HD   ARG  54          HD2       ARG  54  -4.707  -3.945 -14.313
  430   2HD   ARG  54          HD1       ARG  54  -6.360  -4.591 -14.282
  431    HE   ARG  54           HE       ARG  54  -5.387  -2.509 -16.192
  432   1HH1  ARG  54          HH2       ARG  54  -8.370  -2.743 -15.245
  433   2HH1  ARG  54          HH2       ARG  54  -9.038  -3.579 -16.606
  434   1HH2  ARG  54          HH1       ARG  54  -5.950  -4.485 -17.900
  435   2HH2  ARG  54          HH1       ARG  54  -7.667  -4.567 -18.109
  436    H    LYS  55           HN       LYS  55  -6.505  -3.707  -9.287
  437    HA   LYS  55           HA       LYS  55  -9.220  -4.423  -9.317
  438   1HB   LYS  55          HB2       LYS  55  -6.945  -4.472  -7.411
  439   2HB   LYS  55          HB1       LYS  55  -8.543  -4.699  -6.701
  440   1HG   LYS  55          HG2       LYS  55  -8.455  -6.847  -7.367
  441   2HG   LYS  55          HG1       LYS  55  -8.539  -6.271  -9.033
  442   1HD   LYS  55          HD2       LYS  55  -5.864  -6.045  -7.826
  443   2HD   LYS  55          HD1       LYS  55  -6.442  -7.705  -7.981
  444   1HE   LYS  55          HE2       LYS  55  -7.124  -6.938 -10.414
  445   2HE   LYS  55          HE1       LYS  55  -5.896  -5.687 -10.140
  446   1HZ   LYS  55          HZ1       LYS  55  -5.555  -8.627  -9.916
  447   2HZ   LYS  55          HZ2       LYS  55  -4.411  -7.510  -9.340
  448   3HZ   LYS  55          HZ3       LYS  55  -4.773  -7.581 -10.999
  449    H    LYS  56           HN       LYS  56 -11.042  -3.270  -8.851
  450    HA   LYS  56           HA       LYS  56 -11.090  -0.557  -8.040
  451   1HB   LYS  56          HB2       LYS  56 -12.926  -2.791  -8.487
  452   2HB   LYS  56          HB1       LYS  56 -13.514  -1.680  -7.250
  453   1HG   LYS  56          HG2       LYS  56 -12.586  -0.878 -10.024
  454   2HG   LYS  56          HG1       LYS  56 -14.267  -0.992  -9.504
  455   1HD   LYS  56          HD2       LYS  56 -12.978   0.593  -7.562
  456   2HD   LYS  56          HD1       LYS  56 -12.393   1.178  -9.119
  457   1HE   LYS  56          HE2       LYS  56 -15.208   0.701  -9.373
  458   2HE   LYS  56          HE1       LYS  56 -14.935   1.684  -7.920
  459   1HZ   LYS  56          HZ1       LYS  56 -14.950   3.219  -9.671
  460   2HZ   LYS  56          HZ2       LYS  56 -14.032   2.215 -10.689
  461   3HZ   LYS  56          HZ3       LYS  56 -13.302   2.970  -9.353
  462    H    TRP  57           HN       TRP  57 -11.487  -3.524  -6.075
  463    HA   TRP  57           HA       TRP  57 -12.127  -2.312  -3.611
  464   1HB   TRP  57          HB2       TRP  57 -11.897  -4.471  -2.859
  465   2HB   TRP  57          HB1       TRP  57 -11.745  -4.832  -4.572
  466    HD1  TRP  57           HD1      TRP  57  -9.503  -5.809  -5.397
  467    HE1  TRP  57           HE1      TRP  57  -7.261  -6.390  -4.263
  468    HE3  TRP  57           HE3      TRP  57 -10.235  -3.637  -0.834
  469    HZ2  TRP  57           HZ2      TRP  57  -5.953  -5.984  -1.751
  470    HZ3  TRP  57           HZ3      TRP  57  -8.478  -3.751   0.910
  471    HH2  TRP  57           HH2      TRP  57  -6.340  -4.920   0.458
  472    H    VAL  58           HN       VAL  58  -8.954  -2.766  -5.151
  473    HA   VAL  58           HA       VAL  58  -7.334  -1.906  -2.941
  474    HB   VAL  58           HB       VAL  58  -6.981  -1.816  -5.954
  475   1HG1  VAL  58          HG1       VAL  58  -4.467  -2.011  -4.844
  476   2HG1  VAL  58          HG1       VAL  58  -5.269  -0.885  -3.750
  477   3HG1  VAL  58          HG1       VAL  58  -5.177  -0.525  -5.473
  478   1HG2  VAL  58          HG2       VAL  58  -5.386  -3.793  -5.137
  479   2HG2  VAL  58          HG2       VAL  58  -7.099  -4.072  -5.449
  480   3HG2  VAL  58          HG2       VAL  58  -6.530  -3.837  -3.797
  481    H    GLN  59           HN       GLN  59  -8.527  -0.103  -5.809
  482    HA   GLN  59           HA       GLN  59  -7.540   2.458  -5.035
  483   1HB   GLN  59          HB2       GLN  59 -10.025   1.668  -6.601
  484   2HB   GLN  59          HB1       GLN  59  -9.234   3.243  -6.665
  485   1HG   GLN  59          HG2       GLN  59  -7.102   1.869  -7.297
  486   2HG   GLN  59          HG1       GLN  59  -8.253   0.596  -7.709
  487   1HE2  GLN  59          HE2       GLN  59  -6.882   1.516  -9.864
  488   2HE2  GLN  59          HE2       GLN  59  -7.824   2.569 -10.807
  489    H    LYS  60           HN       LYS  60 -10.360   0.595  -4.110
  490    HA   LYS  60           HA       LYS  60 -11.794   2.742  -2.807
  491   1HB   LYS  60          HB2       LYS  60 -12.701   0.547  -3.678
  492   2HB   LYS  60          HB1       LYS  60 -11.894  -0.252  -2.329
  493   1HG   LYS  60          HG2       LYS  60 -13.515   0.363  -0.886
  494   2HG   LYS  60          HG1       LYS  60 -13.456   2.038  -1.435
  495   1HD   LYS  60          HD2       LYS  60 -14.716   1.147  -3.536
  496   2HD   LYS  60          HD1       LYS  60 -15.100  -0.240  -2.515
  497   1HE   LYS  60          HE2       LYS  60 -15.692   2.658  -1.804
  498   2HE   LYS  60          HE1       LYS  60 -16.887   1.472  -2.367
  499   1HZ   LYS  60          HZ1       LYS  60 -15.226   1.336   0.089
  500   2HZ   LYS  60          HZ2       LYS  60 -16.095   0.009  -0.519
  501   3HZ   LYS  60          HZ3       LYS  60 -16.918   1.404  -0.008
  502    H    TYR  61           HN       TYR  61  -9.328   0.406  -1.840
  503    HA   TYR  61           HA       TYR  61  -9.535   1.006   1.012
  504   1HB   TYR  61          HB2       TYR  61  -8.083  -0.759  -0.825
  505   2HB   TYR  61          HB1       TYR  61  -7.080  -0.190   0.511
  506    HD1  TYR  61           HD1      TYR  61  -7.135  -1.397   2.499
  507    HD2  TYR  61           HD2      TYR  61 -10.563  -1.467  -0.089
  508    HE1  TYR  61           HE1      TYR  61  -8.256  -2.996   4.026
  509    HE2  TYR  61           HE2      TYR  61 -11.684  -3.067   1.439
  510    HH   TYR  61           HH       TYR  61 -10.052  -4.744   3.858
  511    H    ILE  62           HN       ILE  62  -7.275   1.812  -1.618
  512    HA   ILE  62           HA       ILE  62  -5.415   3.353  -0.130
  513    HB   ILE  62           HB       ILE  62  -6.434   3.649  -2.977
  514   1HG1  ILE  62          HG1       ILE  62  -3.880   2.283  -2.204
  515   2HG1  ILE  62          HG1       ILE  62  -5.398   1.410  -1.996
  516   1HG2  ILE  62          HG2       ILE  62  -4.829   5.207  -3.334
  517   2HG2  ILE  62          HG2       ILE  62  -3.634   4.302  -2.404
  518   3HG2  ILE  62          HG2       ILE  62  -4.770   5.369  -1.579
  519   1HD1  ILE  62          HD1       ILE  62  -5.922   1.542  -4.305
  520   2HD1  ILE  62          HD1       ILE  62  -4.205   1.142  -4.263
  521   3HD1  ILE  62          HD1       ILE  62  -4.717   2.798  -4.589
  522    H    SER  63           HN       SER  63  -8.576   4.205  -1.490
  523    HA   SER  63           HA       SER  63  -8.316   7.059  -0.951
  524   1HB   SER  63          HB2       SER  63 -10.800   6.931  -1.490
  525   2HB   SER  63          HB1       SER  63  -9.736   6.274  -2.732
  526    HG   SER  63           HG       SER  63 -10.428   4.312  -2.294
  527    H    LEU  64           HN       LEU  64  -9.872   4.291   0.667
  528    HA   LEU  64           HA       LEU  64 -11.065   5.897   2.776
  529   1HB   LEU  64          HB2       LEU  64 -10.882   3.119   1.886
  530   2HB   LEU  64          HB1       LEU  64 -10.847   3.257   3.644
  531    HG   LEU  64           HG       LEU  64 -12.858   4.884   2.142
  532   1HD1  LEU  64          HD1       LEU  64 -13.438   2.027   2.911
  533   2HD1  LEU  64          HD1       LEU  64 -12.834   2.428   1.304
  534   3HD1  LEU  64          HD1       LEU  64 -14.369   3.094   1.860
  535   1HD2  LEU  64          HD2       LEU  64 -13.862   5.015   4.192
  536   2HD2  LEU  64          HD2       LEU  64 -12.263   4.563   4.780
  537   3HD2  LEU  64          HD2       LEU  64 -13.509   3.331   4.581
  538    H    LEU  65           HN       LEU  65  -8.162   3.795   2.586
  539    HA   LEU  65           HA       LEU  65  -7.334   4.004   5.278
  540   1HB   LEU  65          HB2       LEU  65  -6.203   3.324   2.656
  541   2HB   LEU  65          HB1       LEU  65  -5.001   3.977   3.767
  542    HG   LEU  65           HG       LEU  65  -6.855   1.634   4.308
  543   1HD1  LEU  65          HD1       LEU  65  -4.548   1.606   2.866
  544   2HD1  LEU  65          HD1       LEU  65  -5.086   0.251   3.858
  545   3HD1  LEU  65          HD1       LEU  65  -3.907   1.394   4.493
  546   1HD2  LEU  65          HD2       LEU  65  -4.929   1.679   6.283
  547   2HD2  LEU  65          HD2       LEU  65  -6.580   2.268   6.472
  548   3HD2  LEU  65          HD2       LEU  65  -5.283   3.393   6.068
  549    H    LYS  66           HN       LYS  66  -6.933   6.271   2.592
  550    HA   LYS  66           HA       LYS  66  -6.574   8.534   4.339
  551   1HB   LYS  66          HB2       LYS  66  -4.392   7.026   4.405
  552   2HB   LYS  66          HB1       LYS  66  -4.042   7.848   2.885
  553   1HG   LYS  66          HG2       LYS  66  -3.404   9.697   3.994
  554   2HG   LYS  66          HG1       LYS  66  -4.972   9.782   4.797
  555   1HD   LYS  66          HD2       LYS  66  -4.113   8.006   6.404
  556   2HD   LYS  66          HD1       LYS  66  -2.515   8.267   5.704
  557   1HE   LYS  66          HE2       LYS  66  -2.228  10.178   6.893
  558   2HE   LYS  66          HE1       LYS  66  -3.822  10.789   6.411
  559   1HZ   LYS  66          HZ1       LYS  66  -3.158   8.939   8.623
  560   2HZ   LYS  66          HZ2       LYS  66  -4.729   9.023   7.979
  561   3HZ   LYS  66          HZ3       LYS  66  -4.025  10.395   8.694
  562    H    THR  67           HN       THR  67  -5.993  10.523   3.053
  563    HA   THR  67           HA       THR  67  -6.807  10.211   0.197
  564    HB   THR  67           HB       THR  67  -6.969  12.703   1.896
  565    HG1  THR  67           HG1      THR  67  -8.126  11.224   3.032
  566   1HG2  THR  67          HG2       THR  67  -8.877  11.854  -0.262
  567   2HG2  THR  67          HG2       THR  67  -7.318  12.553  -0.703
  568   3HG2  THR  67          HG2       THR  67  -8.456  13.480   0.275
  569    HA   PRO  68           HA       PRO  68  -2.527  11.614  -0.249
  570   1HB   PRO  68          HB2       PRO  68  -2.324  11.042  -2.916
  571   2HB   PRO  68          HB1       PRO  68  -2.144   9.814  -1.648
  572   1HG   PRO  68          HG2       PRO  68  -4.475  10.403  -3.393
  573   2HG   PRO  68          HG1       PRO  68  -3.864   8.849  -2.811
  574   1HD   PRO  68          HD2       PRO  68  -6.033  10.131  -1.746
  575   2HD   PRO  68          HD1       PRO  68  -5.016   8.984  -0.846
  576    H    LYS  69           HN       LYS  69  -5.364  12.551  -2.105
  577    HA   LYS  69           HA       LYS  69  -4.220  15.271  -2.396
  578   1HB   LYS  69          HB2       LYS  69  -4.887  15.223  -4.825
  579   2HB   LYS  69          HB1       LYS  69  -3.576  14.111  -4.430
  580   1HG   LYS  69          HG2       LYS  69  -4.817  12.449  -5.307
  581   2HG   LYS  69          HG1       LYS  69  -5.947  12.664  -3.970
  582   1HD   LYS  69          HD2       LYS  69  -6.772  14.692  -5.524
  583   2HD   LYS  69          HD1       LYS  69  -6.133  13.634  -6.782
  584   1HE   LYS  69          HE2       LYS  69  -7.770  12.241  -4.751
  585   2HE   LYS  69          HE1       LYS  69  -8.661  13.402  -5.756
  586   1HZ   LYS  69          HZ1       LYS  69  -7.989  12.364  -7.704
  587   2HZ   LYS  69          HZ2       LYS  69  -8.299  11.047  -6.677
  588   3HZ   LYS  69          HZ3       LYS  69  -6.701  11.550  -6.958
  589    H    GLN  70           HN       GLN  70  -5.798  16.838  -2.165
  590    HA   GLN  70           HA       GLN  70  -8.633  15.889  -1.953
  591   1HB   GLN  70          HB2       GLN  70  -7.054  17.089  -0.106
  592   2HB   GLN  70          HB1       GLN  70  -7.755  18.517  -0.871
  593   1HG   GLN  70          HG2       GLN  70  -9.848  18.079  -0.075
  594   2HG   GLN  70          HG1       GLN  70  -9.667  16.335  -0.277
  595   1HE2  GLN  70          HE2       GLN  70  -9.673  15.274   1.702
  596   2HE2  GLN  70          HE2       GLN  70  -9.034  15.894   3.147
  597    H    LEU  71           HN       LEU  71 -10.278  17.548  -2.649
  598    HA   LEU  71           HA       LEU  71  -9.264  19.394  -4.777
  599   1HB   LEU  71          HB2       LEU  71 -10.110  17.064  -5.523
  600   2HB   LEU  71          HB1       LEU  71 -11.713  17.651  -5.075
  601    HG   LEU  71           HG       LEU  71 -11.161  19.699  -6.556
  602   1HD1  LEU  71          HD1       LEU  71  -9.515  19.301  -8.314
  603   2HD1  LEU  71          HD1       LEU  71  -9.159  17.703  -7.657
  604   3HD1  LEU  71          HD1       LEU  71  -8.732  19.148  -6.741
  605   1HD2  LEU  71          HD2       LEU  71 -12.812  18.398  -7.502
  606   2HD2  LEU  71          HD2       LEU  71 -11.861  16.918  -7.379
  607   3HD2  LEU  71          HD2       LEU  71 -11.528  18.076  -8.668
  Start of MODEL    4
    1   1H    THR   1          HT1       THR   1  14.570  -4.086  15.341
    2   2H    THR   1          HT2       THR   1  13.819  -3.890  16.853
    3   3H    THR   1          HT3       THR   1  15.040  -2.815  16.360
    4    HA   THR   1           HA       THR   1  13.090  -1.605  15.985
    5    HB   THR   1           HB       THR   1  13.816  -3.090  13.438
    6    HG1  THR   1           HG1      THR   1  15.699  -2.324  14.019
    7   1HG2  THR   1          HG2       THR   1  13.026  -0.194  13.697
    8   2HG2  THR   1          HG2       THR   1  11.805  -1.454  13.519
    9   3HG2  THR   1          HG2       THR   1  13.015  -1.216  12.258
   10    H    ARG   2           HN       ARG   2  12.778  -5.022  15.337
   11    HA   ARG   2           HA       ARG   2  10.882  -6.417  15.214
   12   1HB   ARG   2          HB2       ARG   2  10.298  -4.160  16.927
   13   2HB   ARG   2          HB1       ARG   2   8.833  -4.676  16.092
   14   1HG   ARG   2          HG2       ARG   2   8.849  -6.776  17.062
   15   2HG   ARG   2          HG1       ARG   2  10.600  -6.780  17.274
   16   1HD   ARG   2          HD2       ARG   2   9.771  -6.488  19.481
   17   2HD   ARG   2          HD1       ARG   2  10.159  -4.832  18.969
   18    HE   ARG   2           HE       ARG   2   7.609  -5.016  18.102
   19   1HH1  ARG   2          HH1       ARG   2   8.687  -4.030  20.926
   20   2HH1  ARG   2          HH1       ARG   2   7.441  -4.692  21.932
   21   1HH2  ARG   2          HH2       ARG   2   6.156  -6.742  19.448
   22   2HH2  ARG   2          HH2       ARG   2   6.007  -6.223  21.094
   23    H    GLY   3           HN       GLY   3   9.097  -3.392  14.676
   24   1HA   GLY   3          HA2       GLY   3   8.569  -4.338  11.884
   25   2HA   GLY   3          HA1       GLY   3   7.358  -3.516  12.869
   26    H    SER   4           HN       SER   4   8.119  -2.550  10.329
   27    HA   SER   4           HA       SER   4   8.929   0.174  11.040
   28   1HB   SER   4          HB2       SER   4  10.896  -0.044   9.347
   29   2HB   SER   4          HB1       SER   4  11.118  -0.706  10.963
   30    HG   SER   4           HG       SER   4  11.519  -2.017   8.858
   31    H    ASP   5           HN       ASP   5   8.994   1.549   8.978
   32    HA   ASP   5           HA       ASP   5   6.892   0.585   7.109
   33   1HB   ASP   5          HB2       ASP   5   8.036   3.313   7.772
   34   2HB   ASP   5          HB1       ASP   5   6.741   3.040   6.607
   35    H    ILE   6           HN       ILE   6  10.254   0.804   7.210
   36    HA   ILE   6           HA       ILE   6  10.531   1.518   4.333
   37    HB   ILE   6           HB       ILE   6  12.618   0.890   6.437
   38   1HG1  ILE   6          HG1       ILE   6  11.683   3.639   5.567
   39   2HG1  ILE   6          HG1       ILE   6  11.040   2.827   6.994
   40   1HG2  ILE   6          HG2       ILE   6  13.225   2.788   4.279
   41   2HG2  ILE   6          HG2       ILE   6  12.862   1.164   3.698
   42   3HG2  ILE   6          HG2       ILE   6  14.163   1.413   4.862
   43   1HD1  ILE   6          HD1       ILE   6  13.605   2.505   7.569
   44   2HD1  ILE   6          HD1       ILE   6  12.784   4.019   7.951
   45   3HD1  ILE   6          HD1       ILE   6  13.791   3.902   6.509
   46    H    SER   7           HN       SER   7   9.300  -1.029   5.155
   47    HA   SER   7           HA       SER   7  11.039  -3.254   5.070
   48   1HB   SER   7          HB2       SER   7   8.447  -2.941   5.365
   49   2HB   SER   7          HB1       SER   7   8.405  -3.171   3.619
   50    HG   SER   7           HG       SER   7   9.771  -5.098   4.124
   51    H    LYS   8           HN       LYS   8   9.660  -1.323   2.419
   52    HA   LYS   8           HA       LYS   8  11.845  -1.839   0.623
   53   1HB   LYS   8          HB2       LYS   8  10.650  -3.388  -0.910
   54   2HB   LYS   8          HB1       LYS   8  10.869  -4.108   0.682
   55   1HG   LYS   8          HG2       LYS   8   8.548  -3.248   1.265
   56   2HG   LYS   8          HG1       LYS   8   8.355  -2.861  -0.445
   57   1HD   LYS   8          HD2       LYS   8   8.271  -5.073  -1.083
   58   2HD   LYS   8          HD1       LYS   8   9.309  -5.603   0.241
   59   1HE   LYS   8          HE2       LYS   8   7.316  -6.382   1.098
   60   2HE   LYS   8          HE1       LYS   8   7.148  -4.702   1.645
   61   1HZ   LYS   8          HZ1       LYS   8   6.156  -5.848  -0.912
   62   2HZ   LYS   8          HZ2       LYS   8   6.133  -4.191  -0.534
   63   3HZ   LYS   8          HZ3       LYS   8   5.211  -5.286   0.380
   64    H    THR   9           HN       THR   9  10.633  -1.573  -1.830
   65    HA   THR   9           HA       THR   9   8.805   0.786  -1.542
   66    HB   THR   9           HB       THR   9  11.073   0.533  -3.534
   67    HG1  THR   9           HG1      THR   9  11.057   1.936  -1.071
   68   1HG2  THR   9          HG2       THR   9   9.854   2.266  -4.367
   69   2HG2  THR   9          HG2       THR   9  10.638   3.181  -3.080
   70   3HG2  THR   9          HG2       THR   9   9.013   2.538  -2.841
   71    H    CYS  10           HN       CYS  10  10.168  -1.587  -3.859
   72    HA   CYS  10           HA       CYS  10   7.983  -1.269  -5.757
   73   1HB   CYS  10          HB2       CYS  10  10.064  -3.454  -5.407
   74   2HB   CYS  10          HB1       CYS  10   9.137  -3.132  -6.869
   75    H    CYS  11           HN       CYS  11   7.475  -4.023  -6.332
   76    HA   CYS  11           HA       CYS  11   6.271  -5.154  -3.863
   77   1HB   CYS  11          HB2       CYS  11   4.879  -3.839  -6.136
   78   2HB   CYS  11          HB1       CYS  11   4.161  -5.343  -5.561
   79    H    PHE  12           HN       PHE  12   5.195  -7.341  -4.464
   80    HA   PHE  12           HA       PHE  12   6.458  -8.605  -6.843
   81   1HB   PHE  12          HB2       PHE  12   6.821  -9.233  -3.928
   82   2HB   PHE  12          HB1       PHE  12   6.917 -10.542  -5.105
   83    HD1  PHE  12           HD1      PHE  12   8.559  -7.588  -3.747
   84    HD2  PHE  12           HD2      PHE  12   8.604 -10.448  -6.952
   85    HE1  PHE  12           HE1      PHE  12  10.872  -6.903  -4.326
   86    HE2  PHE  12           HE2      PHE  12  10.917  -9.763  -7.530
   87    HZ   PHE  12           HZ       PHE  12  12.050  -7.992  -6.217
   88    H    GLN  13           HN       GLN  13   4.653  -9.803  -3.995
   89    HA   GLN  13           HA       GLN  13   2.708 -11.068  -5.857
   90   1HB   GLN  13          HB2       GLN  13   2.177 -12.440  -3.865
   91   2HB   GLN  13          HB1       GLN  13   3.908 -12.461  -4.202
   92   1HG   GLN  13          HG2       GLN  13   4.392 -11.481  -2.229
   93   2HG   GLN  13          HG1       GLN  13   3.175 -10.229  -2.477
   94   1HE2  GLN  13          HE2       GLN  13   3.789 -13.354  -0.980
   95   2HE2  GLN  13          HE2       GLN  13   2.305 -13.467  -0.165
   96    H    TYR  14           HN       TYR  14   0.399 -11.182  -4.633
   97    HA   TYR  14           HA       TYR  14  -0.209  -8.539  -3.403
   98   1HB   TYR  14          HB2       TYR  14  -1.686  -9.793  -5.738
   99   2HB   TYR  14          HB1       TYR  14  -2.034  -8.228  -5.006
  100    HD1  TYR  14           HD1      TYR  14   0.252  -6.724  -4.748
  101    HD2  TYR  14           HD2      TYR  14  -0.513  -9.711  -7.739
  102    HE1  TYR  14           HE1      TYR  14   1.921  -5.658  -6.240
  103    HE2  TYR  14           HE2      TYR  14   1.155  -8.645  -9.231
  104    HH   TYR  14           HH       TYR  14   2.760  -7.085  -9.389
  105    H    SER  15           HN       SER  15  -2.187  -8.560  -2.153
  106    HA   SER  15           HA       SER  15  -3.089 -11.304  -1.406
  107   1HB   SER  15          HB2       SER  15  -2.044  -9.202   0.072
  108   2HB   SER  15          HB1       SER  15  -3.778  -9.059   0.351
  109    HG   SER  15           HG       SER  15  -2.003 -11.125   0.995
  110    H    HIS  16           HN       HIS  16  -5.020 -11.757  -2.420
  111    HA   HIS  16           HA       HIS  16  -6.904  -9.558  -3.061
  112   1HB   HIS  16          HB2       HIS  16  -6.595 -12.479  -3.751
  113   2HB   HIS  16          HB1       HIS  16  -8.075 -11.607  -4.151
  114    HD1  HIS  16           HD1      HIS  16  -7.617  -9.264  -5.541
  115    HD2  HIS  16           HD2      HIS  16  -4.602 -12.142  -5.640
  116    HE1  HIS  16           HE1      HIS  16  -6.128  -8.674  -7.503
  117    H    LYS  17           HN       LYS  17  -7.601  -9.111  -0.844
  118    HA   LYS  17           HA       LYS  17  -9.950 -10.563  -0.029
  119   1HB   LYS  17          HB2       LYS  17  -8.978 -11.558   2.045
  120   2HB   LYS  17          HB1       LYS  17  -8.255 -12.239   0.588
  121   1HG   LYS  17          HG2       LYS  17  -6.461 -10.393   0.851
  122   2HG   LYS  17          HG1       LYS  17  -7.077 -10.222   2.495
  123   1HD   LYS  17          HD2       LYS  17  -6.224 -12.883   1.333
  124   2HD   LYS  17          HD1       LYS  17  -5.127 -11.834   2.234
  125   1HE   LYS  17          HE2       LYS  17  -6.846 -11.853   4.122
  126   2HE   LYS  17          HE1       LYS  17  -7.657 -13.164   3.243
  127   1HZ   LYS  17          HZ1       LYS  17  -5.894 -13.873   4.886
  128   2HZ   LYS  17          HZ2       LYS  17  -4.752 -13.194   3.827
  129   3HZ   LYS  17          HZ3       LYS  17  -5.729 -14.486   3.314
  130    HA   PRO  18           HA       PRO  18 -10.295  -6.680   2.057
  131   1HB   PRO  18          HB2       PRO  18 -12.410  -7.236   3.699
  132   2HB   PRO  18          HB1       PRO  18 -12.588  -6.957   1.955
  133   1HG   PRO  18          HG2       PRO  18 -12.549  -9.515   3.469
  134   2HG   PRO  18          HG1       PRO  18 -13.522  -9.046   2.066
  135   1HD   PRO  18          HD2       PRO  18 -11.307 -10.643   1.914
  136   2HD   PRO  18          HD1       PRO  18 -11.887  -9.626   0.576
  137    H    LEU  19           HN       LEU  19  -8.522  -6.409   3.420
  138    HA   LEU  19           HA       LEU  19  -7.949  -8.108   5.695
  139   1HB   LEU  19          HB2       LEU  19  -6.661  -6.226   4.135
  140   2HB   LEU  19          HB1       LEU  19  -6.869  -5.369   5.662
  141    HG   LEU  19           HG       LEU  19  -6.028  -8.109   6.119
  142   1HD1  LEU  19          HD1       LEU  19  -4.576  -6.475   4.083
  143   2HD1  LEU  19          HD1       LEU  19  -4.750  -8.226   4.199
  144   3HD1  LEU  19          HD1       LEU  19  -3.611  -7.381   5.249
  145   1HD2  LEU  19          HD2       LEU  19  -4.448  -7.031   7.568
  146   2HD2  LEU  19          HD2       LEU  19  -5.920  -6.063   7.646
  147   3HD2  LEU  19          HD2       LEU  19  -4.558  -5.518   6.668
  148    HA   PRO  20           HA       PRO  20 -10.581  -6.197   8.682
  149   1HB   PRO  20          HB2       PRO  20  -9.125  -6.623  10.965
  150   2HB   PRO  20          HB1       PRO  20 -10.024  -7.911  10.138
  151   1HG   PRO  20          HG2       PRO  20  -7.115  -7.270  10.039
  152   2HG   PRO  20          HG1       PRO  20  -7.922  -8.846  10.104
  153   1HD   PRO  20          HD2       PRO  20  -6.913  -7.801   7.813
  154   2HD   PRO  20          HD1       PRO  20  -8.321  -8.885   7.843
  155    H    TRP  21           HN       TRP  21 -10.612  -3.978   8.430
  156    HA   TRP  21           HA       TRP  21  -8.557  -2.131   8.300
  157   1HB   TRP  21          HB2       TRP  21 -11.311  -1.974   9.547
  158   2HB   TRP  21          HB1       TRP  21 -10.321  -0.549   9.221
  159    HD1  TRP  21           HD1      TRP  21 -12.594  -3.018   7.575
  160    HE1  TRP  21           HE1      TRP  21 -12.747  -2.525   5.048
  161    HE3  TRP  21           HE3      TRP  21  -8.815   0.384   7.113
  162    HZ2  TRP  21           HZ2      TRP  21 -11.435  -0.904   3.092
  163    HZ3  TRP  21           HZ3      TRP  21  -8.288   1.386   4.908
  164    HH2  TRP  21           HH2      TRP  21  -9.592   0.748   2.899
  165    H    THR  22           HN       THR  22  -9.737  -3.744  11.192
  166    HA   THR  22           HA       THR  22  -8.732  -2.013  13.205
  167    HB   THR  22           HB       THR  22  -8.503  -4.340  14.398
  168    HG1  THR  22           HG1      THR  22  -8.344  -5.535  12.475
  169   1HG2  THR  22          HG2       THR  22 -11.056  -4.550  14.349
  170   2HG2  THR  22          HG2       THR  22 -11.037  -3.206  13.206
  171   3HG2  THR  22          HG2       THR  22 -10.409  -2.985  14.840
  172    H    TRP  23           HN       TRP  23  -7.122  -4.422  11.182
  173    HA   TRP  23           HA       TRP  23  -4.525  -3.901  12.537
  174   1HB   TRP  23          HB2       TRP  23  -5.793  -6.046  10.912
  175   2HB   TRP  23          HB1       TRP  23  -4.058  -5.833  10.693
  176    HD1  TRP  23           HD1      TRP  23  -5.128  -4.903  14.131
  177    HE1  TRP  23           HE1      TRP  23  -4.504  -6.771  15.793
  178    HE3  TRP  23           HE3      TRP  23  -3.917  -8.632  10.855
  179    HZ2  TRP  23           HZ2      TRP  23  -3.612  -9.486  15.742
  180    HZ3  TRP  23           HZ3      TRP  23  -3.185 -10.847  11.690
  181    HH2  TRP  23           HH2      TRP  23  -3.032 -11.280  14.127
  182    H    VAL  24           HN       VAL  24  -6.262  -2.577  10.018
  183    HA   VAL  24           HA       VAL  24  -3.960  -2.296   8.182
  184    HB   VAL  24           HB       VAL  24  -6.796  -1.237   8.019
  185   1HG1  VAL  24          HG1       VAL  24  -5.029  -1.863   5.677
  186   2HG1  VAL  24          HG1       VAL  24  -4.768  -0.356   6.556
  187   3HG1  VAL  24          HG1       VAL  24  -6.332  -0.682   5.809
  188   1HG2  VAL  24          HG2       VAL  24  -6.712  -3.297   6.266
  189   2HG2  VAL  24          HG2       VAL  24  -7.235  -3.494   7.938
  190   3HG2  VAL  24          HG2       VAL  24  -5.584  -3.904   7.479
  191    H    ARG  25           HN       ARG  25  -2.779  -0.385   8.028
  192    HA   ARG  25           HA       ARG  25  -3.595   1.835   9.873
  193   1HB   ARG  25          HB2       ARG  25  -1.460   0.435  10.205
  194   2HB   ARG  25          HB1       ARG  25  -0.839   1.257   8.774
  195   1HG   ARG  25          HG2       ARG  25  -1.986   3.229  10.499
  196   2HG   ARG  25          HG1       ARG  25  -0.908   2.218  11.461
  197   1HD   ARG  25          HD2       ARG  25   0.819   2.529   9.578
  198   2HD   ARG  25          HD1       ARG  25  -0.234   3.829   8.988
  199    HE   ARG  25           HE       ARG  25   0.710   3.807  11.827
  200   1HH1  ARG  25          HH1       ARG  25   2.540   5.040   9.736
  201   2HH1  ARG  25          HH1       ARG  25   2.076   6.707   9.819
  202   1HH2  ARG  25          HH2       ARG  25  -0.876   6.073  11.524
  203   2HH2  ARG  25          HH2       ARG  25   0.141   7.291  10.830
  204    H    SER  26           HN       SER  26  -2.068   1.199   6.686
  205    HA   SER  26           HA       SER  26  -3.449   3.418   5.437
  206   1HB   SER  26          HB2       SER  26  -1.518   4.917   5.235
  207   2HB   SER  26          HB1       SER  26  -1.824   4.583   6.936
  208    HG   SER  26           HG       SER  26  -0.083   3.294   7.007
  209    H    TYR  27           HN       TYR  27  -1.300   3.989   3.545
  210    HA   TYR  27           HA       TYR  27  -0.603   1.344   2.406
  211   1HB   TYR  27          HB2       TYR  27  -1.893   1.712   0.409
  212   2HB   TYR  27          HB1       TYR  27  -2.963   2.070   1.759
  213    HD1  TYR  27           HD1      TYR  27  -1.402   3.345  -1.212
  214    HD2  TYR  27           HD2      TYR  27  -3.232   4.497   2.496
  215    HE1  TYR  27           HE1      TYR  27  -1.747   5.631  -2.096
  216    HE2  TYR  27           HE2      TYR  27  -3.581   6.784   1.615
  217    HH   TYR  27           HH       TYR  27  -3.249   7.558  -1.675
  218    H    GLU  28           HN       GLU  28   0.231   2.129  -0.085
  219    HA   GLU  28           HA       GLU  28   1.660   4.608  -0.234
  220   1HB   GLU  28          HB2       GLU  28   3.954   3.645   0.190
  221   2HB   GLU  28          HB1       GLU  28   2.937   3.722   1.626
  222   1HG   GLU  28          HG2       GLU  28   2.267   1.258   0.776
  223   2HG   GLU  28          HG1       GLU  28   3.894   1.350   0.104
  224    H    PHE  29           HN       PHE  29   1.995   4.870  -2.385
  225    HA   PHE  29           HA       PHE  29   1.710   2.626  -4.243
  226   1HB   PHE  29          HB2       PHE  29   1.458   5.461  -4.189
  227   2HB   PHE  29          HB1       PHE  29   2.651   5.076  -5.428
  228    HD1  PHE  29           HD1      PHE  29  -0.722   5.631  -4.961
  229    HD2  PHE  29           HD2      PHE  29   1.924   2.789  -6.797
  230    HE1  PHE  29           HE1      PHE  29  -2.540   4.931  -6.495
  231    HE2  PHE  29           HE2      PHE  29   0.106   2.088  -8.330
  232    HZ   PHE  29           HZ       PHE  29  -2.126   3.160  -8.180
  233    H    THR  30           HN       THR  30   3.360   1.917  -5.720
  234    HA   THR  30           HA       THR  30   6.047   1.834  -4.625
  235    HB   THR  30           HB       THR  30   6.403   0.681  -6.920
  236    HG1  THR  30           HG1      THR  30   4.836   0.983  -8.257
  237   1HG2  THR  30          HG2       THR  30   4.427  -0.187  -4.817
  238   2HG2  THR  30          HG2       THR  30   6.080  -0.745  -5.073
  239   3HG2  THR  30          HG2       THR  30   4.804  -1.229  -6.190
  240    H    SER  31           HN       SER  31   7.977   2.532  -5.953
  241    HA   SER  31           HA       SER  31   7.636   5.302  -6.852
  242   1HB   SER  31          HB2       SER  31  10.081   5.238  -6.893
  243   2HB   SER  31          HB1       SER  31   9.507   4.452  -5.426
  244    HG   SER  31           HG       SER  31  10.663   2.838  -6.123
  245    H    ASN  32           HN       ASN  32   9.254   5.727  -8.908
  246    HA   ASN  32           HA       ASN  32   7.936   4.376 -11.168
  247   1HB   ASN  32          HB2       ASN  32   8.427   6.858 -10.935
  248   2HB   ASN  32          HB1       ASN  32  10.134   6.463 -11.142
  249   1HD2  ASN  32          HD2       ASN  32   7.000   5.705 -12.785
  250   2HD2  ASN  32          HD2       ASN  32   7.626   5.852 -14.356
  251    H    SER  33           HN       SER  33  10.865   4.016  -9.370
  252    HA   SER  33           HA       SER  33  12.312   2.710 -11.590
  253   1HB   SER  33          HB2       SER  33  12.862   3.786  -8.882
  254   2HB   SER  33          HB1       SER  33  13.856   2.418  -9.377
  255    HG   SER  33           HG       SER  33  13.499   4.908 -10.688
  256    H    CYS  34           HN       CYS  34   9.798   1.533 -10.358
  257    HA   CYS  34           HA       CYS  34  10.956  -0.994  -9.239
  258   1HB   CYS  34          HB2       CYS  34   8.336   0.479  -8.955
  259   2HB   CYS  34          HB1       CYS  34   8.461  -1.227  -8.524
  260    H    SER  35           HN       SER  35  10.948  -2.694 -10.658
  261    HA   SER  35           HA       SER  35   9.804  -2.622 -13.267
  262   1HB   SER  35          HB2       SER  35  11.336  -4.361 -11.580
  263   2HB   SER  35          HB1       SER  35  10.054  -5.309 -12.328
  264    HG   SER  35           HG       SER  35  12.023  -3.694 -13.574
  265    H    GLN  36           HN       GLN  36   8.577  -3.964 -10.207
  266    HA   GLN  36           HA       GLN  36   6.043  -4.756 -11.566
  267   1HB   GLN  36          HB2       GLN  36   7.265  -6.375 -10.145
  268   2HB   GLN  36          HB1       GLN  36   7.136  -5.266  -8.779
  269   1HG   GLN  36          HG2       GLN  36   5.193  -6.313  -8.292
  270   2HG   GLN  36          HG1       GLN  36   4.518  -5.471  -9.688
  271   1HE2  GLN  36          HE2       GLN  36   4.911  -8.543  -8.394
  272   2HE2  GLN  36          HE2       GLN  36   4.792  -9.450  -9.823
  273    H    ARG  37           HN       ARG  37   5.696  -2.249 -11.700
  274    HA   ARG  37           HA       ARG  37   5.238  -0.572  -9.493
  275   1HB   ARG  37          HB2       ARG  37   3.996  -0.878 -12.226
  276   2HB   ARG  37          HB1       ARG  37   3.467   0.403 -11.135
  277   1HG   ARG  37          HG2       ARG  37   6.203   0.612 -10.966
  278   2HG   ARG  37          HG1       ARG  37   5.975   0.154 -12.655
  279   1HD   ARG  37          HD2       ARG  37   4.189   1.997 -12.765
  280   2HD   ARG  37          HD1       ARG  37   4.837   2.560 -11.211
  281    HE   ARG  37           HE       ARG  37   7.009   2.900 -12.306
  282   1HH1  ARG  37          HH1       ARG  37   4.734   4.198 -14.022
  283   2HH1  ARG  37          HH1       ARG  37   5.316   3.819 -15.609
  284   1HH2  ARG  37          HH2       ARG  37   7.613   1.474 -14.496
  285   2HH2  ARG  37          HH2       ARG  37   6.945   2.278 -15.878
  286    H    ALA  38           HN       ALA  38   3.687  -0.559  -7.885
  287    HA   ALA  38           HA       ALA  38   1.005  -1.605  -8.272
  288   1HB   ALA  38          HB1       ALA  38   3.206  -3.304  -7.279
  289   2HB   ALA  38          HB2       ALA  38   1.665  -3.772  -7.998
  290   3HB   ALA  38          HB3       ALA  38   1.747  -3.347  -6.289
  291    H    VAL  39           HN       VAL  39  -0.162  -1.659  -6.061
  292    HA   VAL  39           HA       VAL  39   0.793   0.654  -4.448
  293    HB   VAL  39           HB       VAL  39  -1.836  -0.844  -4.692
  294   1HG1  VAL  39          HG1       VAL  39  -1.637  -0.014  -2.413
  295   2HG1  VAL  39          HG1       VAL  39  -2.746   1.032  -3.297
  296   3HG1  VAL  39          HG1       VAL  39  -1.090   1.559  -2.996
  297   1HG2  VAL  39          HG2       VAL  39  -0.971   1.946  -5.519
  298   2HG2  VAL  39          HG2       VAL  39  -2.591   1.277  -5.717
  299   3HG2  VAL  39          HG2       VAL  39  -1.235   0.587  -6.610
  300    H    ILE  40           HN       ILE  40   0.382   0.423  -2.010
  301    HA   ILE  40           HA       ILE  40   0.735  -2.377  -1.040
  302    HB   ILE  40           HB       ILE  40   2.525   0.027  -0.691
  303   1HG1  ILE  40          HG1       ILE  40   3.434  -2.783  -1.145
  304   2HG1  ILE  40          HG1       ILE  40   2.726  -1.891  -2.494
  305   1HG2  ILE  40          HG2       ILE  40   3.785  -1.490   0.961
  306   2HG2  ILE  40          HG2       ILE  40   2.282  -2.406   1.077
  307   3HG2  ILE  40          HG2       ILE  40   2.319  -0.709   1.556
  308   1HD1  ILE  40          HD1       ILE  40   4.341  -0.008  -1.956
  309   2HD1  ILE  40          HD1       ILE  40   5.097  -1.481  -2.561
  310   3HD1  ILE  40          HD1       ILE  40   5.140  -1.112  -0.836
  311    H    PHE  41           HN       PHE  41  -0.310  -2.719   0.907
  312    HA   PHE  41           HA       PHE  41  -1.577  -0.355   2.251
  313   1HB   PHE  41          HB2       PHE  41  -2.427  -3.270   1.987
  314   2HB   PHE  41          HB1       PHE  41  -3.317  -2.047   2.893
  315    HD1  PHE  41           HD1      PHE  41  -3.427   0.287   1.363
  316    HD2  PHE  41           HD2      PHE  41  -3.422  -3.757  -0.066
  317    HE1  PHE  41           HE1      PHE  41  -4.562   1.026  -0.713
  318    HE2  PHE  41           HE2      PHE  41  -4.561  -3.023  -2.145
  319    HZ   PHE  41           HZ       PHE  41  -5.131  -0.630  -2.466
  320    H    THR  42           HN       THR  42  -0.514  -0.001   4.209
  321    HA   THR  42           HA       THR  42   0.977  -2.245   5.423
  322    HB   THR  42           HB       THR  42   2.001  -0.012   5.092
  323    HG1  THR  42           HG1      THR  42   2.897   0.061   7.096
  324   1HG2  THR  42          HG2       THR  42   0.101   1.428   5.324
  325   2HG2  THR  42          HG2       THR  42   1.198   1.817   6.647
  326   3HG2  THR  42          HG2       THR  42  -0.226   0.824   6.947
  327    H    THR  43           HN       THR  43   0.695  -2.815   7.678
  328    HA   THR  43           HA       THR  43  -2.119  -2.437   8.587
  329    HB   THR  43           HB       THR  43  -1.385  -4.467  10.030
  330    HG1  THR  43           HG1      THR  43   0.398  -5.557   9.094
  331   1HG2  THR  43          HG2       THR  43  -2.870  -4.917   8.266
  332   2HG2  THR  43          HG2       THR  43  -1.490  -5.951   7.901
  333   3HG2  THR  43          HG2       THR  43  -1.702  -4.427   7.038
  334    H    LYS  44           HN       LYS  44  -2.209  -2.693  11.136
  335    HA   LYS  44           HA       LYS  44  -0.874  -0.378  12.261
  336   1HB   LYS  44          HB2       LYS  44  -3.149  -1.883  12.721
  337   2HB   LYS  44          HB1       LYS  44  -2.127  -2.292  14.099
  338   1HG   LYS  44          HG2       LYS  44  -1.938  -0.019  14.770
  339   2HG   LYS  44          HG1       LYS  44  -2.564   0.567  13.229
  340   1HD   LYS  44          HD2       LYS  44  -4.296  -1.244  14.863
  341   2HD   LYS  44          HD1       LYS  44  -4.133   0.438  15.367
  342   1HE   LYS  44          HE2       LYS  44  -4.749  -0.221  12.487
  343   2HE   LYS  44          HE1       LYS  44  -6.047  -0.142  13.695
  344   1HZ   LYS  44          HZ1       LYS  44  -5.537   2.050  14.224
  345   2HZ   LYS  44          HZ2       LYS  44  -5.382   2.023  12.532
  346   3HZ   LYS  44          HZ3       LYS  44  -3.997   1.977  13.517
  347    H    ARG  45           HN       ARG  45  -0.157  -3.779  12.103
  348    HA   ARG  45           HA       ARG  45   1.619  -3.827  14.430
  349   1HB   ARG  45          HB2       ARG  45   0.239  -5.712  13.294
  350   2HB   ARG  45          HB1       ARG  45   1.556  -5.773  12.123
  351   1HG   ARG  45          HG2       ARG  45   2.566  -7.180  13.581
  352   2HG   ARG  45          HG1       ARG  45   2.899  -5.735  14.537
  353   1HD   ARG  45          HD2       ARG  45   0.277  -7.218  14.817
  354   2HD   ARG  45          HD1       ARG  45   1.707  -7.674  15.763
  355    HE   ARG  45           HE       ARG  45   0.272  -5.082  15.950
  356   1HH1  ARG  45          HH1       ARG  45   0.728  -6.712  18.373
  357   2HH1  ARG  45          HH1       ARG  45   2.127  -5.973  19.076
  358   1HH2  ARG  45          HH2       ARG  45   3.026  -4.297  16.175
  359   2HH2  ARG  45          HH2       ARG  45   3.433  -4.610  17.830
  360    H    GLY  46           HN       GLY  46   1.901  -3.047  11.040
  361   1HA   GLY  46          HA2       GLY  46   3.925  -1.663  10.479
  362   2HA   GLY  46          HA1       GLY  46   4.867  -2.848  11.383
  363    H    LYS  47           HN       LYS  47   2.507  -4.573   9.798
  364    HA   LYS  47           HA       LYS  47   4.415  -5.609   7.843
  365   1HB   LYS  47          HB2       LYS  47   2.235  -6.536   9.273
  366   2HB   LYS  47          HB1       LYS  47   1.583  -6.381   7.641
  367   1HG   LYS  47          HG2       LYS  47   2.483  -8.534   7.577
  368   2HG   LYS  47          HG1       LYS  47   3.818  -7.574   6.937
  369   1HD   LYS  47          HD2       LYS  47   4.866  -7.503   9.148
  370   2HD   LYS  47          HD1       LYS  47   3.507  -8.388   9.842
  371   1HE   LYS  47          HE2       LYS  47   4.477  -9.858   7.569
  372   2HE   LYS  47          HE1       LYS  47   5.841  -9.490   8.644
  373   1HZ   LYS  47          HZ1       LYS  47   4.415 -10.190  10.525
  374   2HZ   LYS  47          HZ2       LYS  47   4.767 -11.456   9.450
  375   3HZ   LYS  47          HZ3       LYS  47   3.243 -10.707   9.414
  376    H    LYS  48           HN       LYS  48   4.058  -5.559   5.519
  377    HA   LYS  48           HA       LYS  48   2.201  -3.392   4.603
  378   1HB   LYS  48          HB2       LYS  48   5.066  -3.612   4.519
  379   2HB   LYS  48          HB1       LYS  48   4.438  -3.590   2.872
  380   1HG   LYS  48          HG2       LYS  48   4.106  -1.374   3.033
  381   2HG   LYS  48          HG1       LYS  48   2.989  -1.643   4.372
  382   1HD   LYS  48          HD2       LYS  48   4.707  -0.208   5.219
  383   2HD   LYS  48          HD1       LYS  48   5.037  -1.810   5.881
  384   1HE   LYS  48          HE2       LYS  48   7.149  -1.014   5.070
  385   2HE   LYS  48          HE1       LYS  48   6.575  -2.137   3.821
  386   1HZ   LYS  48          HZ1       LYS  48   7.298   0.189   3.077
  387   2HZ   LYS  48          HZ2       LYS  48   5.839   0.723   3.762
  388   3HZ   LYS  48          HZ3       LYS  48   5.821  -0.404   2.490
  389    H    VAL  49           HN       VAL  49   0.669  -4.322   3.331
  390    HA   VAL  49           HA       VAL  49   1.308  -6.828   1.851
  391    HB   VAL  49           HB       VAL  49  -1.279  -5.311   2.326
  392   1HG1  VAL  49          HG1       VAL  49  -1.436  -6.743   0.364
  393   2HG1  VAL  49          HG1       VAL  49  -2.313  -7.503   1.693
  394   3HG1  VAL  49          HG1       VAL  49  -0.710  -8.087   1.245
  395   1HG2  VAL  49          HG2       VAL  49   0.333  -6.997   4.028
  396   2HG2  VAL  49          HG2       VAL  49  -1.208  -7.787   3.699
  397   3HG2  VAL  49          HG2       VAL  49  -1.180  -6.172   4.407
  398    H    CYS  50           HN       CYS  50   1.948  -6.615  -0.263
  399    HA   CYS  50           HA       CYS  50   1.691  -4.124  -1.743
  400   1HB   CYS  50          HB2       CYS  50   2.736  -6.893  -2.121
  401   2HB   CYS  50          HB1       CYS  50   2.356  -5.994  -3.589
  402    H    THR  51           HN       THR  51   0.464  -3.947  -3.805
  403    HA   THR  51           HA       THR  51  -1.679  -5.893  -4.337
  404    HB   THR  51           HB       THR  51  -3.335  -3.859  -4.018
  405    HG1  THR  51           HG1      THR  51  -2.501  -2.228  -3.019
  406   1HG2  THR  51          HG2       THR  51  -2.853  -6.100  -2.615
  407   2HG2  THR  51          HG2       THR  51  -4.011  -4.883  -2.079
  408   3HG2  THR  51          HG2       THR  51  -2.381  -4.909  -1.403
  409    H    HIS  52           HN       HIS  52  -3.106  -4.976  -6.198
  410    HA   HIS  52           HA       HIS  52  -1.342  -3.474  -8.072
  411   1HB   HIS  52          HB2       HIS  52  -3.145  -5.781  -8.202
  412   2HB   HIS  52          HB1       HIS  52  -3.412  -4.630  -9.511
  413    HD1  HIS  52           HD1      HIS  52  -2.183  -7.357 -10.181
  414    HD2  HIS  52           HD2      HIS  52   0.100  -3.989  -9.271
  415    HE1  HIS  52           HE1      HIS  52   0.104  -7.744 -11.198
  416    HA   PRO  53           HA       PRO  53  -4.311  -0.172  -7.733
  417   1HB   PRO  53          HB2       PRO  53  -3.474   1.312  -9.880
  418   2HB   PRO  53          HB1       PRO  53  -2.613   1.280  -8.327
  419   1HG   PRO  53          HG2       PRO  53  -2.015  -0.184 -10.852
  420   2HG   PRO  53          HG1       PRO  53  -0.908   0.594  -9.710
  421   1HD   PRO  53          HD2       PRO  53  -1.319  -2.088  -9.772
  422   2HD   PRO  53          HD1       PRO  53  -0.896  -1.207  -8.287
  423    H    ARG  54           HN       ARG  54  -3.956  -2.319 -10.414
  424    HA   ARG  54           HA       ARG  54  -6.058  -1.276 -12.112
  425   1HB   ARG  54          HB2       ARG  54  -4.061  -3.019 -12.421
  426   2HB   ARG  54          HB1       ARG  54  -5.318  -4.176 -11.981
  427   1HG   ARG  54          HG2       ARG  54  -6.696  -3.530 -13.820
  428   2HG   ARG  54          HG1       ARG  54  -5.717  -2.097 -14.139
  429   1HD   ARG  54          HD2       ARG  54  -4.121  -3.286 -15.281
  430   2HD   ARG  54          HD1       ARG  54  -4.262  -4.691 -14.207
  431    HE   ARG  54           HE       ARG  54  -6.708  -4.605 -15.512
  432   1HH1  ARG  54          HH1       ARG  54  -4.378  -6.634 -15.878
  433   2HH1  ARG  54          HH1       ARG  54  -4.237  -6.622 -17.604
  434   1HH2  ARG  54          HH2       ARG  54  -6.109  -3.731 -18.002
  435   2HH2  ARG  54          HH2       ARG  54  -5.214  -4.977 -18.806
  436    H    LYS  55           HN       LYS  55  -5.971  -3.294  -9.257
  437    HA   LYS  55           HA       LYS  55  -8.619  -4.458  -9.592
  438   1HB   LYS  55          HB2       LYS  55  -6.482  -4.270  -7.499
  439   2HB   LYS  55          HB1       LYS  55  -8.091  -4.803  -7.007
  440   1HG   LYS  55          HG2       LYS  55  -7.145  -6.838  -7.590
  441   2HG   LYS  55          HG1       LYS  55  -7.862  -6.370  -9.133
  442   1HD   LYS  55          HD2       LYS  55  -5.336  -5.125  -9.070
  443   2HD   LYS  55          HD1       LYS  55  -5.072  -6.765  -8.473
  444   1HE   LYS  55          HE2       LYS  55  -6.585  -6.111 -11.026
  445   2HE   LYS  55          HE1       LYS  55  -4.889  -6.628 -10.968
  446   1HZ   LYS  55          HZ1       LYS  55  -5.565  -8.605  -9.756
  447   2HZ   LYS  55          HZ2       LYS  55  -6.370  -8.529 -11.251
  448   3HZ   LYS  55          HZ3       LYS  55  -7.189  -8.121  -9.819
  449    H    LYS  56           HN       LYS  56 -10.515  -3.374  -9.237
  450    HA   LYS  56           HA       LYS  56 -10.747  -0.679  -8.430
  451   1HB   LYS  56          HB2       LYS  56 -12.646  -3.039  -8.276
  452   2HB   LYS  56          HB1       LYS  56 -13.154  -1.367  -8.036
  453   1HG   LYS  56          HG2       LYS  56 -12.810  -0.796 -10.254
  454   2HG   LYS  56          HG1       LYS  56 -11.574  -2.033 -10.490
  455   1HD   LYS  56          HD2       LYS  56 -13.542  -2.747 -11.687
  456   2HD   LYS  56          HD1       LYS  56 -13.394  -3.769 -10.257
  457   1HE   LYS  56          HE2       LYS  56 -15.317  -2.950  -9.332
  458   2HE   LYS  56          HE1       LYS  56 -14.959  -1.288  -9.843
  459   1HZ   LYS  56          HZ1       LYS  56 -16.846  -2.454 -11.048
  460   2HZ   LYS  56          HZ2       LYS  56 -15.652  -3.413 -11.784
  461   3HZ   LYS  56          HZ3       LYS  56 -15.659  -1.731 -12.020
  462    H    TRP  57           HN       TRP  57 -11.055  -3.647  -6.443
  463    HA   TRP  57           HA       TRP  57 -11.791  -2.398  -4.008
  464   1HB   TRP  57          HB2       TRP  57 -11.474  -4.527  -3.150
  465   2HB   TRP  57          HB1       TRP  57 -11.483  -4.920  -4.864
  466    HD1  TRP  57           HD1      TRP  57  -9.344  -5.967  -5.860
  467    HE1  TRP  57           HE1      TRP  57  -7.014  -6.553  -4.924
  468    HE3  TRP  57           HE3      TRP  57  -9.614  -3.656  -1.315
  469    HZ2  TRP  57           HZ2      TRP  57  -5.470  -6.098  -2.557
  470    HZ3  TRP  57           HZ3      TRP  57  -7.703  -3.748   0.260
  471    HH2  TRP  57           HH2      TRP  57  -5.633  -4.965  -0.355
  472    H    VAL  58           HN       VAL  58  -8.581  -2.885  -5.456
  473    HA   VAL  58           HA       VAL  58  -7.001  -2.027  -3.229
  474    HB   VAL  58           HB       VAL  58  -6.579  -1.846  -6.228
  475   1HG1  VAL  58          HG1       VAL  58  -4.583  -1.743  -3.945
  476   2HG1  VAL  58          HG1       VAL  58  -5.025  -0.386  -4.982
  477   3HG1  VAL  58          HG1       VAL  58  -4.173  -1.773  -5.659
  478   1HG2  VAL  58          HG2       VAL  58  -6.986  -4.129  -5.513
  479   2HG2  VAL  58          HG2       VAL  58  -5.879  -3.943  -4.152
  480   3HG2  VAL  58          HG2       VAL  58  -5.255  -3.951  -5.801
  481    H    GLN  59           HN       GLN  59  -8.175  -0.194  -6.085
  482    HA   GLN  59           HA       GLN  59  -7.187   2.355  -5.287
  483   1HB   GLN  59          HB2       GLN  59  -9.526   1.388  -6.950
  484   2HB   GLN  59          HB1       GLN  59  -9.151   3.104  -6.786
  485   1HG   GLN  59          HG2       GLN  59  -6.816   1.429  -7.428
  486   2HG   GLN  59          HG1       GLN  59  -8.055   1.441  -8.684
  487   1HE2  GLN  59          HE2       GLN  59  -7.033   4.052  -6.417
  488   2HE2  GLN  59          HE2       GLN  59  -6.646   5.164  -7.640
  489    H    LYS  60           HN       LYS  60  -9.909   0.440  -4.229
  490    HA   LYS  60           HA       LYS  60 -11.357   2.600  -2.938
  491   1HB   LYS  60          HB2       LYS  60 -11.984   0.130  -3.765
  492   2HB   LYS  60          HB1       LYS  60 -11.575  -0.261  -2.094
  493   1HG   LYS  60          HG2       LYS  60 -13.918   0.224  -2.102
  494   2HG   LYS  60          HG1       LYS  60 -13.129   1.637  -1.401
  495   1HD   LYS  60          HD2       LYS  60 -13.778   2.975  -3.106
  496   2HD   LYS  60          HD1       LYS  60 -13.325   1.780  -4.321
  497   1HE   LYS  60          HE2       LYS  60 -15.421   0.581  -4.010
  498   2HE   LYS  60          HE1       LYS  60 -15.864   1.639  -2.655
  499   1HZ   LYS  60          HZ1       LYS  60 -16.812   2.323  -4.851
  500   2HZ   LYS  60          HZ2       LYS  60 -15.228   2.641  -5.376
  501   3HZ   LYS  60          HZ3       LYS  60 -15.890   3.520  -4.081
  502    H    TYR  61           HN       TYR  61  -8.867   0.261  -1.994
  503    HA   TYR  61           HA       TYR  61  -9.011   0.888   0.853
  504   1HB   TYR  61          HB2       TYR  61  -7.510  -0.827  -1.009
  505   2HB   TYR  61          HB1       TYR  61  -6.542  -0.244   0.345
  506    HD1  TYR  61           HD1      TYR  61 -10.082  -1.409  -0.152
  507    HD2  TYR  61           HD2      TYR  61  -6.471  -1.692   2.157
  508    HE1  TYR  61           HE1      TYR  61 -11.165  -3.069   1.339
  509    HE2  TYR  61           HE2      TYR  61  -7.554  -3.352   3.647
  510    HH   TYR  61           HH       TYR  61 -10.507  -3.764   4.101
  511    H    ILE  62           HN       ILE  62  -7.070   1.975  -1.904
  512    HA   ILE  62           HA       ILE  62  -5.140   3.499  -0.419
  513    HB   ILE  62           HB       ILE  62  -6.310   3.868  -3.201
  514   1HG1  ILE  62          HG1       ILE  62  -3.803   2.410  -2.305
  515   2HG1  ILE  62          HG1       ILE  62  -5.323   1.613  -2.714
  516   1HG2  ILE  62          HG2       ILE  62  -4.913   5.617  -3.432
  517   2HG2  ILE  62          HG2       ILE  62  -3.546   4.620  -2.932
  518   3HG2  ILE  62          HG2       ILE  62  -4.497   5.482  -1.723
  519   1HD1  ILE  62          HD1       ILE  62  -3.261   2.666  -4.485
  520   2HD1  ILE  62          HD1       ILE  62  -4.851   3.329  -4.868
  521   3HD1  ILE  62          HD1       ILE  62  -4.603   1.583  -4.853
  522    H    SER  63           HN       SER  63  -8.242   4.395  -1.950
  523    HA   SER  63           HA       SER  63  -8.206   7.148  -1.102
  524   1HB   SER  63          HB2       SER  63 -10.509   7.094  -1.875
  525   2HB   SER  63          HB1       SER  63  -9.557   6.076  -2.952
  526    HG   SER  63           HG       SER  63 -11.483   5.401  -1.061
  527    H    LEU  64           HN       LEU  64  -9.416   4.145   0.350
  528    HA   LEU  64           HA       LEU  64 -10.783   5.462   2.560
  529   1HB   LEU  64          HB2       LEU  64 -10.118   2.727   1.617
  530   2HB   LEU  64          HB1       LEU  64 -10.340   2.893   3.359
  531    HG   LEU  64           HG       LEU  64 -12.362   4.293   1.725
  532   1HD1  LEU  64          HD1       LEU  64 -12.803   2.558   0.346
  533   2HD1  LEU  64          HD1       LEU  64 -13.356   1.687   1.776
  534   3HD1  LEU  64          HD1       LEU  64 -11.694   1.497   1.215
  535   1HD2  LEU  64          HD2       LEU  64 -13.476   2.438   3.550
  536   2HD2  LEU  64          HD2       LEU  64 -13.302   4.179   3.772
  537   3HD2  LEU  64          HD2       LEU  64 -12.034   3.088   4.331
  538    H    LEU  65           HN       LEU  65  -7.604   3.903   2.108
  539    HA   LEU  65           HA       LEU  65  -6.801   4.356   4.884
  540   1HB   LEU  65          HB2       LEU  65  -5.534   3.344   2.342
  541   2HB   LEU  65          HB1       LEU  65  -4.529   3.677   3.750
  542    HG   LEU  65           HG       LEU  65  -6.874   1.754   3.618
  543   1HD1  LEU  65          HD1       LEU  65  -5.249   0.320   2.964
  544   2HD1  LEU  65          HD1       LEU  65  -4.578   0.483   4.587
  545   3HD1  LEU  65          HD1       LEU  65  -3.986   1.508   3.282
  546   1HD2  LEU  65          HD2       LEU  65  -7.000   2.593   5.805
  547   2HD2  LEU  65          HD2       LEU  65  -5.259   2.853   5.908
  548   3HD2  LEU  65          HD2       LEU  65  -5.913   1.220   5.996
  549    H    LYS  66           HN       LYS  66  -7.585   6.829   4.060
  550    HA   LYS  66           HA       LYS  66  -5.374   8.355   2.892
  551   1HB   LYS  66          HB2       LYS  66  -7.969   8.691   2.789
  552   2HB   LYS  66          HB1       LYS  66  -7.759   9.471   4.357
  553   1HG   LYS  66          HG2       LYS  66  -6.114  11.021   3.379
  554   2HG   LYS  66          HG1       LYS  66  -6.304  10.238   1.809
  555   1HD   LYS  66          HD2       LYS  66  -7.755  12.075   1.642
  556   2HD   LYS  66          HD1       LYS  66  -8.839  10.769   2.120
  557   1HE   LYS  66          HE2       LYS  66  -8.955  11.527   4.365
  558   2HE   LYS  66          HE1       LYS  66  -7.514  12.547   4.180
  559   1HZ   LYS  66          HZ1       LYS  66  -8.700  13.854   2.523
  560   2HZ   LYS  66          HZ2       LYS  66  -9.527  13.876   4.006
  561   3HZ   LYS  66          HZ3       LYS  66 -10.086  12.901   2.733
  562    H    THR  67           HN       THR  67  -3.615   8.110   4.384
  563    HA   THR  67           HA       THR  67  -4.010   9.525   6.981
  564    HB   THR  67           HB       THR  67  -2.227   7.129   6.699
  565    HG1  THR  67           HG1      THR  67  -4.044   5.867   7.322
  566   1HG2  THR  67          HG2       THR  67  -2.400   7.013   9.024
  567   2HG2  THR  67          HG2       THR  67  -3.948   7.859   9.049
  568   3HG2  THR  67          HG2       THR  67  -2.459   8.754   8.744
  569    HA   PRO  68           HA       PRO  68  -0.180  10.739   4.485
  570   1HB   PRO  68          HB2       PRO  68  -0.906  13.321   3.929
  571   2HB   PRO  68          HB1       PRO  68  -1.273  11.959   2.850
  572   1HG   PRO  68          HG2       PRO  68  -3.032  13.333   4.824
  573   2HG   PRO  68          HG1       PRO  68  -3.408  12.742   3.197
  574   1HD   PRO  68          HD2       PRO  68  -4.107  11.406   5.450
  575   2HD   PRO  68          HD1       PRO  68  -3.744  10.589   3.912
  576    H    LYS  69           HN       LYS  69   1.406  11.279   5.935
  577    HA   LYS  69           HA       LYS  69   0.836  12.464   8.506
  578   1HB   LYS  69          HB2       LYS  69   3.356  11.881   6.927
  579   2HB   LYS  69          HB1       LYS  69   3.380  12.464   8.591
  580   1HG   LYS  69          HG2       LYS  69   3.378  10.212   9.041
  581   2HG   LYS  69          HG1       LYS  69   1.636  10.437   8.885
  582   1HD   LYS  69          HD2       LYS  69   1.535   9.265   6.943
  583   2HD   LYS  69          HD1       LYS  69   3.023   9.983   6.326
  584   1HE   LYS  69          HE2       LYS  69   4.377   8.467   7.678
  585   2HE   LYS  69          HE1       LYS  69   2.919   7.803   8.442
  586   1HZ   LYS  69          HZ1       LYS  69   3.359   7.832   5.508
  587   2HZ   LYS  69          HZ2       LYS  69   2.134   7.020   6.361
  588   3HZ   LYS  69          HZ3       LYS  69   3.748   6.504   6.488
  589    H    GLN  70           HN       GLN  70   1.552  14.544   9.280
  590    HA   GLN  70           HA       GLN  70   1.975  16.588   7.121
  591   1HB   GLN  70          HB2       GLN  70   0.662  18.084   8.623
  592   2HB   GLN  70          HB1       GLN  70  -0.262  16.662   8.142
  593   1HG   GLN  70          HG2       GLN  70  -0.063  15.656  10.245
  594   2HG   GLN  70          HG1       GLN  70   1.367  16.597  10.668
  595   1HE2  GLN  70          HE2       GLN  70  -0.202  16.902  12.685
  596   2HE2  GLN  70          HE2       GLN  70  -1.209  18.267  12.621
  597    H    LEU  71           HN       LEU  71   2.596  18.756   8.686
  598    HA   LEU  71           HA       LEU  71   4.944  17.870  10.329
  599   1HB   LEU  71          HB2       LEU  71   4.970  19.041   7.803
  600   2HB   LEU  71          HB1       LEU  71   5.254  20.402   8.888
  601    HG   LEU  71           HG       LEU  71   6.775  18.018   9.650
  602   1HD1  LEU  71          HD1       LEU  71   8.305  18.982   7.508
  603   2HD1  LEU  71          HD1       LEU  71   6.684  18.776   6.844
  604   3HD1  LEU  71          HD1       LEU  71   7.506  17.413   7.604
  605   1HD2  LEU  71          HD2       LEU  71   8.034  20.586   8.805
  606   2HD2  LEU  71          HD2       LEU  71   8.337  19.605  10.239
  607   3HD2  LEU  71          HD2       LEU  71   6.922  20.655  10.171
  Start of MODEL    5
    1   1H    THR   1          HT1       THR   1  22.765  -7.435  10.632
    2   2H    THR   1          HT2       THR   1  23.274  -6.702   9.187
    3   3H    THR   1          HT3       THR   1  23.759  -8.290   9.555
    4    HA   THR   1           HA       THR   1  22.054  -8.618   8.015
    5    HB   THR   1           HB       THR   1  20.850  -8.638  10.803
    6    HG1  THR   1           HG1      THR   1  21.758 -10.739  10.854
    7   1HG2  THR   1          HG2       THR   1  20.216 -10.862   9.047
    8   2HG2  THR   1          HG2       THR   1  19.729  -9.326   8.330
    9   3HG2  THR   1          HG2       THR   1  19.126  -9.786   9.921
   10    H    ARG   2           HN       ARG   2  21.279  -6.052  10.337
   11    HA   ARG   2           HA       ARG   2  19.769  -4.239  10.180
   12   1HB   ARG   2          HB2       ARG   2  21.352  -4.296   8.023
   13   2HB   ARG   2          HB1       ARG   2  19.812  -4.577   7.209
   14   1HG   ARG   2          HG2       ARG   2  19.009  -2.483   7.707
   15   2HG   ARG   2          HG1       ARG   2  19.871  -2.405   9.243
   16   1HD   ARG   2          HD2       ARG   2  21.671  -2.491   6.916
   17   2HD   ARG   2          HD1       ARG   2  20.636  -1.051   6.963
   18    HE   ARG   2           HE       ARG   2  21.406  -0.878   9.427
   19   1HH1  ARG   2          HH2       ARG   2  23.408   0.030   7.293
   20   2HH1  ARG   2          HH2       ARG   2  24.861  -0.714   7.871
   21   1HH2  ARG   2          HH1       ARG   2  23.214  -2.875  10.024
   22   2HH2  ARG   2          HH1       ARG   2  24.751  -2.359   9.417
   23    H    GLY   3           HN       GLY   3  17.667  -3.640   8.589
   24   1HA   GLY   3          HA2       GLY   3  15.813  -5.874   9.106
   25   2HA   GLY   3          HA1       GLY   3  15.355  -4.238   8.630
   26    H    SER   4           HN       SER   4  15.665  -7.401   7.527
   27    HA   SER   4           HA       SER   4  15.798  -6.491   4.671
   28   1HB   SER   4          HB2       SER   4  16.595  -8.809   4.259
   29   2HB   SER   4          HB1       SER   4  17.618  -7.972   5.423
   30    HG   SER   4           HG       SER   4  16.909 -10.163   5.993
   31    H    ASP   5           HN       ASP   5  13.346  -6.351   6.165
   32    HA   ASP   5           HA       ASP   5  11.706  -8.699   5.782
   33   1HB   ASP   5          HB2       ASP   5  11.131  -5.744   6.164
   34   2HB   ASP   5          HB1       ASP   5   9.884  -6.992   6.203
   35    H    ILE   6           HN       ILE   6   9.598  -8.356   4.350
   36    HA   ILE   6           HA       ILE   6  10.553  -7.750   1.594
   37    HB   ILE   6           HB       ILE   6   8.105  -9.182   2.679
   38   1HG1  ILE   6          HG1       ILE   6  10.378 -10.515   1.248
   39   2HG1  ILE   6          HG1       ILE   6  10.584 -10.094   2.949
   40   1HG2  ILE   6          HG2       ILE   6   8.636 -10.034   0.076
   41   2HG2  ILE   6          HG2       ILE   6   8.873  -8.287   0.009
   42   3HG2  ILE   6          HG2       ILE   6   7.336  -8.948   0.567
   43   1HD1  ILE   6          HD1       ILE   6   8.078 -11.503   2.089
   44   2HD1  ILE   6          HD1       ILE   6   8.894 -11.533   3.653
   45   3HD1  ILE   6          HD1       ILE   6   9.562 -12.434   2.292
   46    H    SER   7           HN       SER   7   9.929  -5.509   3.328
   47    HA   SER   7           HA       SER   7   7.371  -4.521   2.145
   48   1HB   SER   7          HB2       SER   7   7.602  -2.889   4.128
   49   2HB   SER   7          HB1       SER   7   7.251  -4.570   4.521
   50    HG   SER   7           HG       SER   7   8.962  -4.246   5.752
   51    H    LYS   8           HN       LYS   8   9.841  -4.461   0.642
   52    HA   LYS   8           HA       LYS   8  11.173  -1.911   0.864
   53   1HB   LYS   8          HB2       LYS   8  11.225  -4.313  -0.720
   54   2HB   LYS   8          HB1       LYS   8  11.269  -2.917  -1.796
   55   1HG   LYS   8          HG2       LYS   8  13.272  -2.128  -0.920
   56   2HG   LYS   8          HG1       LYS   8  13.018  -2.914   0.638
   57   1HD   LYS   8          HD2       LYS   8  13.376  -5.123  -0.442
   58   2HD   LYS   8          HD1       LYS   8  13.699  -4.304  -1.971
   59   1HE   LYS   8          HE2       LYS   8  15.278  -3.300   0.328
   60   2HE   LYS   8          HE1       LYS   8  15.660  -4.954  -0.191
   61   1HZ   LYS   8          HZ1       LYS   8  16.073  -4.266  -2.361
   62   2HZ   LYS   8          HZ2       LYS   8  16.792  -3.041  -1.429
   63   3HZ   LYS   8          HZ3       LYS   8  15.277  -2.781  -2.156
   64    H    THR   9           HN       THR   9  11.113  -0.579  -1.426
   65    HA   THR   9           HA       THR   9   8.529   0.731  -1.469
   66    HB   THR   9           HB       THR   9  10.606   1.047  -3.612
   67    HG1  THR   9           HG1      THR   9  10.910   1.551  -0.855
   68   1HG2  THR   9          HG2       THR   9  10.132   3.468  -3.063
   69   2HG2  THR   9          HG2       THR   9   8.897   2.900  -1.938
   70   3HG2  THR   9          HG2       THR   9   8.740   2.566  -3.662
   71    H    CYS  10           HN       CYS  10  10.249  -1.406  -3.767
   72    HA   CYS  10           HA       CYS  10   8.095  -1.361  -5.725
   73   1HB   CYS  10          HB2       CYS  10  10.430  -3.258  -5.318
   74   2HB   CYS  10          HB1       CYS  10   9.503  -3.064  -6.804
   75    H    CYS  11           HN       CYS  11   7.322  -3.737  -6.427
   76    HA   CYS  11           HA       CYS  11   6.500  -5.243  -3.966
   77   1HB   CYS  11          HB2       CYS  11   4.922  -3.946  -6.143
   78   2HB   CYS  11          HB1       CYS  11   4.328  -5.490  -5.533
   79    H    PHE  12           HN       PHE  12   5.710  -7.481  -4.557
   80    HA   PHE  12           HA       PHE  12   6.720  -8.517  -7.147
   81   1HB   PHE  12          HB2       PHE  12   7.943  -8.808  -4.503
   82   2HB   PHE  12          HB1       PHE  12   7.621 -10.364  -5.267
   83    HD1  PHE  12           HD1      PHE  12   8.944 -11.140  -7.078
   84    HD2  PHE  12           HD2      PHE  12   9.233  -7.046  -5.810
   85    HE1  PHE  12           HE1      PHE  12  10.903 -10.818  -8.564
   86    HE2  PHE  12           HE2      PHE  12  11.192  -6.724  -7.296
   87    HZ   PHE  12           HZ       PHE  12  12.026  -8.610  -8.673
   88    H    GLN  13           HN       GLN  13   5.248  -9.398  -4.007
   89    HA   GLN  13           HA       GLN  13   3.616 -11.469  -5.375
   90   1HB   GLN  13          HB2       GLN  13   3.204 -12.236  -3.080
   91   2HB   GLN  13          HB1       GLN  13   4.933 -11.986  -3.318
   92   1HG   GLN  13          HG2       GLN  13   4.869 -10.666  -1.487
   93   2HG   GLN  13          HG1       GLN  13   4.011  -9.492  -2.485
   94   1HE2  GLN  13          HE2       GLN  13   2.327  -8.745  -1.157
   95   2HE2  GLN  13          HE2       GLN  13   1.236  -9.751  -0.334
   96    H    TYR  14           HN       TYR  14   1.245 -11.543  -4.623
   97    HA   TYR  14           HA       TYR  14   0.120  -8.934  -3.810
   98   1HB   TYR  14          HB2       TYR  14  -0.356 -10.276  -6.486
   99   2HB   TYR  14          HB1       TYR  14  -1.312  -8.922  -5.881
  100    HD1  TYR  14           HD1      TYR  14   1.456  -9.782  -7.861
  101    HD2  TYR  14           HD2      TYR  14   0.174  -6.880  -4.964
  102    HE1  TYR  14           HE1      TYR  14   3.174  -8.196  -8.688
  103    HE2  TYR  14           HE2      TYR  14   1.893  -5.295  -5.791
  104    HH   TYR  14           HH       TYR  14   3.254  -5.332  -8.540
  105    H    SER  15           HN       SER  15  -1.717  -9.270  -2.601
  106    HA   SER  15           HA       SER  15  -2.861 -12.024  -2.565
  107   1HB   SER  15          HB2       SER  15  -1.801 -10.836  -0.527
  108   2HB   SER  15          HB1       SER  15  -3.242  -9.823  -0.530
  109    HG   SER  15           HG       SER  15  -3.046 -12.069   0.647
  110    H    HIS  16           HN       HIS  16  -5.254 -12.159  -2.346
  111    HA   HIS  16           HA       HIS  16  -6.640  -9.779  -3.545
  112   1HB   HIS  16          HB2       HIS  16  -6.167 -12.158  -4.753
  113   2HB   HIS  16          HB1       HIS  16  -7.700 -12.525  -3.963
  114    HD1  HIS  16           HD1      HIS  16  -8.280 -12.525  -6.740
  115    HD2  HIS  16           HD2      HIS  16  -7.837  -8.862  -4.800
  116    HE1  HIS  16           HE1      HIS  16  -9.409 -10.796  -8.207
  117    H    LYS  17           HN       LYS  17  -6.951  -9.340  -1.100
  118    HA   LYS  17           HA       LYS  17  -9.616 -10.263  -0.333
  119   1HB   LYS  17          HB2       LYS  17  -8.785 -11.283   1.807
  120   2HB   LYS  17          HB1       LYS  17  -8.260 -12.162   0.372
  121   1HG   LYS  17          HG2       LYS  17  -6.066 -11.599   0.666
  122   2HG   LYS  17          HG1       LYS  17  -6.455  -9.989   1.271
  123   1HD   LYS  17          HD2       LYS  17  -5.582 -11.127   3.158
  124   2HD   LYS  17          HD1       LYS  17  -7.332 -11.190   3.379
  125   1HE   LYS  17          HE2       LYS  17  -6.800 -13.453   1.839
  126   2HE   LYS  17          HE1       LYS  17  -5.450 -13.394   2.991
  127   1HZ   LYS  17          HZ1       LYS  17  -8.353 -13.299   3.599
  128   2HZ   LYS  17          HZ2       LYS  17  -7.157 -12.896   4.736
  129   3HZ   LYS  17          HZ3       LYS  17  -7.231 -14.469   4.099
  130    HA   PRO  18           HA       PRO  18  -9.376  -6.278   1.549
  131   1HB   PRO  18          HB2       PRO  18 -11.569  -6.421   3.175
  132   2HB   PRO  18          HB1       PRO  18 -11.682  -6.212   1.416
  133   1HG   PRO  18          HG2       PRO  18 -12.050  -8.662   3.060
  134   2HG   PRO  18          HG1       PRO  18 -12.924  -8.128   1.616
  135   1HD   PRO  18          HD2       PRO  18 -10.974 -10.046   1.592
  136   2HD   PRO  18          HD1       PRO  18 -11.379  -9.029   0.192
  137    H    LEU  19           HN       LEU  19  -8.070  -5.636   3.203
  138    HA   LEU  19           HA       LEU  19  -7.390  -7.466   5.389
  139   1HB   LEU  19          HB2       LEU  19  -5.899  -5.836   4.053
  140   2HB   LEU  19          HB1       LEU  19  -6.624  -4.559   5.028
  141    HG   LEU  19           HG       LEU  19  -5.909  -5.847   7.083
  142   1HD1  LEU  19          HD1       LEU  19  -5.645  -8.048   5.982
  143   2HD1  LEU  19          HD1       LEU  19  -4.147  -7.551   6.768
  144   3HD1  LEU  19          HD1       LEU  19  -4.316  -7.403   5.019
  145   1HD2  LEU  19          HD2       LEU  19  -3.303  -5.443   6.018
  146   2HD2  LEU  19          HD2       LEU  19  -4.241  -4.336   7.020
  147   3HD2  LEU  19          HD2       LEU  19  -4.361  -4.252   5.262
  148    HA   PRO  20           HA       PRO  20 -10.445  -5.920   8.196
  149   1HB   PRO  20          HB2       PRO  20  -9.183  -6.487  10.570
  150   2HB   PRO  20          HB1       PRO  20  -9.981  -7.721   9.572
  151   1HG   PRO  20          HG2       PRO  20  -7.085  -7.003   9.727
  152   2HG   PRO  20          HG1       PRO  20  -7.847  -8.604   9.680
  153   1HD   PRO  20          HD2       PRO  20  -6.738  -7.518   7.493
  154   2HD   PRO  20          HD1       PRO  20  -8.205  -8.517   7.393
  155    H    TRP  21           HN       TRP  21 -10.522  -3.696   8.080
  156    HA   TRP  21           HA       TRP  21  -8.556  -1.776   8.284
  157   1HB   TRP  21          HB2       TRP  21 -11.418  -1.816   9.256
  158   2HB   TRP  21          HB1       TRP  21 -10.461  -0.334   9.175
  159    HD1  TRP  21           HD1      TRP  21 -12.225  -2.890   7.010
  160    HE1  TRP  21           HE1      TRP  21 -12.207  -2.088   4.560
  161    HE3  TRP  21           HE3      TRP  21  -9.069   1.105   7.412
  162    HZ2  TRP  21           HZ2      TRP  21 -11.008  -0.030   2.980
  163    HZ3  TRP  21           HZ3      TRP  21  -8.505   2.467   5.419
  164    HH2  TRP  21           HH2      TRP  21  -9.469   1.904   3.205
  165    H    THR  22           HN       THR  22  -9.906  -3.629  10.951
  166    HA   THR  22           HA       THR  22  -9.172  -2.031  13.164
  167    HB   THR  22           HB       THR  22  -8.877  -4.393  14.205
  168    HG1  THR  22           HG1      THR  22  -8.424  -5.659  12.526
  169   1HG2  THR  22          HG2       THR  22 -11.284  -4.787  14.129
  170   2HG2  THR  22          HG2       THR  22 -11.428  -3.773  12.694
  171   3HG2  THR  22          HG2       THR  22 -10.979  -3.053  14.241
  172    H    TRP  23           HN       TRP  23  -7.234  -4.191  11.140
  173    HA   TRP  23           HA       TRP  23  -4.781  -3.524  12.694
  174   1HB   TRP  23          HB2       TRP  23  -5.683  -5.682  10.804
  175   2HB   TRP  23          HB1       TRP  23  -3.960  -5.390  11.009
  176    HD1  TRP  23           HD1      TRP  23  -5.274  -4.564  14.247
  177    HE1  TRP  23           HE1      TRP  23  -5.172  -6.560  15.873
  178    HE3  TRP  23           HE3      TRP  23  -4.499  -8.370  10.929
  179    HZ2  TRP  23           HZ2      TRP  23  -4.811  -9.396  15.782
  180    HZ3  TRP  23           HZ3      TRP  23  -4.281 -10.706  11.726
  181    HH2  TRP  23           HH2      TRP  23  -4.436 -11.224  14.146
  182    H    VAL  24           HN       VAL  24  -6.446  -2.360  10.010
  183    HA   VAL  24           HA       VAL  24  -4.097  -1.939   8.293
  184    HB   VAL  24           HB       VAL  24  -6.903  -0.797   8.161
  185   1HG1  VAL  24          HG1       VAL  24  -5.291  -1.319   5.729
  186   2HG1  VAL  24          HG1       VAL  24  -4.712  -0.006   6.755
  187   3HG1  VAL  24          HG1       VAL  24  -6.351   0.039   6.107
  188   1HG2  VAL  24          HG2       VAL  24  -5.869  -3.148   6.579
  189   2HG2  VAL  24          HG2       VAL  24  -7.540  -2.683   6.894
  190   3HG2  VAL  24          HG2       VAL  24  -6.564  -3.388   8.180
  191    H    ARG  25           HN       ARG  25  -3.072   0.092   7.968
  192    HA   ARG  25           HA       ARG  25  -3.842   2.261   9.891
  193   1HB   ARG  25          HB2       ARG  25  -1.865   0.789  10.541
  194   2HB   ARG  25          HB1       ARG  25  -1.024   1.446   9.136
  195   1HG   ARG  25          HG2       ARG  25  -1.157   3.688  10.005
  196   2HG   ARG  25          HG1       ARG  25  -2.234   3.176  11.307
  197   1HD   ARG  25          HD2       ARG  25  -0.300   3.040  12.531
  198   2HD   ARG  25          HD1       ARG  25  -0.074   1.502  11.676
  199    HE   ARG  25           HE       ARG  25   0.830   3.670  10.022
  200   1HH1  ARG  25          HH1       ARG  25   1.662   2.993  13.203
  201   2HH1  ARG  25          HH1       ARG  25   3.343   2.711  12.889
  202   1HH2  ARG  25          HH2       ARG  25   2.989   2.810   9.441
  203   2HH2  ARG  25          HH2       ARG  25   4.094   2.609  10.760
  204    H    SER  26           HN       SER  26  -2.191   1.419   6.835
  205    HA   SER  26           HA       SER  26  -3.202   3.759   5.476
  206   1HB   SER  26          HB2       SER  26  -0.991   4.951   5.348
  207   2HB   SER  26          HB1       SER  26  -1.655   4.897   6.976
  208    HG   SER  26           HG       SER  26   0.474   4.272   7.090
  209    H    TYR  27           HN       TYR  27  -1.147   4.133   3.594
  210    HA   TYR  27           HA       TYR  27  -0.372   1.442   2.633
  211   1HB   TYR  27          HB2       TYR  27  -1.642   1.662   0.590
  212   2HB   TYR  27          HB1       TYR  27  -2.742   1.997   1.923
  213    HD1  TYR  27           HD1      TYR  27  -1.094   3.329  -1.023
  214    HD2  TYR  27           HD2      TYR  27  -3.310   4.380   2.502
  215    HE1  TYR  27           HE1      TYR  27  -1.571   5.559  -1.990
  216    HE2  TYR  27           HE2      TYR  27  -3.787   6.611   1.536
  217    HH   TYR  27           HH       TYR  27  -3.016   8.107  -0.107
  218    H    GLU  28           HN       GLU  28   0.360   2.171   0.042
  219    HA   GLU  28           HA       GLU  28   1.766   4.651  -0.214
  220   1HB   GLU  28          HB2       GLU  28   4.088   3.683   0.179
  221   2HB   GLU  28          HB1       GLU  28   3.114   3.885   1.633
  222   1HG   GLU  28          HG2       GLU  28   2.471   1.323   0.656
  223   2HG   GLU  28          HG1       GLU  28   4.222   1.457   0.508
  224    H    PHE  29           HN       PHE  29   2.283   4.841  -2.368
  225    HA   PHE  29           HA       PHE  29   1.928   2.492  -4.112
  226   1HB   PHE  29          HB2       PHE  29   1.309   5.142  -4.264
  227   2HB   PHE  29          HB1       PHE  29   2.810   5.108  -5.190
  228    HD1  PHE  29           HD1      PHE  29   3.007   3.066  -6.893
  229    HD2  PHE  29           HD2      PHE  29  -0.680   4.668  -5.382
  230    HE1  PHE  29           HE1      PHE  29   1.795   2.098  -8.828
  231    HE2  PHE  29           HE2      PHE  29  -1.893   3.701  -7.317
  232    HZ   PHE  29           HZ       PHE  29  -0.656   2.417  -9.040
  233    H    THR  30           HN       THR  30   3.572   1.745  -5.583
  234    HA   THR  30           HA       THR  30   6.274   1.751  -4.539
  235    HB   THR  30           HB       THR  30   6.650   0.538  -6.767
  236    HG1  THR  30           HG1      THR  30   5.157   1.066  -8.150
  237   1HG2  THR  30          HG2       THR  30   6.164  -1.223  -5.461
  238   2HG2  THR  30          HG2       THR  30   4.458  -1.016  -5.858
  239   3HG2  THR  30          HG2       THR  30   5.138  -0.212  -4.443
  240    H    SER  31           HN       SER  31   8.168   2.609  -5.685
  241    HA   SER  31           HA       SER  31   7.839   5.314  -6.627
  242   1HB   SER  31          HB2       SER  31   9.830   3.854  -5.547
  243   2HB   SER  31          HB1       SER  31  10.292   3.733  -7.243
  244    HG   SER  31           HG       SER  31  11.029   5.680  -7.029
  245    H    ASN  32           HN       ASN  32   9.206   5.781  -8.836
  246    HA   ASN  32           HA       ASN  32   7.627   4.487 -10.968
  247   1HB   ASN  32          HB2       ASN  32   8.684   6.283 -12.328
  248   2HB   ASN  32          HB1       ASN  32   7.942   6.927 -10.864
  249   1HD2  ASN  32          HD2       ASN  32   9.958   8.455 -12.034
  250   2HD2  ASN  32          HD2       ASN  32  11.368   8.381 -11.091
  251    H    SER  33           HN       SER  33  10.846   4.327  -9.637
  252    HA   SER  33           HA       SER  33  11.890   2.909 -12.025
  253   1HB   SER  33          HB2       SER  33  12.927   4.426  -9.724
  254   2HB   SER  33          HB1       SER  33  13.882   3.002 -10.127
  255    HG   SER  33           HG       SER  33  14.025   5.281 -11.296
  256    H    CYS  34           HN       CYS  34   9.836   1.577 -10.475
  257    HA   CYS  34           HA       CYS  34  11.329  -0.485  -8.922
  258   1HB   CYS  34          HB2       CYS  34   8.570   0.612  -9.073
  259   2HB   CYS  34          HB1       CYS  34   8.701  -1.100  -8.674
  260    H    SER  35           HN       SER  35  10.990  -2.756  -9.438
  261    HA   SER  35           HA       SER  35  11.058  -3.404 -12.221
  262   1HB   SER  35          HB2       SER  35  11.719  -4.612  -9.897
  263   2HB   SER  35          HB1       SER  35  10.195  -5.433 -10.219
  264    HG   SER  35           HG       SER  35  11.809  -6.565 -11.248
  265    H    GLN  36           HN       GLN  36   8.401  -3.046  -9.969
  266    HA   GLN  36           HA       GLN  36   6.479  -3.458 -12.182
  267   1HB   GLN  36          HB2       GLN  36   6.971  -5.695 -11.170
  268   2HB   GLN  36          HB1       GLN  36   6.411  -5.078  -9.615
  269   1HG   GLN  36          HG2       GLN  36   4.482  -6.103 -10.458
  270   2HG   GLN  36          HG1       GLN  36   4.253  -4.424 -10.946
  271   1HE2  GLN  36          HE2       GLN  36   2.860  -6.098 -12.525
  272   2HE2  GLN  36          HE2       GLN  36   3.632  -6.378 -14.010
  273    H    ARG  37           HN       ARG  37   4.954  -1.875 -11.971
  274    HA   ARG  37           HA       ARG  37   4.818  -0.138  -9.663
  275   1HB   ARG  37          HB2       ARG  37   3.849  -0.327 -12.359
  276   2HB   ARG  37          HB1       ARG  37   2.482   0.030 -11.303
  277   1HG   ARG  37          HG2       ARG  37   3.788   1.901 -10.300
  278   2HG   ARG  37          HG1       ARG  37   5.086   1.577 -11.450
  279   1HD   ARG  37          HD2       ARG  37   3.973   2.601 -13.156
  280   2HD   ARG  37          HD1       ARG  37   2.429   1.851 -12.706
  281    HE   ARG  37           HE       ARG  37   2.368   3.554 -10.804
  282   1HH1  ARG  37          HH1       ARG  37   3.177   4.192 -14.014
  283   2HH1  ARG  37          HH1       ARG  37   3.621   5.845 -13.750
  284   1HH2  ARG  37          HH2       ARG  37   3.387   5.634 -10.297
  285   2HH2  ARG  37          HH2       ARG  37   3.740   6.662 -11.646
  286    H    ALA  38           HN       ALA  38   3.434  -0.271  -7.887
  287    HA   ALA  38           HA       ALA  38   0.950  -1.783  -7.947
  288   1HB   ALA  38          HB1       ALA  38   3.417  -3.148  -7.492
  289   2HB   ALA  38          HB2       ALA  38   1.784  -3.812  -7.423
  290   3HB   ALA  38          HB3       ALA  38   2.523  -3.137  -5.971
  291    H    VAL  39           HN       VAL  39  -0.222  -1.574  -5.935
  292    HA   VAL  39           HA       VAL  39   0.764   0.651  -4.214
  293    HB   VAL  39           HB       VAL  39  -1.934  -0.713  -4.526
  294   1HG1  VAL  39          HG1       VAL  39  -2.679   0.527  -2.797
  295   2HG1  VAL  39          HG1       VAL  39  -1.928   1.985  -3.443
  296   3HG1  VAL  39          HG1       VAL  39  -0.993   0.889  -2.429
  297   1HG2  VAL  39          HG2       VAL  39  -2.451   0.833  -6.130
  298   2HG2  VAL  39          HG2       VAL  39  -0.703   0.870  -6.359
  299   3HG2  VAL  39          HG2       VAL  39  -1.489   2.098  -5.366
  300    H    ILE  40           HN       ILE  40   0.798   0.374  -1.885
  301    HA   ILE  40           HA       ILE  40   0.641  -2.476  -0.975
  302    HB   ILE  40           HB       ILE  40   2.649  -0.292  -0.358
  303   1HG1  ILE  40          HG1       ILE  40   3.503  -2.949  -1.306
  304   2HG1  ILE  40          HG1       ILE  40   2.559  -2.027  -2.474
  305   1HG2  ILE  40          HG2       ILE  40   3.316  -2.928   0.637
  306   2HG2  ILE  40          HG2       ILE  40   1.792  -2.374   1.330
  307   3HG2  ILE  40          HG2       ILE  40   3.250  -1.396   1.509
  308   1HD1  ILE  40          HD1       ILE  40   4.116  -0.052  -1.891
  309   2HD1  ILE  40          HD1       ILE  40   4.790  -1.350  -2.876
  310   3HD1  ILE  40          HD1       ILE  40   5.163  -1.265  -1.154
  311    H    PHE  41           HN       PHE  41  -0.495  -2.788   0.901
  312    HA   PHE  41           HA       PHE  41  -1.593  -0.383   2.309
  313   1HB   PHE  41          HB2       PHE  41  -2.455  -3.286   2.036
  314   2HB   PHE  41          HB1       PHE  41  -3.267  -2.135   3.097
  315    HD1  PHE  41           HD1      PHE  41  -3.604   0.281   1.767
  316    HD2  PHE  41           HD2      PHE  41  -3.563  -3.645   0.030
  317    HE1  PHE  41           HE1      PHE  41  -4.942   1.115  -0.147
  318    HE2  PHE  41           HE2      PHE  41  -4.901  -2.812  -1.884
  319    HZ   PHE  41           HZ       PHE  41  -5.592  -0.433  -1.970
  320    H    THR  42           HN       THR  42  -0.773  -0.038   4.396
  321    HA   THR  42           HA       THR  42   0.781  -2.284   5.586
  322    HB   THR  42           HB       THR  42   1.993  -0.196   5.187
  323    HG1  THR  42           HG1      THR  42   1.344  -0.610   7.918
  324   1HG2  THR  42          HG2       THR  42   0.822   1.713   5.284
  325   2HG2  THR  42          HG2       THR  42   0.863   1.577   7.044
  326   3HG2  THR  42          HG2       THR  42  -0.495   0.916   6.139
  327    H    THR  43           HN       THR  43   0.519  -2.727   7.858
  328    HA   THR  43           HA       THR  43  -2.253  -2.167   8.794
  329    HB   THR  43           HB       THR  43  -1.722  -4.203  10.234
  330    HG1  THR  43           HG1      THR  43   0.155  -5.189   9.941
  331   1HG2  THR  43          HG2       THR  43  -1.964  -4.075   7.286
  332   2HG2  THR  43          HG2       THR  43  -2.971  -4.914   8.465
  333   3HG2  THR  43          HG2       THR  43  -1.447  -5.628   7.940
  334    H    LYS  44           HN       LYS  44  -2.035  -2.723  11.452
  335    HA   LYS  44           HA       LYS  44  -0.791  -0.300  12.511
  336   1HB   LYS  44          HB2       LYS  44  -2.766  -2.327  13.253
  337   2HB   LYS  44          HB1       LYS  44  -1.764  -1.821  14.614
  338   1HG   LYS  44          HG2       LYS  44  -2.412   0.436  14.413
  339   2HG   LYS  44          HG1       LYS  44  -2.988   0.216  12.760
  340   1HD   LYS  44          HD2       LYS  44  -4.577  -1.561  14.061
  341   2HD   LYS  44          HD1       LYS  44  -4.354  -0.354  15.327
  342   1HE   LYS  44          HE2       LYS  44  -4.832   0.994  12.822
  343   2HE   LYS  44          HE1       LYS  44  -6.120  -0.190  13.114
  344   1HZ   LYS  44          HZ1       LYS  44  -5.190   1.978  14.903
  345   2HZ   LYS  44          HZ2       LYS  44  -6.087   0.659  15.487
  346   3HZ   LYS  44          HZ3       LYS  44  -6.759   1.699  14.324
  347    H    ARG  45           HN       ARG  45  -0.087  -3.739  12.434
  348    HA   ARG  45           HA       ARG  45   1.929  -3.631  14.558
  349   1HB   ARG  45          HB2       ARG  45   0.397  -5.547  13.167
  350   2HB   ARG  45          HB1       ARG  45   2.077  -5.903  12.765
  351   1HG   ARG  45          HG2       ARG  45   1.786  -7.107  14.750
  352   2HG   ARG  45          HG1       ARG  45   2.485  -5.596  15.333
  353   1HD   ARG  45          HD2       ARG  45  -0.085  -4.863  15.438
  354   2HD   ARG  45          HD1       ARG  45  -0.313  -6.615  15.613
  355    HE   ARG  45           HE       ARG  45   1.800  -5.412  17.292
  356   1HH1  ARG  45          HH2       ARG  45  -1.574  -5.566  17.193
  357   2HH1  ARG  45          HH2       ARG  45  -1.755  -6.243  18.776
  358   1HH2  ARG  45          HH1       ARG  45   1.646  -6.727  19.247
  359   2HH2  ARG  45          HH1       ARG  45   0.067  -6.901  19.940
  360    H    GLY  46           HN       GLY  46   1.862  -2.980  11.160
  361   1HA   GLY  46          HA2       GLY  46   3.804  -1.825  10.175
  362   2HA   GLY  46          HA1       GLY  46   4.845  -2.842  11.171
  363    H    LYS  47           HN       LYS  47   2.131  -4.406   9.723
  364    HA   LYS  47           HA       LYS  47   3.948  -5.994   8.027
  365   1HB   LYS  47          HB2       LYS  47   2.139  -6.890   9.580
  366   2HB   LYS  47          HB1       LYS  47   0.957  -6.231   8.450
  367   1HG   LYS  47          HG2       LYS  47   1.156  -8.371   7.597
  368   2HG   LYS  47          HG1       LYS  47   2.432  -7.565   6.680
  369   1HD   LYS  47          HD2       LYS  47   4.100  -8.300   8.334
  370   2HD   LYS  47          HD1       LYS  47   2.832  -9.090   9.271
  371   1HE   LYS  47          HE2       LYS  47   3.036  -9.823   6.380
  372   2HE   LYS  47          HE1       LYS  47   4.277 -10.459   7.477
  373   1HZ   LYS  47          HZ1       LYS  47   2.455 -11.961   7.554
  374   2HZ   LYS  47          HZ2       LYS  47   1.331 -10.702   7.752
  375   3HZ   LYS  47          HZ3       LYS  47   2.418 -11.079   9.002
  376    H    LYS  48           HN       LYS  48   4.421  -4.524   6.288
  377    HA   LYS  48           HA       LYS  48   2.275  -3.166   4.840
  378   1HB   LYS  48          HB2       LYS  48   5.176  -3.648   4.099
  379   2HB   LYS  48          HB1       LYS  48   4.120  -2.391   3.453
  380   1HG   LYS  48          HG2       LYS  48   3.922  -1.983   6.175
  381   2HG   LYS  48          HG1       LYS  48   5.608  -2.461   5.987
  382   1HD   LYS  48          HD2       LYS  48   4.677  -0.569   3.935
  383   2HD   LYS  48          HD1       LYS  48   4.648   0.084   5.573
  384   1HE   LYS  48          HE2       LYS  48   7.091  -1.348   5.326
  385   2HE   LYS  48          HE1       LYS  48   6.932  -0.336   3.876
  386   1HZ   LYS  48          HZ1       LYS  48   7.807   1.104   5.473
  387   2HZ   LYS  48          HZ2       LYS  48   6.825   0.489   6.715
  388   3HZ   LYS  48          HZ3       LYS  48   6.148   1.453   5.491
  389    H    VAL  49           HN       VAL  49   1.037  -4.127   3.290
  390    HA   VAL  49           HA       VAL  49   2.051  -6.661   2.040
  391    HB   VAL  49           HB       VAL  49  -0.749  -5.566   2.465
  392   1HG1  VAL  49          HG1       VAL  49   0.294  -7.675   0.767
  393   2HG1  VAL  49          HG1       VAL  49  -1.355  -7.063   0.892
  394   3HG1  VAL  49          HG1       VAL  49  -0.803  -8.335   1.981
  395   1HG2  VAL  49          HG2       VAL  49   1.046  -7.412   3.986
  396   2HG2  VAL  49          HG2       VAL  49  -0.675  -7.797   3.934
  397   3HG2  VAL  49          HG2       VAL  49  -0.136  -6.249   4.589
  398    H    CYS  50           HN       CYS  50   2.126  -6.800  -0.208
  399    HA   CYS  50           HA       CYS  50   1.882  -4.299  -1.746
  400   1HB   CYS  50          HB2       CYS  50   2.931  -7.078  -2.097
  401   2HB   CYS  50          HB1       CYS  50   2.526  -6.175  -3.556
  402    H    THR  51           HN       THR  51   0.442  -4.080  -3.587
  403    HA   THR  51           HA       THR  51  -1.604  -6.157  -4.061
  404    HB   THR  51           HB       THR  51  -3.392  -4.349  -3.571
  405    HG1  THR  51           HG1      THR  51  -2.110  -2.574  -3.347
  406   1HG2  THR  51          HG2       THR  51  -3.594  -5.087  -1.333
  407   2HG2  THR  51          HG2       THR  51  -1.848  -5.244  -1.140
  408   3HG2  THR  51          HG2       THR  51  -2.731  -6.393  -2.144
  409    H    HIS  52           HN       HIS  52  -3.084  -5.444  -5.883
  410    HA   HIS  52           HA       HIS  52  -1.536  -3.905  -7.877
  411   1HB   HIS  52          HB2       HIS  52  -3.803  -5.861  -7.827
  412   2HB   HIS  52          HB1       HIS  52  -3.637  -4.813  -9.236
  413    HD1  HIS  52           HD1      HIS  52  -1.251  -4.914 -10.480
  414    HD2  HIS  52           HD2      HIS  52  -1.993  -7.983  -7.756
  415    HE1  HIS  52           HE1      HIS  52   0.439  -6.736 -10.974
  416    HA   PRO  53           HA       PRO  53  -4.186  -0.402  -7.298
  417   1HB   PRO  53          HB2       PRO  53  -3.443   1.033  -9.502
  418   2HB   PRO  53          HB1       PRO  53  -2.420   0.878  -8.063
  419   1HG   PRO  53          HG2       PRO  53  -2.187  -0.445 -10.692
  420   2HG   PRO  53          HG1       PRO  53  -0.928   0.008  -9.536
  421   1HD   PRO  53          HD2       PRO  53  -1.952  -2.560  -9.919
  422   2HD   PRO  53          HD1       PRO  53  -0.988  -2.016  -8.530
  423    H    ARG  54           HN       ARG  54  -4.070  -2.016 -10.470
  424    HA   ARG  54           HA       ARG  54  -6.394  -0.858 -11.633
  425   1HB   ARG  54          HB2       ARG  54  -6.353  -2.967 -12.990
  426   2HB   ARG  54          HB1       ARG  54  -4.766  -2.211 -12.852
  427   1HG   ARG  54          HG2       ARG  54  -4.870  -3.859 -10.624
  428   2HG   ARG  54          HG1       ARG  54  -5.676  -4.814 -11.868
  429   1HD   ARG  54          HD2       ARG  54  -3.151  -3.418 -12.652
  430   2HD   ARG  54          HD1       ARG  54  -3.011  -4.855 -11.620
  431    HE   ARG  54           HE       ARG  54  -4.497  -4.855 -14.223
  432   1HH1  ARG  54          HH1       ARG  54  -4.377  -6.948 -11.785
  433   2HH1  ARG  54          HH1       ARG  54  -3.472  -8.196 -12.575
  434   1HH2  ARG  54          HH2       ARG  54  -2.547  -6.197 -15.254
  435   2HH2  ARG  54          HH2       ARG  54  -2.436  -7.770 -14.539
  436    H    LYS  55           HN       LYS  55  -6.049  -3.203  -9.077
  437    HA   LYS  55           HA       LYS  55  -8.617  -4.479  -9.263
  438   1HB   LYS  55          HB2       LYS  55  -6.744  -3.916  -6.943
  439   2HB   LYS  55          HB1       LYS  55  -8.090  -5.054  -6.881
  440   1HG   LYS  55          HG2       LYS  55  -5.710  -5.202  -8.758
  441   2HG   LYS  55          HG1       LYS  55  -6.007  -6.252  -7.372
  442   1HD   LYS  55          HD2       LYS  55  -6.992  -7.610  -8.915
  443   2HD   LYS  55          HD1       LYS  55  -8.362  -6.515  -8.728
  444   1HE   LYS  55          HE2       LYS  55  -7.185  -5.088 -10.573
  445   2HE   LYS  55          HE1       LYS  55  -6.297  -6.584 -10.925
  446   1HZ   LYS  55          HZ1       LYS  55  -9.241  -6.210 -10.864
  447   2HZ   LYS  55          HZ2       LYS  55  -8.495  -7.735 -10.915
  448   3HZ   LYS  55          HZ3       LYS  55  -8.288  -6.643 -12.199
  449    H    LYS  56           HN       LYS  56 -10.575  -3.501  -8.988
  450    HA   LYS  56           HA       LYS  56 -11.021  -0.829  -8.219
  451   1HB   LYS  56          HB2       LYS  56 -12.645  -3.357  -8.292
  452   2HB   LYS  56          HB1       LYS  56 -13.375  -1.871  -7.683
  453   1HG   LYS  56          HG2       LYS  56 -13.871  -1.587  -9.908
  454   2HG   LYS  56          HG1       LYS  56 -12.249  -0.894  -9.921
  455   1HD   LYS  56          HD2       LYS  56 -11.284  -2.924 -10.737
  456   2HD   LYS  56          HD1       LYS  56 -12.766  -3.831 -10.429
  457   1HE   LYS  56          HE2       LYS  56 -13.622  -3.248 -12.447
  458   2HE   LYS  56          HE1       LYS  56 -13.257  -1.534 -12.167
  459   1HZ   LYS  56          HZ1       LYS  56 -10.848  -2.214 -12.532
  460   2HZ   LYS  56          HZ2       LYS  56 -11.842  -2.147 -13.908
  461   3HZ   LYS  56          HZ3       LYS  56 -11.461  -3.646 -13.203
  462    H    TRP  57           HN       TRP  57 -11.160  -3.772  -6.176
  463    HA   TRP  57           HA       TRP  57 -12.027  -2.485  -3.793
  464   1HB   TRP  57          HB2       TRP  57 -11.711  -4.590  -2.892
  465   2HB   TRP  57          HB1       TRP  57 -11.621  -5.018  -4.595
  466    HD1  TRP  57           HD1      TRP  57  -9.395  -6.004  -5.470
  467    HE1  TRP  57           HE1      TRP  57  -7.110  -6.525  -4.393
  468    HE3  TRP  57           HE3      TRP  57  -9.995  -3.684  -0.965
  469    HZ2  TRP  57           HZ2      TRP  57  -5.723  -6.015  -1.943
  470    HZ3  TRP  57           HZ3      TRP  57  -8.179  -3.721   0.722
  471    HH2  TRP  57           HH2      TRP  57  -6.045  -4.881   0.238
  472    H    VAL  58           HN       VAL  58  -8.766  -2.877  -5.160
  473    HA   VAL  58           HA       VAL  58  -7.317  -1.898  -2.868
  474    HB   VAL  58           HB       VAL  58  -6.735  -1.948  -5.846
  475   1HG1  VAL  58          HG1       VAL  58  -5.352  -0.521  -3.882
  476   2HG1  VAL  58          HG1       VAL  58  -4.726  -0.993  -5.460
  477   3HG1  VAL  58          HG1       VAL  58  -4.437  -2.018  -4.055
  478   1HG2  VAL  58          HG2       VAL  58  -6.163  -3.807  -3.534
  479   2HG2  VAL  58          HG2       VAL  58  -5.274  -3.905  -5.052
  480   3HG2  VAL  58          HG2       VAL  58  -7.016  -4.173  -5.033
  481    H    GLN  59           HN       GLN  59  -8.513  -0.282  -5.833
  482    HA   GLN  59           HA       GLN  59  -7.534   2.327  -5.269
  483   1HB   GLN  59          HB2       GLN  59  -9.996   1.289  -6.711
  484   2HB   GLN  59          HB1       GLN  59  -9.472   2.970  -6.782
  485   1HG   GLN  59          HG2       GLN  59  -7.177   2.001  -7.511
  486   2HG   GLN  59          HG1       GLN  59  -8.077   0.522  -7.850
  487   1HE2  GLN  59          HE2       GLN  59  -8.565   4.062  -8.433
  488   2HE2  GLN  59          HE2       GLN  59  -9.072   3.870 -10.041
  489    H    LYS  60           HN       LYS  60 -10.273   0.512  -4.056
  490    HA   LYS  60           HA       LYS  60 -11.583   2.796  -2.813
  491   1HB   LYS  60          HB2       LYS  60 -12.469   0.456  -3.636
  492   2HB   LYS  60          HB1       LYS  60 -11.968  -0.082  -2.032
  493   1HG   LYS  60          HG2       LYS  60 -13.417   1.506  -0.956
  494   2HG   LYS  60          HG1       LYS  60 -13.760   2.316  -2.485
  495   1HD   LYS  60          HD2       LYS  60 -15.020   0.466  -3.302
  496   2HD   LYS  60          HD1       LYS  60 -14.425  -0.597  -2.025
  497   1HE   LYS  60          HE2       LYS  60 -15.927   0.205  -0.483
  498   2HE   LYS  60          HE1       LYS  60 -15.841   1.861  -1.118
  499   1HZ   LYS  60          HZ1       LYS  60 -17.292  -0.454  -2.265
  500   2HZ   LYS  60          HZ2       LYS  60 -16.958   0.947  -3.165
  501   3HZ   LYS  60          HZ3       LYS  60 -17.934   1.037  -1.777
  502    H    TYR  61           HN       TYR  61  -9.250   0.314  -1.845
  503    HA   TYR  61           HA       TYR  61  -9.390   0.948   0.996
  504   1HB   TYR  61          HB2       TYR  61  -8.022  -0.873  -0.840
  505   2HB   TYR  61          HB1       TYR  61  -6.971  -0.319   0.464
  506    HD1  TYR  61           HD1      TYR  61  -7.172  -1.219   2.633
  507    HD2  TYR  61           HD2      TYR  61 -10.357  -1.755  -0.198
  508    HE1  TYR  61           HE1      TYR  61  -8.315  -2.754   4.210
  509    HE2  TYR  61           HE2      TYR  61 -11.501  -3.290   1.379
  510    HH   TYR  61           HH       TYR  61 -10.286  -4.863   3.618
  511    H    ILE  62           HN       ILE  62  -7.485   2.055  -1.758
  512    HA   ILE  62           HA       ILE  62  -5.463   3.430  -0.184
  513    HB   ILE  62           HB       ILE  62  -6.430   3.822  -3.040
  514   1HG1  ILE  62          HG1       ILE  62  -4.025   2.227  -2.161
  515   2HG1  ILE  62          HG1       ILE  62  -5.621   1.481  -2.251
  516   1HG2  ILE  62          HG2       ILE  62  -4.640   5.347  -1.529
  517   2HG2  ILE  62          HG2       ILE  62  -4.767   5.329  -3.288
  518   3HG2  ILE  62          HG2       ILE  62  -3.607   4.277  -2.477
  519   1HD1  ILE  62          HD1       ILE  62  -3.812   1.899  -4.381
  520   2HD1  ILE  62          HD1       ILE  62  -5.135   3.038  -4.632
  521   3HD1  ILE  62          HD1       ILE  62  -5.472   1.313  -4.491
  522    H    SER  63           HN       SER  63  -8.451   4.431  -1.866
  523    HA   SER  63           HA       SER  63  -8.258   7.222  -1.132
  524   1HB   SER  63          HB2       SER  63  -9.569   6.200  -3.024
  525   2HB   SER  63          HB1       SER  63 -10.679   5.528  -1.834
  526    HG   SER  63           HG       SER  63 -11.619   7.406  -2.178
  527    H    LEU  64           HN       LEU  64  -9.545   4.343   0.427
  528    HA   LEU  64           HA       LEU  64 -11.070   5.815   2.449
  529   1HB   LEU  64          HB2       LEU  64 -10.349   2.988   1.779
  530   2HB   LEU  64          HB1       LEU  64 -10.919   3.331   3.413
  531    HG   LEU  64           HG       LEU  64 -12.376   4.085   0.862
  532   1HD1  LEU  64          HD1       LEU  64 -12.514   1.749   2.719
  533   2HD1  LEU  64          HD1       LEU  64 -12.789   1.816   0.979
  534   3HD1  LEU  64          HD1       LEU  64 -14.034   2.386   2.090
  535   1HD2  LEU  64          HD2       LEU  64 -14.139   4.192   2.992
  536   2HD2  LEU  64          HD2       LEU  64 -13.355   5.588   2.252
  537   3HD2  LEU  64          HD2       LEU  64 -12.654   4.840   3.687
  538    H    LEU  65           HN       LEU  65  -8.070   3.825   2.514
  539    HA   LEU  65           HA       LEU  65  -7.357   4.237   5.206
  540   1HB   LEU  65          HB2       LEU  65  -6.038   3.557   2.648
  541   2HB   LEU  65          HB1       LEU  65  -4.953   4.216   3.872
  542    HG   LEU  65           HG       LEU  65  -6.834   1.865   4.260
  543   1HD1  LEU  65          HD1       LEU  65  -3.970   1.458   4.685
  544   2HD1  LEU  65          HD1       LEU  65  -4.337   1.931   3.026
  545   3HD1  LEU  65          HD1       LEU  65  -5.103   0.505   3.727
  546   1HD2  LEU  65          HD2       LEU  65  -4.900   2.006   6.303
  547   2HD2  LEU  65          HD2       LEU  65  -6.626   2.336   6.454
  548   3HD2  LEU  65          HD2       LEU  65  -5.504   3.653   6.112
  549    H    LYS  66           HN       LYS  66  -6.765   6.310   2.389
  550    HA   LYS  66           HA       LYS  66  -6.072   8.564   2.248
  551   1HB   LYS  66          HB2       LYS  66  -7.704   8.197   4.699
  552   2HB   LYS  66          HB1       LYS  66  -6.787   9.700   4.609
  553   1HG   LYS  66          HG2       LYS  66  -8.417   8.762   2.257
  554   2HG   LYS  66          HG1       LYS  66  -9.177   9.651   3.577
  555   1HD   LYS  66          HD2       LYS  66  -6.693  10.916   2.760
  556   2HD   LYS  66          HD1       LYS  66  -7.804  10.758   1.399
  557   1HE   LYS  66          HE2       LYS  66  -9.541  11.950   2.559
  558   2HE   LYS  66          HE1       LYS  66  -8.644  11.886   4.089
  559   1HZ   LYS  66          HZ1       LYS  66  -7.946  13.366   1.621
  560   2HZ   LYS  66          HZ2       LYS  66  -6.790  13.025   2.819
  561   3HZ   LYS  66          HZ3       LYS  66  -8.145  13.980   3.190
  562    H    THR  67           HN       THR  67  -3.814   8.575   2.231
  563    HA   THR  67           HA       THR  67  -2.488   9.057   4.843
  564    HB   THR  67           HB       THR  67  -1.592   7.044   2.765
  565    HG1  THR  67           HG1      THR  67  -2.398   5.536   4.095
  566   1HG2  THR  67          HG2       THR  67   0.326   6.785   3.957
  567   2HG2  THR  67          HG2       THR  67  -0.499   6.982   5.504
  568   3HG2  THR  67          HG2       THR  67  -0.040   8.400   4.562
  569    HA   PRO  68           HA       PRO  68  -0.946  11.487   1.078
  570   1HB   PRO  68          HB2       PRO  68  -2.140  13.898   1.563
  571   2HB   PRO  68          HB1       PRO  68  -2.894  12.633   0.571
  572   1HG   PRO  68          HG2       PRO  68  -3.433  13.396   3.391
  573   2HG   PRO  68          HG1       PRO  68  -4.554  12.867   2.130
  574   1HD   PRO  68          HD2       PRO  68  -3.639  11.258   4.150
  575   2HD   PRO  68          HD1       PRO  68  -4.216  10.664   2.578
  576    H    LYS  69           HN       LYS  69   1.121  12.102   1.640
  577    HA   LYS  69           HA       LYS  69   1.584  13.328   4.305
  578   1HB   LYS  69          HB2       LYS  69   2.783  11.262   3.230
  579   2HB   LYS  69          HB1       LYS  69   3.688  12.478   2.329
  580   1HG   LYS  69          HG2       LYS  69   5.041  12.275   4.199
  581   2HG   LYS  69          HG1       LYS  69   3.966  13.568   4.735
  582   1HD   LYS  69          HD2       LYS  69   2.853  10.912   5.244
  583   2HD   LYS  69          HD1       LYS  69   4.394  11.165   6.063
  584   1HE   LYS  69          HE2       LYS  69   3.555  12.838   7.417
  585   2HE   LYS  69          HE1       LYS  69   2.402  13.393   6.188
  586   1HZ   LYS  69          HZ1       LYS  69   2.231  10.961   7.877
  587   2HZ   LYS  69          HZ2       LYS  69   1.285  11.169   6.480
  588   3HZ   LYS  69          HZ3       LYS  69   1.125  12.245   7.786
  589    H    GLN  70           HN       GLN  70   0.708  15.462   3.557
  590    HA   GLN  70           HA       GLN  70   2.110  16.888   1.416
  591   1HB   GLN  70          HB2       GLN  70  -0.332  17.097   2.231
  592   2HB   GLN  70          HB1       GLN  70   0.326  18.045   3.565
  593   1HG   GLN  70          HG2       GLN  70   1.456  19.515   1.852
  594   2HG   GLN  70          HG1       GLN  70   0.558  18.649   0.606
  595   1HE2  GLN  70          HE2       GLN  70  -1.914  18.328   2.113
  596   2HE2  GLN  70          HE2       GLN  70  -2.612  19.867   2.274
  597    H    LEU  71           HN       LEU  71   1.840  17.386   4.963
  598    HA   LEU  71           HA       LEU  71   4.069  19.275   4.989
  599   1HB   LEU  71          HB2       LEU  71   2.068  18.100   6.825
  600   2HB   LEU  71          HB1       LEU  71   3.596  18.546   7.587
  601    HG   LEU  71           HG       LEU  71   2.705  20.597   5.726
  602   1HD1  LEU  71          HD1       LEU  71   0.483  19.614   6.466
  603   2HD1  LEU  71          HD1       LEU  71   0.712  21.319   6.857
  604   3HD1  LEU  71          HD1       LEU  71   0.907  20.093   8.110
  605   1HD2  LEU  71          HD2       LEU  71   2.709  21.618   8.312
  606   2HD2  LEU  71          HD2       LEU  71   4.095  21.579   7.222
  607   3HD2  LEU  71          HD2       LEU  71   3.863  20.287   8.399
  Start of MODEL    6
    1   1H    THR   1          HT1       THR   1  20.837  -9.419   1.905
    2   2H    THR   1          HT2       THR   1  20.823 -10.893   1.058
    3   3H    THR   1          HT3       THR   1  21.987 -10.613   2.264
    4    HA   THR   1           HA       THR   1  19.077 -11.085   2.610
    5    HB   THR   1           HB       THR   1  21.489 -12.359   3.915
    6    HG1  THR   1           HG1      THR   1  20.181 -13.325   1.608
    7   1HG2  THR   1          HG2       THR   1  19.155 -12.719   4.813
    8   2HG2  THR   1          HG2       THR   1  19.982 -14.194   4.309
    9   3HG2  THR   1          HG2       THR   1  18.750 -13.474   3.271
   10    H    ARG   2           HN       ARG   2  18.154  -9.831   4.172
   11    HA   ARG   2           HA       ARG   2  17.924  -8.464   6.083
   12   1HB   ARG   2          HB2       ARG   2  19.529 -10.758   6.649
   13   2HB   ARG   2          HB1       ARG   2  20.207  -9.398   7.546
   14   1HG   ARG   2          HG2       ARG   2  18.530  -9.538   9.036
   15   2HG   ARG   2          HG1       ARG   2  17.357  -9.259   7.749
   16   1HD   ARG   2          HD2       ARG   2  17.119 -11.596   7.315
   17   2HD   ARG   2          HD1       ARG   2  18.563 -11.992   8.271
   18    HE   ARG   2           HE       ARG   2  16.974 -10.666  10.086
   19   1HH1  ARG   2          HH2       ARG   2  15.031 -12.028   7.924
   20   2HH1  ARG   2          HH2       ARG   2  14.478 -13.356   8.890
   21   1HH2  ARG   2          HH1       ARG   2  16.894 -12.928  11.340
   22   2HH2  ARG   2          HH1       ARG   2  15.533 -13.866  10.822
   23    H    GLY   3           HN       GLY   3  18.460  -6.379   5.397
   24   1HA   GLY   3          HA2       GLY   3  21.142  -5.416   6.138
   25   2HA   GLY   3          HA1       GLY   3  20.725  -5.246   4.430
   26    H    SER   4           HN       SER   4  18.648  -4.069   3.974
   27    HA   SER   4           HA       SER   4  18.309  -1.826   5.928
   28   1HB   SER   4          HB2       SER   4  18.424  -2.145   2.995
   29   2HB   SER   4          HB1       SER   4  17.162  -1.051   3.555
   30    HG   SER   4           HG       SER   4  19.572  -0.380   3.226
   31    H    ASP   5           HN       ASP   5  15.960  -0.846   5.677
   32    HA   ASP   5           HA       ASP   5  14.053  -2.737   6.616
   33   1HB   ASP   5          HB2       ASP   5  13.981   0.044   5.456
   34   2HB   ASP   5          HB1       ASP   5  12.477  -0.776   5.876
   35    H    ILE   6           HN       ILE   6  11.836  -2.980   5.355
   36    HA   ILE   6           HA       ILE   6  12.415  -3.584   2.473
   37    HB   ILE   6           HB       ILE   6  10.757  -5.213   4.424
   38   1HG1  ILE   6          HG1       ILE   6  13.515  -5.838   3.323
   39   2HG1  ILE   6          HG1       ILE   6  13.237  -5.165   4.930
   40   1HG2  ILE   6          HG2       ILE   6  11.850  -6.443   1.982
   41   2HG2  ILE   6          HG2       ILE   6  10.677  -5.162   1.675
   42   3HG2  ILE   6          HG2       ILE   6  10.228  -6.550   2.665
   43   1HD1  ILE   6          HD1       ILE   6  11.758  -7.641   4.088
   44   2HD1  ILE   6          HD1       ILE   6  12.196  -7.105   5.710
   45   3HD1  ILE   6          HD1       ILE   6  13.429  -7.770   4.640
   46    H    SER   7           HN       SER   7  11.185  -1.187   3.348
   47    HA   SER   7           HA       SER   7   8.316  -1.641   2.657
   48   1HB   SER   7          HB2       SER   7   9.765   0.435   4.310
   49   2HB   SER   7          HB1       SER   7   8.074   0.602   3.847
   50    HG   SER   7           HG       SER   7   7.723  -1.449   4.863
   51    H    LYS   8           HN       LYS   8  11.256  -0.381   1.488
   52    HA   LYS   8           HA       LYS   8   9.825   1.458  -0.378
   53   1HB   LYS   8          HB2       LYS   8  11.670   2.185   1.337
   54   2HB   LYS   8          HB1       LYS   8  12.781   1.460   0.175
   55   1HG   LYS   8          HG2       LYS   8  11.910   2.908  -1.598
   56   2HG   LYS   8          HG1       LYS   8  10.740   3.604  -0.476
   57   1HD   LYS   8          HD2       LYS   8  12.375   4.751   0.731
   58   2HD   LYS   8          HD1       LYS   8  13.661   3.662   0.213
   59   1HE   LYS   8          HE2       LYS   8  12.549   4.868  -2.135
   60   2HE   LYS   8          HE1       LYS   8  12.918   6.154  -0.969
   61   1HZ   LYS   8          HZ1       LYS   8  14.871   5.507  -2.300
   62   2HZ   LYS   8          HZ2       LYS   8  14.760   3.931  -1.675
   63   3HZ   LYS   8          HZ3       LYS   8  15.102   5.237  -0.642
   64    H    THR   9           HN       THR   9   9.923  -1.380  -0.851
   65    HA   THR   9           HA       THR   9  11.868  -1.528  -3.131
   66    HB   THR   9           HB       THR   9  12.266  -3.041  -1.185
   67    HG1  THR   9           HG1      THR   9  12.086  -5.026  -2.518
   68   1HG2  THR   9          HG2       THR   9   9.491  -4.005  -1.904
   69   2HG2  THR   9          HG2       THR   9  10.039  -3.365  -0.355
   70   3HG2  THR   9          HG2       THR   9  10.610  -4.939  -0.910
   71    H    CYS  10           HN       CYS  10  10.947  -3.432  -4.686
   72    HA   CYS  10           HA       CYS  10   8.394  -2.423  -5.709
   73   1HB   CYS  10          HB2       CYS  10  10.145  -4.753  -6.563
   74   2HB   CYS  10          HB1       CYS  10   8.906  -3.972  -7.539
   75    H    CYS  11           HN       CYS  11   6.704  -4.162  -6.372
   76    HA   CYS  11           HA       CYS  11   6.372  -6.127  -4.123
   77   1HB   CYS  11          HB2       CYS  11   4.487  -4.299  -5.607
   78   2HB   CYS  11          HB1       CYS  11   3.875  -5.720  -4.762
   79    H    PHE  12           HN       PHE  12   6.566  -8.203  -4.895
   80    HA   PHE  12           HA       PHE  12   5.866  -8.735  -7.744
   81   1HB   PHE  12          HB2       PHE  12   7.919  -9.580  -5.849
   82   2HB   PHE  12          HB1       PHE  12   7.156 -10.954  -6.648
   83    HD1  PHE  12           HD1      PHE  12   7.934 -11.603  -8.753
   84    HD2  PHE  12           HD2      PHE  12   8.534  -7.555  -7.447
   85    HE1  PHE  12           HE1      PHE  12   9.244 -11.135 -10.806
   86    HE2  PHE  12           HE2      PHE  12   9.842  -7.086  -9.501
   87    HZ   PHE  12           HZ       PHE  12  10.197  -8.876 -11.181
   88    H    GLN  13           HN       GLN  13   4.151  -8.718  -5.056
   89    HA   GLN  13           HA       GLN  13   2.564 -11.093  -5.822
   90   1HB   GLN  13          HB2       GLN  13   4.497 -11.258  -3.857
   91   2HB   GLN  13          HB1       GLN  13   3.042 -10.903  -2.925
   92   1HG   GLN  13          HG2       GLN  13   2.031 -12.889  -3.477
   93   2HG   GLN  13          HG1       GLN  13   2.793 -12.956  -5.066
   94   1HE2  GLN  13          HE2       GLN  13   3.617 -15.136  -4.768
   95   2HE2  GLN  13          HE2       GLN  13   4.865 -15.477  -3.669
   96    H    TYR  14           HN       TYR  14   0.362 -10.863  -5.192
   97    HA   TYR  14           HA       TYR  14  -0.343  -8.423  -3.628
   98   1HB   TYR  14          HB2       TYR  14  -1.623  -9.316  -6.231
   99   2HB   TYR  14          HB1       TYR  14  -1.984  -7.840  -5.337
  100    HD1  TYR  14           HD1      TYR  14  -0.439  -8.883  -8.182
  101    HD2  TYR  14           HD2      TYR  14   0.470  -6.622  -4.644
  102    HE1  TYR  14           HE1      TYR  14   1.375  -7.710  -9.399
  103    HE2  TYR  14           HE2      TYR  14   2.286  -5.449  -5.862
  104    HH   TYR  14           HH       TYR  14   2.560  -5.349  -9.100
  105    H    SER  15           HN       SER  15  -1.986  -8.821  -2.160
  106    HA   SER  15           HA       SER  15  -3.011 -11.538  -1.874
  107   1HB   SER  15          HB2       SER  15  -2.463  -9.458  -0.209
  108   2HB   SER  15          HB1       SER  15  -4.207  -9.270  -0.377
  109    HG   SER  15           HG       SER  15  -3.071 -10.868   1.240
  110    H    HIS  16           HN       HIS  16  -5.609 -11.290  -1.136
  111    HA   HIS  16           HA       HIS  16  -7.139  -9.781  -3.164
  112   1HB   HIS  16          HB2       HIS  16  -8.143 -11.921  -4.026
  113   2HB   HIS  16          HB1       HIS  16  -6.423 -11.772  -4.381
  114    HD1  HIS  16           HD1      HIS  16  -6.661 -14.509  -4.486
  115    HD2  HIS  16           HD2      HIS  16  -6.928 -12.745  -0.717
  116    HE1  HIS  16           HE1      HIS  16  -6.258 -16.355  -2.799
  117    H    LYS  17           HN       LYS  17  -6.892 -10.237  -0.126
  118    HA   LYS  17           HA       LYS  17  -9.771 -10.868   0.373
  119   1HB   LYS  17          HB2       LYS  17  -7.210 -11.641   1.733
  120   2HB   LYS  17          HB1       LYS  17  -8.681 -11.515   2.698
  121   1HG   LYS  17          HG2       LYS  17  -9.507 -12.916   0.445
  122   2HG   LYS  17          HG1       LYS  17  -7.899 -13.568   0.770
  123   1HD   LYS  17          HD2       LYS  17 -10.155 -13.346   2.786
  124   2HD   LYS  17          HD1       LYS  17  -9.615 -14.833   2.006
  125   1HE   LYS  17          HE2       LYS  17  -7.269 -13.699   3.058
  126   2HE   LYS  17          HE1       LYS  17  -8.492 -13.495   4.328
  127   1HZ   LYS  17          HZ1       LYS  17  -7.700 -15.671   4.609
  128   2HZ   LYS  17          HZ2       LYS  17  -7.695 -15.986   2.940
  129   3HZ   LYS  17          HZ3       LYS  17  -9.166 -15.860   3.778
  130    HA   PRO  18           HA       PRO  18  -9.870  -6.806   2.101
  131   1HB   PRO  18          HB2       PRO  18 -12.114  -7.038   3.650
  132   2HB   PRO  18          HB1       PRO  18 -12.170  -6.900   1.881
  133   1HG   PRO  18          HG2       PRO  18 -12.447  -9.308   3.601
  134   2HG   PRO  18          HG1       PRO  18 -13.288  -8.886   2.102
  135   1HD   PRO  18          HD2       PRO  18 -11.214 -10.666   2.238
  136   2HD   PRO  18          HD1       PRO  18 -11.632  -9.739   0.781
  137    H    LEU  19           HN       LEU  19  -8.248  -6.430   3.583
  138    HA   LEU  19           HA       LEU  19  -7.793  -8.004   5.967
  139   1HB   LEU  19          HB2       LEU  19  -6.462  -6.151   4.408
  140   2HB   LEU  19          HB1       LEU  19  -6.795  -5.232   5.873
  141    HG   LEU  19           HG       LEU  19  -5.884  -7.923   6.500
  142   1HD1  LEU  19          HD1       LEU  19  -3.612  -6.368   5.449
  143   2HD1  LEU  19          HD1       LEU  19  -4.705  -6.972   4.204
  144   3HD1  LEU  19          HD1       LEU  19  -3.944  -8.097   5.328
  145   1HD2  LEU  19          HD2       LEU  19  -4.615  -5.224   7.059
  146   2HD2  LEU  19          HD2       LEU  19  -4.429  -6.706   7.998
  147   3HD2  LEU  19          HD2       LEU  19  -5.978  -5.863   7.980
  148    HA   PRO  20           HA       PRO  20 -10.658  -6.052   8.714
  149   1HB   PRO  20          HB2       PRO  20  -9.291  -6.252  11.085
  150   2HB   PRO  20          HB1       PRO  20 -10.090  -7.635  10.308
  151   1HG   PRO  20          HG2       PRO  20  -7.212  -6.848  10.269
  152   2HG   PRO  20          HG1       PRO  20  -7.938  -8.456  10.440
  153   1HD   PRO  20          HD2       PRO  20  -6.903  -7.580   8.106
  154   2HD   PRO  20          HD1       PRO  20  -8.294  -8.684   8.175
  155    H    TRP  21           HN       TRP  21 -10.792  -3.856   8.327
  156    HA   TRP  21           HA       TRP  21  -8.837  -1.927   8.109
  157   1HB   TRP  21          HB2       TRP  21 -11.632  -1.854   9.252
  158   2HB   TRP  21          HB1       TRP  21 -10.698  -0.380   8.989
  159    HD1  TRP  21           HD1      TRP  21 -12.640  -3.046   7.187
  160    HE1  TRP  21           HE1      TRP  21 -12.710  -2.510   4.664
  161    HE3  TRP  21           HE3      TRP  21  -9.268   0.781   7.008
  162    HZ2  TRP  21           HZ2      TRP  21 -11.487  -0.694   2.818
  163    HZ3  TRP  21           HZ3      TRP  21  -8.741   1.895   4.858
  164    HH2  TRP  21           HH2      TRP  21  -9.845   1.163   2.765
  165    H    THR  22           HN       THR  22  -9.996  -3.336  11.134
  166    HA   THR  22           HA       THR  22  -9.062  -1.403  12.984
  167    HB   THR  22           HB       THR  22  -8.809  -3.503  14.440
  168    HG1  THR  22           HG1      THR  22  -9.403  -5.416  13.493
  169   1HG2  THR  22          HG2       THR  22 -11.228  -2.576  12.983
  170   2HG2  THR  22          HG2       THR  22 -10.910  -2.635  14.718
  171   3HG2  THR  22          HG2       THR  22 -11.370  -4.104  13.855
  172    H    TRP  23           HN       TRP  23  -7.354  -4.119  11.441
  173    HA   TRP  23           HA       TRP  23  -4.784  -3.342  12.660
  174   1HB   TRP  23          HB2       TRP  23  -5.969  -5.590  11.103
  175   2HB   TRP  23          HB1       TRP  23  -4.233  -5.346  10.932
  176    HD1  TRP  23           HD1      TRP  23  -5.995  -4.541  14.218
  177    HE1  TRP  23           HE1      TRP  23  -5.177  -6.187  16.025
  178    HE3  TRP  23           HE3      TRP  23  -3.272  -7.747  11.322
  179    HZ2  TRP  23           HZ2      TRP  23  -3.580  -8.553  16.216
  180    HZ3  TRP  23           HZ3      TRP  23  -2.114  -9.687  12.340
  181    HH2  TRP  23           HH2      TRP  23  -2.265 -10.094  14.781
  182    H    VAL  24           HN       VAL  24  -6.563  -2.536   9.831
  183    HA   VAL  24           HA       VAL  24  -4.221  -2.115   8.109
  184    HB   VAL  24           HB       VAL  24  -7.088  -1.144   7.848
  185   1HG1  VAL  24          HG1       VAL  24  -5.550  -1.885   5.457
  186   2HG1  VAL  24          HG1       VAL  24  -4.868  -0.517   6.335
  187   3HG1  VAL  24          HG1       VAL  24  -6.534  -0.453   5.760
  188   1HG2  VAL  24          HG2       VAL  24  -6.631  -3.706   8.162
  189   2HG2  VAL  24          HG2       VAL  24  -5.962  -3.611   6.536
  190   3HG2  VAL  24          HG2       VAL  24  -7.649  -3.186   6.821
  191    H    ARG  25           HN       ARG  25  -2.930  -0.314   8.305
  192    HA   ARG  25           HA       ARG  25  -3.991   2.013   9.840
  193   1HB   ARG  25          HB2       ARG  25  -1.882   0.696  10.445
  194   2HB   ARG  25          HB1       ARG  25  -1.143   1.420   9.016
  195   1HG   ARG  25          HG2       ARG  25  -2.514   3.412  10.642
  196   2HG   ARG  25          HG1       ARG  25  -1.268   2.565  11.560
  197   1HD   ARG  25          HD2       ARG  25   0.428   3.140   9.938
  198   2HD   ARG  25          HD1       ARG  25  -0.789   3.779   8.817
  199    HE   ARG  25           HE       ARG  25  -1.102   5.107  11.318
  200   1HH1  ARG  25          HH2       ARG  25  -0.010   5.573   8.219
  201   2HH1  ARG  25          HH2       ARG  25   1.121   6.829   8.598
  202   1HH2  ARG  25          HH1       ARG  25   0.839   6.412  12.029
  203   2HH2  ARG  25          HH1       ARG  25   1.602   7.303  10.755
  204    H    SER  26           HN       SER  26  -2.325   1.229   6.758
  205    HA   SER  26           HA       SER  26  -3.577   3.466   5.409
  206   1HB   SER  26          HB2       SER  26  -1.790   5.013   5.392
  207   2HB   SER  26          HB1       SER  26  -1.807   4.424   7.051
  208    HG   SER  26           HG       SER  26   0.276   4.253   6.369
  209    H    TYR  27           HN       TYR  27  -1.345   3.945   3.600
  210    HA   TYR  27           HA       TYR  27  -0.645   1.278   2.538
  211   1HB   TYR  27          HB2       TYR  27  -1.873   1.551   0.508
  212   2HB   TYR  27          HB1       TYR  27  -2.988   2.010   1.790
  213    HD1  TYR  27           HD1      TYR  27  -0.833   3.262  -0.935
  214    HD2  TYR  27           HD2      TYR  27  -3.702   4.311   2.085
  215    HE1  TYR  27           HE1      TYR  27  -1.116   5.492  -1.981
  216    HE2  TYR  27           HE2      TYR  27  -3.986   6.540   1.038
  217    HH   TYR  27           HH       TYR  27  -2.497   8.067  -0.470
  218    H    GLU  28           HN       GLU  28   0.343   1.921   0.101
  219    HA   GLU  28           HA       GLU  28   1.761   4.409  -0.108
  220   1HB   GLU  28          HB2       GLU  28   4.020   3.506   0.524
  221   2HB   GLU  28          HB1       GLU  28   2.904   3.580   1.887
  222   1HG   GLU  28          HG2       GLU  28   2.313   1.122   1.213
  223   2HG   GLU  28          HG1       GLU  28   3.850   1.173   0.351
  224    H    PHE  29           HN       PHE  29   2.343   4.549  -2.247
  225    HA   PHE  29           HA       PHE  29   2.143   2.165  -3.953
  226   1HB   PHE  29          HB2       PHE  29   1.767   4.942  -4.161
  227   2HB   PHE  29          HB1       PHE  29   3.153   4.592  -5.194
  228    HD1  PHE  29           HD1      PHE  29  -0.289   4.886  -5.237
  229    HD2  PHE  29           HD2      PHE  29   2.807   2.198  -6.518
  230    HE1  PHE  29           HE1      PHE  29  -1.809   3.958  -6.963
  231    HE2  PHE  29           HE2      PHE  29   1.287   1.270  -8.244
  232    HZ   PHE  29           HZ       PHE  29  -1.020   2.151  -8.467
  233    H    THR  30           HN       THR  30   3.884   1.183  -5.039
  234    HA   THR  30           HA       THR  30   6.447   1.122  -3.858
  235    HB   THR  30           HB       THR  30   6.964   0.313  -6.367
  236    HG1  THR  30           HG1      THR  30   5.224   0.783  -7.475
  237   1HG2  THR  30          HG2       THR  30   6.907  -1.170  -4.443
  238   2HG2  THR  30          HG2       THR  30   5.943  -1.880  -5.737
  239   3HG2  THR  30          HG2       THR  30   5.147  -1.079  -4.383
  240    H    SER  31           HN       SER  31   8.525   1.793  -5.056
  241    HA   SER  31           HA       SER  31   8.522   4.661  -5.462
  242   1HB   SER  31          HB2       SER  31  10.677   2.652  -6.162
  243   2HB   SER  31          HB1       SER  31  10.891   4.334  -5.684
  244    HG   SER  31           HG       SER  31  10.353   2.077  -4.157
  245    H    ASN  32           HN       ASN  32  10.030   5.287  -7.571
  246    HA   ASN  32           HA       ASN  32   8.322   4.607  -9.889
  247   1HB   ASN  32          HB2       ASN  32  10.254   6.699  -9.051
  248   2HB   ASN  32          HB1       ASN  32  10.210   6.357 -10.780
  249   1HD2  ASN  32          HD2       ASN  32   7.626   5.962 -11.432
  250   2HD2  ASN  32          HD2       ASN  32   6.635   7.253 -10.949
  251    H    SER  33           HN       SER  33  11.619   4.082  -8.728
  252    HA   SER  33           HA       SER  33  12.817   3.175 -11.153
  253   1HB   SER  33          HB2       SER  33  14.179   3.684  -9.267
  254   2HB   SER  33          HB1       SER  33  13.238   2.637  -8.209
  255    HG   SER  33           HG       SER  33  15.093   1.546  -8.770
  256    H    CYS  34           HN       CYS  34  10.634   1.603  -8.898
  257    HA   CYS  34           HA       CYS  34  11.101  -1.128  -9.509
  258   1HB   CYS  34          HB2       CYS  34   8.760   0.543  -8.627
  259   2HB   CYS  34          HB1       CYS  34   8.530  -1.176  -8.950
  260    H    SER  35           HN       SER  35  10.357  -2.465 -11.181
  261    HA   SER  35           HA       SER  35   9.507  -1.134 -13.666
  262   1HB   SER  35          HB2       SER  35   9.742  -4.100 -13.220
  263   2HB   SER  35          HB1       SER  35  10.154  -3.163 -14.653
  264    HG   SER  35           HG       SER  35  11.907  -3.953 -13.151
  265    H    GLN  36           HN       GLN  36   8.088  -3.098 -11.121
  266    HA   GLN  36           HA       GLN  36   5.528  -3.282 -12.665
  267   1HB   GLN  36          HB2       GLN  36   7.074  -5.066 -11.069
  268   2HB   GLN  36          HB1       GLN  36   5.569  -4.762 -10.197
  269   1HG   GLN  36          HG2       GLN  36   5.473  -5.334 -13.143
  270   2HG   GLN  36          HG1       GLN  36   5.661  -6.670 -12.008
  271   1HE2  GLN  36          HE2       GLN  36   3.462  -7.434 -12.539
  272   2HE2  GLN  36          HE2       GLN  36   2.099  -6.625 -11.931
  273    H    ARG  37           HN       ARG  37   4.776  -1.120 -12.160
  274    HA   ARG  37           HA       ARG  37   4.767   0.099  -9.600
  275   1HB   ARG  37          HB2       ARG  37   3.103   0.255 -12.101
  276   2HB   ARG  37          HB1       ARG  37   2.620   1.188 -10.682
  277   1HG   ARG  37          HG2       ARG  37   4.465   2.562 -10.781
  278   2HG   ARG  37          HG1       ARG  37   5.489   1.312 -11.489
  279   1HD   ARG  37          HD2       ARG  37   5.166   2.336 -13.490
  280   2HD   ARG  37          HD1       ARG  37   3.480   1.785 -13.410
  281    HE   ARG  37           HE       ARG  37   3.717   4.079 -11.752
  282   1HH1  ARG  37          HH1       ARG  37   1.778   3.610 -14.082
  283   2HH1  ARG  37          HH1       ARG  37   2.189   4.937 -15.117
  284   1HH2  ARG  37          HH2       ARG  37   5.191   5.603 -13.514
  285   2HH2  ARG  37          HH2       ARG  37   4.121   6.066 -14.795
  286    H    ALA  38           HN       ALA  38   3.584  -0.327  -7.769
  287    HA   ALA  38           HA       ALA  38   0.990  -1.725  -7.950
  288   1HB   ALA  38          HB1       ALA  38   3.089  -3.311  -7.901
  289   2HB   ALA  38          HB2       ALA  38   1.709  -3.679  -6.867
  290   3HB   ALA  38          HB3       ALA  38   3.132  -2.889  -6.190
  291    H    VAL  39           HN       VAL  39  -0.104  -1.749  -5.810
  292    HA   VAL  39           HA       VAL  39   0.759   0.567  -4.138
  293    HB   VAL  39           HB       VAL  39  -1.846  -0.982  -4.346
  294   1HG1  VAL  39          HG1       VAL  39  -2.810   0.780  -3.017
  295   2HG1  VAL  39          HG1       VAL  39  -1.309   1.704  -3.053
  296   3HG1  VAL  39          HG1       VAL  39  -1.393   0.190  -2.153
  297   1HG2  VAL  39          HG2       VAL  39  -1.510   1.842  -5.268
  298   2HG2  VAL  39          HG2       VAL  39  -2.567   0.577  -5.894
  299   3HG2  VAL  39          HG2       VAL  39  -0.848   0.565  -6.289
  300    H    ILE  40           HN       ILE  40   0.631   0.300  -1.755
  301    HA   ILE  40           HA       ILE  40   0.813  -2.544  -0.844
  302    HB   ILE  40           HB       ILE  40   2.673  -0.209  -0.333
  303   1HG1  ILE  40          HG1       ILE  40   3.425  -2.947  -1.313
  304   2HG1  ILE  40          HG1       ILE  40   2.808  -1.743  -2.443
  305   1HG2  ILE  40          HG2       ILE  40   3.946  -1.831   1.085
  306   2HG2  ILE  40          HG2       ILE  40   2.587  -2.949   0.951
  307   3HG2  ILE  40          HG2       ILE  40   2.377  -1.395   1.762
  308   1HD1  ILE  40          HD1       ILE  40   5.172  -1.462  -2.478
  309   2HD1  ILE  40          HD1       ILE  40   5.288  -1.582  -0.723
  310   3HD1  ILE  40          HD1       ILE  40   4.569  -0.151  -1.464
  311    H    PHE  41           HN       PHE  41  -0.834  -2.745   0.638
  312    HA   PHE  41           HA       PHE  41  -1.722  -0.413   2.228
  313   1HB   PHE  41          HB2       PHE  41  -2.661  -3.301   2.023
  314   2HB   PHE  41          HB1       PHE  41  -3.502  -2.024   2.904
  315    HD1  PHE  41           HD1      PHE  41  -3.553  -3.783  -0.072
  316    HD2  PHE  41           HD2      PHE  41  -3.677   0.258   1.377
  317    HE1  PHE  41           HE1      PHE  41  -4.675  -3.065  -2.166
  318    HE2  PHE  41           HE2      PHE  41  -4.796   0.976  -0.716
  319    HZ   PHE  41           HZ       PHE  41  -5.295  -0.686  -2.486
  320    H    THR  42           HN       THR  42  -0.865  -0.087   4.257
  321    HA   THR  42           HA       THR  42   0.682  -2.325   5.477
  322    HB   THR  42           HB       THR  42   1.902  -0.263   5.137
  323    HG1  THR  42           HG1      THR  42   1.924  -1.420   7.280
  324   1HG2  THR  42          HG2       THR  42  -0.643   0.906   5.876
  325   2HG2  THR  42          HG2       THR  42   0.732   1.653   5.062
  326   3HG2  THR  42          HG2       THR  42   0.667   1.606   6.824
  327    H    THR  43           HN       THR  43   0.485  -2.602   7.853
  328    HA   THR  43           HA       THR  43  -2.327  -2.102   8.747
  329    HB   THR  43           HB       THR  43  -1.812  -4.133  10.202
  330    HG1  THR  43           HG1      THR  43   0.350  -4.462   8.421
  331   1HG2  THR  43          HG2       THR  43  -2.841  -4.003   7.752
  332   2HG2  THR  43          HG2       THR  43  -2.506  -5.554   8.520
  333   3HG2  THR  43          HG2       THR  43  -1.371  -4.889   7.346
  334    H    LYS  44           HN       LYS  44  -2.159  -2.570  11.400
  335    HA   LYS  44           HA       LYS  44  -0.757  -0.201  12.412
  336   1HB   LYS  44          HB2       LYS  44  -2.702  -2.252  13.436
  337   2HB   LYS  44          HB1       LYS  44  -1.916  -1.142  14.561
  338   1HG   LYS  44          HG2       LYS  44  -2.819   0.371  12.309
  339   2HG   LYS  44          HG1       LYS  44  -4.159  -0.632  12.866
  340   1HD   LYS  44          HD2       LYS  44  -3.318   0.206  15.253
  341   2HD   LYS  44          HD1       LYS  44  -2.701   1.553  14.295
  342   1HE   LYS  44          HE2       LYS  44  -4.831   2.260  13.668
  343   2HE   LYS  44          HE1       LYS  44  -5.531   0.639  13.846
  344   1HZ   LYS  44          HZ1       LYS  44  -4.898   0.874  16.284
  345   2HZ   LYS  44          HZ2       LYS  44  -6.231   1.781  15.746
  346   3HZ   LYS  44          HZ3       LYS  44  -4.723   2.532  15.972
  347    H    ARG  45           HN       ARG  45  -0.260  -3.645  12.321
  348    HA   ARG  45           HA       ARG  45   1.611  -3.738  14.573
  349   1HB   ARG  45          HB2       ARG  45   0.099  -5.590  13.740
  350   2HB   ARG  45          HB1       ARG  45   1.131  -5.708  12.315
  351   1HG   ARG  45          HG2       ARG  45   3.071  -5.915  14.070
  352   2HG   ARG  45          HG1       ARG  45   1.773  -6.377  15.173
  353   1HD   ARG  45          HD2       ARG  45   1.409  -7.780  12.685
  354   2HD   ARG  45          HD1       ARG  45   3.066  -8.039  13.265
  355    HE   ARG  45           HE       ARG  45   1.533  -8.288  15.556
  356   1HH1  ARG  45          HH2       ARG  45  -0.081  -9.229  12.883
  357   2HH1  ARG  45          HH2       ARG  45  -0.056 -10.933  13.195
  358   1HH2  ARG  45          HH1       ARG  45   2.255 -10.698  15.769
  359   2HH2  ARG  45          HH1       ARG  45   1.265 -11.764  14.828
  360    H    GLY  46           HN       GLY  46   1.781  -3.200  11.114
  361   1HA   GLY  46          HA2       GLY  46   3.830  -1.956  10.362
  362   2HA   GLY  46          HA1       GLY  46   4.763  -3.088  11.340
  363    H    LYS  47           HN       LYS  47   2.189  -4.706   9.856
  364    HA   LYS  47           HA       LYS  47   4.041  -6.022   7.981
  365   1HB   LYS  47          HB2       LYS  47   2.373  -7.149   9.538
  366   2HB   LYS  47          HB1       LYS  47   1.097  -6.515   8.499
  367   1HG   LYS  47          HG2       LYS  47   1.536  -8.719   7.698
  368   2HG   LYS  47          HG1       LYS  47   2.323  -7.633   6.552
  369   1HD   LYS  47          HD2       LYS  47   4.475  -7.965   7.672
  370   2HD   LYS  47          HD1       LYS  47   3.707  -8.992   8.883
  371   1HE   LYS  47          HE2       LYS  47   3.211 -10.694   7.264
  372   2HE   LYS  47          HE1       LYS  47   3.624  -9.617   5.914
  373   1HZ   LYS  47          HZ1       LYS  47   5.437 -10.732   7.975
  374   2HZ   LYS  47          HZ2       LYS  47   5.870  -9.401   7.013
  375   3HZ   LYS  47          HZ3       LYS  47   5.541 -10.905   6.292
  376    H    LYS  48           HN       LYS  48   4.264  -5.128   5.955
  377    HA   LYS  48           HA       LYS  48   2.158  -3.383   4.849
  378   1HB   LYS  48          HB2       LYS  48   4.741  -4.332   3.582
  379   2HB   LYS  48          HB1       LYS  48   3.827  -2.878   3.188
  380   1HG   LYS  48          HG2       LYS  48   5.189  -3.413   5.846
  381   2HG   LYS  48          HG1       LYS  48   5.819  -2.363   4.576
  382   1HD   LYS  48          HD2       LYS  48   3.957  -0.856   4.787
  383   2HD   LYS  48          HD1       LYS  48   3.100  -1.974   5.848
  384   1HE   LYS  48          HE2       LYS  48   4.544  -1.554   7.664
  385   2HE   LYS  48          HE1       LYS  48   5.825  -0.916   6.615
  386   1HZ   LYS  48          HZ1       LYS  48   3.235   0.332   7.314
  387   2HZ   LYS  48          HZ2       LYS  48   4.104   0.809   5.935
  388   3HZ   LYS  48          HZ3       LYS  48   4.794   0.980   7.479
  389    H    VAL  49           HN       VAL  49   0.930  -3.879   2.991
  390    HA   VAL  49           HA       VAL  49   1.138  -6.705   1.995
  391    HB   VAL  49           HB       VAL  49  -1.277  -4.974   2.615
  392   1HG1  VAL  49          HG1       VAL  49  -2.157  -7.553   2.072
  393   2HG1  VAL  49          HG1       VAL  49  -0.948  -7.263   0.822
  394   3HG1  VAL  49          HG1       VAL  49  -2.316  -6.165   0.997
  395   1HG2  VAL  49          HG2       VAL  49  -0.599  -5.908   4.645
  396   2HG2  VAL  49          HG2       VAL  49   0.048  -7.357   3.876
  397   3HG2  VAL  49          HG2       VAL  49  -1.697  -7.151   4.043
  398    H    CYS  50           HN       CYS  50   1.910  -6.522  -0.095
  399    HA   CYS  50           HA       CYS  50   1.593  -4.165  -1.737
  400   1HB   CYS  50          HB2       CYS  50   2.405  -7.043  -2.227
  401   2HB   CYS  50          HB1       CYS  50   2.437  -5.826  -3.498
  402    H    THR  51           HN       THR  51   0.338  -4.078  -3.761
  403    HA   THR  51           HA       THR  51  -1.790  -6.058  -4.216
  404    HB   THR  51           HB       THR  51  -3.460  -4.023  -3.946
  405    HG1  THR  51           HG1      THR  51  -1.477  -3.351  -2.050
  406   1HG2  THR  51          HG2       THR  51  -2.376  -5.148  -1.377
  407   2HG2  THR  51          HG2       THR  51  -3.146  -6.211  -2.555
  408   3HG2  THR  51          HG2       THR  51  -4.053  -4.876  -1.847
  409    H    HIS  52           HN       HIS  52  -3.111  -5.387  -6.171
  410    HA   HIS  52           HA       HIS  52  -1.386  -3.903  -8.074
  411   1HB   HIS  52          HB2       HIS  52  -2.768  -6.282  -8.172
  412   2HB   HIS  52          HB1       HIS  52  -3.862  -5.187  -9.018
  413    HD1  HIS  52           HD1      HIS  52  -3.370  -6.008 -11.393
  414    HD2  HIS  52           HD2      HIS  52   0.064  -4.852  -9.330
  415    HE1  HIS  52           HE1      HIS  52  -1.495  -5.955 -13.095
  416    HA   PRO  53           HA       PRO  53  -4.149  -0.445  -7.894
  417   1HB   PRO  53          HB2       PRO  53  -3.405   0.806 -10.210
  418   2HB   PRO  53          HB1       PRO  53  -2.415   0.831  -8.738
  419   1HG   PRO  53          HG2       PRO  53  -2.116  -0.822 -11.190
  420   2HG   PRO  53          HG1       PRO  53  -0.875  -0.080 -10.169
  421   1HD   PRO  53          HD2       PRO  53  -1.543  -2.731 -10.070
  422   2HD   PRO  53          HD1       PRO  53  -0.852  -1.831  -8.702
  423    H    ARG  54           HN       ARG  54  -3.962  -2.556 -10.709
  424    HA   ARG  54           HA       ARG  54  -6.208  -1.572 -12.177
  425   1HB   ARG  54          HB2       ARG  54  -4.366  -3.258 -12.800
  426   2HB   ARG  54          HB1       ARG  54  -5.334  -4.459 -11.943
  427   1HG   ARG  54          HG2       ARG  54  -6.179  -4.692 -14.095
  428   2HG   ARG  54          HG1       ARG  54  -7.288  -3.487 -13.440
  429   1HD   ARG  54          HD2       ARG  54  -6.498  -2.744 -15.644
  430   2HD   ARG  54          HD1       ARG  54  -5.800  -1.690 -14.398
  431    HE   ARG  54           HE       ARG  54  -4.086  -3.957 -14.828
  432   1HH1  ARG  54          HH2       ARG  54  -4.827  -2.895 -17.620
  433   2HH1  ARG  54          HH2       ARG  54  -3.514  -1.803 -17.904
  434   1HH2  ARG  54          HH1       ARG  54  -2.510  -1.725 -14.587
  435   2HH2  ARG  54          HH1       ARG  54  -2.202  -1.140 -16.188
  436    H    LYS  55           HN       LYS  55  -5.972  -3.809  -9.430
  437    HA   LYS  55           HA       LYS  55  -8.704  -4.733  -9.532
  438   1HB   LYS  55          HB2       LYS  55  -6.349  -4.845  -7.760
  439   2HB   LYS  55          HB1       LYS  55  -7.895  -4.950  -6.916
  440   1HG   LYS  55          HG2       LYS  55  -7.467  -7.191  -7.446
  441   2HG   LYS  55          HG1       LYS  55  -8.515  -6.678  -8.770
  442   1HD   LYS  55          HD2       LYS  55  -6.784  -7.702  -9.942
  443   2HD   LYS  55          HD1       LYS  55  -6.237  -6.026  -9.926
  444   1HE   LYS  55          HE2       LYS  55  -4.324  -7.240  -9.215
  445   2HE   LYS  55          HE1       LYS  55  -5.044  -6.693  -7.688
  446   1HZ   LYS  55          HZ1       LYS  55  -6.293  -8.777  -7.594
  447   2HZ   LYS  55          HZ2       LYS  55  -4.618  -9.064  -7.602
  448   3HZ   LYS  55          HZ3       LYS  55  -5.532  -9.309  -9.013
  449    H    LYS  56           HN       LYS  56 -10.494  -3.553  -9.066
  450    HA   LYS  56           HA       LYS  56 -10.517  -0.851  -8.230
  451   1HB   LYS  56          HB2       LYS  56 -12.293  -2.333  -9.358
  452   2HB   LYS  56          HB1       LYS  56 -12.711  -2.867  -7.729
  453   1HG   LYS  56          HG2       LYS  56 -14.144  -1.069  -7.895
  454   2HG   LYS  56          HG1       LYS  56 -12.718  -0.233  -7.278
  455   1HD   LYS  56          HD2       LYS  56 -13.389   1.064  -9.142
  456   2HD   LYS  56          HD1       LYS  56 -12.057   0.082  -9.751
  457   1HE   LYS  56          HE2       LYS  56 -13.414  -0.907 -11.273
  458   2HE   LYS  56          HE1       LYS  56 -14.584  -1.338 -10.010
  459   1HZ   LYS  56          HZ1       LYS  56 -14.301   1.439 -10.989
  460   2HZ   LYS  56          HZ2       LYS  56 -15.591   0.753 -10.120
  461   3HZ   LYS  56          HZ3       LYS  56 -15.343   0.337 -11.749
  462    H    TRP  57           HN       TRP  57 -10.995  -3.818  -6.278
  463    HA   TRP  57           HA       TRP  57 -11.667  -2.648  -3.821
  464   1HB   TRP  57          HB2       TRP  57 -11.428  -4.812  -3.113
  465   2HB   TRP  57          HB1       TRP  57 -11.147  -5.150  -4.815
  466    HD1  TRP  57           HD1      TRP  57  -8.786  -5.972  -5.514
  467    HE1  TRP  57           HE1      TRP  57  -6.613  -6.490  -4.225
  468    HE3  TRP  57           HE3      TRP  57  -9.979  -4.014  -0.952
  469    HZ2  TRP  57           HZ2      TRP  57  -5.527  -6.118  -1.603
  470    HZ3  TRP  57           HZ3      TRP  57  -8.360  -4.109   0.920
  471    HH2  TRP  57           HH2      TRP  57  -6.138  -5.158   0.602
  472    H    VAL  58           HN       VAL  58  -8.467  -2.952  -5.321
  473    HA   VAL  58           HA       VAL  58  -6.916  -2.090  -3.056
  474    HB   VAL  58           HB       VAL  58  -6.455  -1.895  -6.046
  475   1HG1  VAL  58          HG1       VAL  58  -4.113  -1.672  -5.531
  476   2HG1  VAL  58          HG1       VAL  58  -4.411  -1.943  -3.814
  477   3HG1  VAL  58          HG1       VAL  58  -4.970  -0.457  -4.581
  478   1HG2  VAL  58          HG2       VAL  58  -4.979  -3.971  -5.367
  479   2HG2  VAL  58          HG2       VAL  58  -6.709  -4.179  -5.629
  480   3HG2  VAL  58          HG2       VAL  58  -6.078  -4.052  -3.990
  481    H    GLN  59           HN       GLN  59  -8.112  -0.298  -5.927
  482    HA   GLN  59           HA       GLN  59  -7.154   2.272  -5.160
  483   1HB   GLN  59          HB2       GLN  59  -9.673   1.513  -6.687
  484   2HB   GLN  59          HB1       GLN  59  -8.809   3.046  -6.802
  485   1HG   GLN  59          HG2       GLN  59  -6.758   1.593  -7.461
  486   2HG   GLN  59          HG1       GLN  59  -7.946   0.327  -7.772
  487   1HE2  GLN  59          HE2       GLN  59  -7.851   0.345 -10.085
  488   2HE2  GLN  59          HE2       GLN  59  -8.294   1.694 -11.015
  489    H    LYS  60           HN       LYS  60  -9.946   0.384  -4.197
  490    HA   LYS  60           HA       LYS  60 -11.405   2.520  -2.918
  491   1HB   LYS  60          HB2       LYS  60 -12.009   0.059  -3.728
  492   2HB   LYS  60          HB1       LYS  60 -11.576  -0.347  -2.067
  493   1HG   LYS  60          HG2       LYS  60 -13.133   1.690  -1.469
  494   2HG   LYS  60          HG1       LYS  60 -13.811   1.387  -3.069
  495   1HD   LYS  60          HD2       LYS  60 -13.433  -0.888  -1.139
  496   2HD   LYS  60          HD1       LYS  60 -14.850   0.154  -1.012
  497   1HE   LYS  60          HE2       LYS  60 -14.110  -0.984  -3.698
  498   2HE   LYS  60          HE1       LYS  60 -14.986  -1.992  -2.529
  499   1HZ   LYS  60          HZ1       LYS  60 -16.500  -0.666  -3.918
  500   2HZ   LYS  60          HZ2       LYS  60 -15.777   0.758  -3.336
  501   3HZ   LYS  60          HZ3       LYS  60 -16.627  -0.262  -2.276
  502    H    TYR  61           HN       TYR  61  -8.855   0.288  -1.902
  503    HA   TYR  61           HA       TYR  61  -9.102   0.990   0.935
  504   1HB   TYR  61          HB2       TYR  61  -7.569  -0.817  -0.817
  505   2HB   TYR  61          HB1       TYR  61  -6.657  -0.216   0.567
  506    HD1  TYR  61           HD1      TYR  61 -10.061  -1.577  -0.243
  507    HD2  TYR  61           HD2      TYR  61  -6.839  -1.349   2.589
  508    HE1  TYR  61           HE1      TYR  61 -11.253  -3.167   1.242
  509    HE2  TYR  61           HE2      TYR  61  -8.031  -2.938   4.073
  510    HH   TYR  61           HH       TYR  61 -10.930  -4.604   3.029
  511    H    ILE  62           HN       ILE  62  -6.970   1.852  -1.772
  512    HA   ILE  62           HA       ILE  62  -5.047   3.379  -0.341
  513    HB   ILE  62           HB       ILE  62  -6.235   3.753  -3.113
  514   1HG1  ILE  62          HG1       ILE  62  -3.722   2.300  -2.237
  515   2HG1  ILE  62          HG1       ILE  62  -5.252   1.494  -2.587
  516   1HG2  ILE  62          HG2       ILE  62  -3.427   4.480  -2.646
  517   2HG2  ILE  62          HG2       ILE  62  -4.566   5.487  -1.754
  518   3HG2  ILE  62          HG2       ILE  62  -4.685   5.364  -3.509
  519   1HD1  ILE  62          HD1       ILE  62  -3.648   3.193  -4.522
  520   2HD1  ILE  62          HD1       ILE  62  -5.209   2.453  -4.878
  521   3HD1  ILE  62          HD1       ILE  62  -3.802   1.437  -4.566
  522    H    SER  63           HN       SER  63  -8.202   4.317  -1.722
  523    HA   SER  63           HA       SER  63  -8.004   7.099  -0.954
  524   1HB   SER  63          HB2       SER  63  -9.745   5.341  -2.370
  525   2HB   SER  63          HB1       SER  63 -10.710   6.158  -1.144
  526    HG   SER  63           HG       SER  63 -10.581   7.880  -2.325
  527    H    LEU  64           HN       LEU  64  -9.728   4.298   0.469
  528    HA   LEU  64           HA       LEU  64 -10.805   5.705   2.716
  529   1HB   LEU  64          HB2       LEU  64 -10.381   2.932   1.791
  530   2HB   LEU  64          HB1       LEU  64 -10.494   3.108   3.543
  531    HG   LEU  64           HG       LEU  64 -12.526   4.751   2.632
  532   1HD1  LEU  64          HD1       LEU  64 -12.492   2.216   0.966
  533   2HD1  LEU  64          HD1       LEU  64 -12.213   3.841   0.343
  534   3HD1  LEU  64          HD1       LEU  64 -13.788   3.412   1.009
  535   1HD2  LEU  64          HD2       LEU  64 -12.899   1.816   3.255
  536   2HD2  LEU  64          HD2       LEU  64 -13.967   3.159   3.659
  537   3HD2  LEU  64          HD2       LEU  64 -12.425   2.977   4.494
  538    H    LEU  65           HN       LEU  65  -7.712   4.000   2.237
  539    HA   LEU  65           HA       LEU  65  -6.867   4.363   5.011
  540   1HB   LEU  65          HB2       LEU  65  -5.662   3.406   2.423
  541   2HB   LEU  65          HB1       LEU  65  -4.627   3.677   3.820
  542    HG   LEU  65           HG       LEU  65  -7.017   1.815   3.686
  543   1HD1  LEU  65          HD1       LEU  65  -4.754   0.433   4.531
  544   2HD1  LEU  65          HD1       LEU  65  -4.133   1.515   3.285
  545   3HD1  LEU  65          HD1       LEU  65  -5.438   0.391   2.907
  546   1HD2  LEU  65          HD2       LEU  65  -5.593   1.318   6.027
  547   2HD2  LEU  65          HD2       LEU  65  -7.142   2.154   5.922
  548   3HD2  LEU  65          HD2       LEU  65  -5.639   3.076   5.937
  549    H    LYS  66           HN       LYS  66  -7.587   6.901   4.248
  550    HA   LYS  66           HA       LYS  66  -6.766   9.110   4.008
  551   1HB   LYS  66          HB2       LYS  66  -5.514   7.967   5.989
  552   2HB   LYS  66          HB1       LYS  66  -4.136   7.923   4.888
  553   1HG   LYS  66          HG2       LYS  66  -3.697  10.073   5.372
  554   2HG   LYS  66          HG1       LYS  66  -5.271  10.528   4.717
  555   1HD   LYS  66          HD2       LYS  66  -5.957   9.481   7.165
  556   2HD   LYS  66          HD1       LYS  66  -4.415  10.260   7.520
  557   1HE   LYS  66          HE2       LYS  66  -5.286  12.351   7.256
  558   2HE   LYS  66          HE1       LYS  66  -6.224  11.872   5.826
  559   1HZ   LYS  66          HZ1       LYS  66  -6.908  10.887   8.528
  560   2HZ   LYS  66          HZ2       LYS  66  -7.879  10.913   7.136
  561   3HZ   LYS  66          HZ3       LYS  66  -7.521  12.359   7.952
  562    H    THR  67           HN       THR  67  -6.800   9.254   1.678
  563    HA   THR  67           HA       THR  67  -4.658   8.201   0.031
  564    HB   THR  67           HB       THR  67  -6.251  10.442  -1.008
  565    HG1  THR  67           HG1      THR  67  -8.121   9.833  -0.327
  566   1HG2  THR  67          HG2       THR  67  -5.351   9.086  -2.658
  567   2HG2  THR  67          HG2       THR  67  -6.961   8.382  -2.503
  568   3HG2  THR  67          HG2       THR  67  -5.582   7.613  -1.715
  569    HA   PRO  68           HA       PRO  68  -3.170  12.717  -0.028
  570   1HB   PRO  68          HB2       PRO  68  -4.296  14.523   1.684
  571   2HB   PRO  68          HB1       PRO  68  -4.944  14.198   0.065
  572   1HG   PRO  68          HG2       PRO  68  -5.930  13.309   2.708
  573   2HG   PRO  68          HG1       PRO  68  -6.825  13.669   1.226
  574   1HD   PRO  68          HD2       PRO  68  -6.204  11.130   2.171
  575   2HD   PRO  68          HD1       PRO  68  -6.709  11.524   0.515
  576    H    LYS  69           HN       LYS  69  -1.738  11.065   1.260
  577    HA   LYS  69           HA       LYS  69  -1.473  11.181   4.092
  578   1HB   LYS  69          HB2       LYS  69  -0.320   9.861   1.958
  579   2HB   LYS  69          HB1       LYS  69   1.007  10.871   2.533
  580   1HG   LYS  69          HG2       LYS  69   0.063   9.961   4.902
  581   2HG   LYS  69          HG1       LYS  69  -0.351   8.594   3.867
  582   1HD   LYS  69          HD2       LYS  69   2.100   8.863   2.979
  583   2HD   LYS  69          HD1       LYS  69   2.358   9.740   4.488
  584   1HE   LYS  69          HE2       LYS  69   2.671   7.711   5.465
  585   2HE   LYS  69          HE1       LYS  69   0.929   7.444   5.247
  586   1HZ   LYS  69          HZ1       LYS  69   1.946   5.703   4.079
  587   2HZ   LYS  69          HZ2       LYS  69   3.138   6.715   3.414
  588   3HZ   LYS  69          HZ3       LYS  69   1.531   6.824   2.877
  589    H    GLN  70           HN       GLN  70   0.801  12.061   4.997
  590    HA   GLN  70           HA       GLN  70   0.940  14.948   4.205
  591   1HB   GLN  70          HB2       GLN  70   1.399  13.419   6.777
  592   2HB   GLN  70          HB1       GLN  70   1.854  15.114   6.593
  593   1HG   GLN  70          HG2       GLN  70  -0.654  15.281   5.669
  594   2HG   GLN  70          HG1       GLN  70  -0.859  13.883   6.725
  595   1HE2  GLN  70          HE2       GLN  70   1.072  16.924   7.028
  596   2HE2  GLN  70          HE2       GLN  70   0.456  17.332   8.556
  597    H    LEU  71           HN       LEU  71   2.747  11.990   4.471
  598    HA   LEU  71           HA       LEU  71   5.315  13.475   4.062
  599   1HB   LEU  71          HB2       LEU  71   4.439  11.013   5.453
  600   2HB   LEU  71          HB1       LEU  71   5.969  10.870   4.586
  601    HG   LEU  71           HG       LEU  71   6.334  11.625   6.909
  602   1HD1  LEU  71          HD1       LEU  71   7.156  13.029   4.508
  603   2HD1  LEU  71          HD1       LEU  71   8.095  12.654   5.953
  604   3HD1  LEU  71          HD1       LEU  71   7.122  14.124   5.891
  605   1HD2  LEU  71          HD2       LEU  71   5.398  13.640   7.756
  606   2HD2  LEU  71          HD2       LEU  71   4.052  12.826   6.956
  607   3HD2  LEU  71          HD2       LEU  71   4.876  14.164   6.156
  Start of MODEL    7
    1   1H    THR   1          HT1       THR   1  13.563   5.537  12.402
    2   2H    THR   1          HT2       THR   1  14.608   6.871  12.519
    3   3H    THR   1          HT3       THR   1  14.165   6.011  13.915
    4    HA   THR   1           HA       THR   1  15.890   5.046  11.694
    5    HB   THR   1           HB       THR   1  16.300   5.590  14.654
    6    HG1  THR   1           HG1      THR   1  16.424   7.522  13.785
    7   1HG2  THR   1          HG2       THR   1  18.468   5.032  12.647
    8   2HG2  THR   1          HG2       THR   1  17.626   3.696  13.431
    9   3HG2  THR   1          HG2       THR   1  18.514   4.871  14.402
   10    H    ARG   2           HN       ARG   2  15.696   2.871  11.358
   11    HA   ARG   2           HA       ARG   2  15.135   0.605  11.737
   12   1HB   ARG   2          HB2       ARG   2  16.697   1.683  13.867
   13   2HB   ARG   2          HB1       ARG   2  15.513   0.590  14.584
   14   1HG   ARG   2          HG2       ARG   2  16.311  -1.262  13.416
   15   2HG   ARG   2          HG1       ARG   2  17.012  -0.277  12.133
   16   1HD   ARG   2          HD2       ARG   2  18.884  -1.043  13.410
   17   2HD   ARG   2          HD1       ARG   2  18.616   0.622  13.966
   18    HE   ARG   2           HE       ARG   2  17.217  -1.561  15.418
   19   1HH1  ARG   2          HH2       ARG   2  20.241  -1.382  15.890
   20   2HH1  ARG   2          HH2       ARG   2  20.292  -0.377  17.300
   21   1HH2  ARG   2          HH1       ARG   2  17.013   0.703  16.972
   22   2HH2  ARG   2          HH1       ARG   2  18.463   0.803  17.913
   23    H    GLY   3           HN       GLY   3  12.806   1.515  11.358
   24   1HA   GLY   3          HA2       GLY   3  11.106   0.472  13.504
   25   2HA   GLY   3          HA1       GLY   3  10.920   2.204  13.218
   26    H    SER   4           HN       SER   4  10.684   2.728  10.749
   27    HA   SER   4           HA       SER   4   9.145   0.612   9.321
   28   1HB   SER   4          HB2       SER   4   7.296   2.252   9.007
   29   2HB   SER   4          HB1       SER   4   7.559   1.878  10.708
   30    HG   SER   4           HG       SER   4   7.372   4.181  10.067
   31    H    ASP   5           HN       ASP   5  10.821   0.618   7.712
   32    HA   ASP   5           HA       ASP   5  10.802   3.025   5.961
   33   1HB   ASP   5          HB2       ASP   5  13.015   1.828   7.515
   34   2HB   ASP   5          HB1       ASP   5  13.408   2.199   5.836
   35    H    ILE   6           HN       ILE   6   9.607   0.263   5.812
   36    HA   ILE   6           HA       ILE   6  11.169  -0.954   3.583
   37    HB   ILE   6           HB       ILE   6   8.668  -1.939   4.995
   38   1HG1  ILE   6          HG1       ILE   6  10.950  -3.361   5.881
   39   2HG1  ILE   6          HG1       ILE   6  11.362  -1.650   6.003
   40   1HG2  ILE   6          HG2       ILE   6   9.599  -4.163   4.258
   41   2HG2  ILE   6          HG2       ILE   6  10.818  -3.284   3.335
   42   3HG2  ILE   6          HG2       ILE   6   9.111  -3.116   2.926
   43   1HD1  ILE   6          HD1       ILE   6   9.225  -3.191   7.414
   44   2HD1  ILE   6          HD1       ILE   6   8.911  -1.499   7.032
   45   3HD1  ILE   6          HD1       ILE   6  10.295  -1.934   8.034
   46    H    SER   7           HN       SER   7   9.776   1.565   3.120
   47    HA   SER   7           HA       SER   7   7.458   0.725   1.447
   48   1HB   SER   7          HB2       SER   7   7.346   2.515   3.278
   49   2HB   SER   7          HB1       SER   7   8.325   3.517   2.212
   50    HG   SER   7           HG       SER   7   6.704   3.338   0.648
   51    H    LYS   8           HN       LYS   8  10.675   1.030   0.977
   52    HA   LYS   8           HA       LYS   8  10.409   2.463  -1.625
   53   1HB   LYS   8          HB2       LYS   8  12.400   2.290   0.524
   54   2HB   LYS   8          HB1       LYS   8  13.103   2.093  -1.082
   55   1HG   LYS   8          HG2       LYS   8  12.960   4.312  -1.407
   56   2HG   LYS   8          HG1       LYS   8  11.206   4.214  -1.237
   57   1HD   LYS   8          HD2       LYS   8  11.783   4.118   1.344
   58   2HD   LYS   8          HD1       LYS   8  13.273   4.903   0.820
   59   1HE   LYS   8          HE2       LYS   8  11.460   6.388  -0.558
   60   2HE   LYS   8          HE1       LYS   8  10.506   5.974   0.880
   61   1HZ   LYS   8          HZ1       LYS   8  12.183   6.787   2.298
   62   2HZ   LYS   8          HZ2       LYS   8  11.992   7.981   1.104
   63   3HZ   LYS   8          HZ3       LYS   8  13.312   6.914   1.039
   64    H    THR   9           HN       THR   9   9.592  -0.326  -1.225
   65    HA   THR   9           HA       THR   9  11.634  -1.696  -2.943
   66    HB   THR   9           HB       THR   9  11.418  -2.512  -0.584
   67    HG1  THR   9           HG1      THR   9  11.943  -4.284  -1.543
   68   1HG2  THR   9          HG2       THR   9   9.361  -3.628   0.112
   69   2HG2  THR   9          HG2       THR   9   8.614  -3.273  -1.445
   70   3HG2  THR   9          HG2       THR   9   9.003  -1.959  -0.334
   71    H    CYS  10           HN       CYS  10  10.606  -3.447  -4.334
   72    HA   CYS  10           HA       CYS  10   8.230  -2.373  -5.683
   73   1HB   CYS  10          HB2       CYS  10   9.861  -4.895  -6.139
   74   2HB   CYS  10          HB1       CYS  10   8.761  -4.145  -7.291
   75    H    CYS  11           HN       CYS  11   7.103  -4.887  -6.503
   76    HA   CYS  11           HA       CYS  11   6.086  -6.041  -3.933
   77   1HB   CYS  11          HB2       CYS  11   4.654  -4.660  -6.173
   78   2HB   CYS  11          HB1       CYS  11   3.833  -5.990  -5.358
   79    H    PHE  12           HN       PHE  12   6.004  -8.269  -4.023
   80    HA   PHE  12           HA       PHE  12   5.908  -9.578  -6.701
   81   1HB   PHE  12          HB2       PHE  12   8.074  -9.444  -4.791
   82   2HB   PHE  12          HB1       PHE  12   7.561 -11.118  -5.002
   83    HD1  PHE  12           HD1      PHE  12   7.981 -12.304  -7.032
   84    HD2  PHE  12           HD2      PHE  12   8.711  -8.077  -6.805
   85    HE1  PHE  12           HE1      PHE  12   9.148 -12.388  -9.219
   86    HE2  PHE  12           HE2      PHE  12   9.878  -8.161  -8.991
   87    HZ   PHE  12           HZ       PHE  12  10.097 -10.316 -10.198
   88    H    GLN  13           HN       GLN  13   3.909  -9.174  -4.471
   89    HA   GLN  13           HA       GLN  13   2.869 -11.893  -4.410
   90   1HB   GLN  13          HB2       GLN  13   3.071 -12.113  -1.925
   91   2HB   GLN  13          HB1       GLN  13   4.640 -12.067  -2.730
   92   1HG   GLN  13          HG2       GLN  13   4.162  -9.397  -2.289
   93   2HG   GLN  13          HG1       GLN  13   3.434 -10.135  -0.863
   94   1HE2  GLN  13          HE2       GLN  13   6.338 -11.113  -2.765
   95   2HE2  GLN  13          HE2       GLN  13   7.400 -11.069  -1.441
   96    H    TYR  14           HN       TYR  14   0.856 -11.063  -5.039
   97    HA   TYR  14           HA       TYR  14  -0.313  -8.762  -3.616
   98   1HB   TYR  14          HB2       TYR  14  -1.395 -10.585  -5.790
   99   2HB   TYR  14          HB1       TYR  14  -2.067  -9.024  -5.316
  100    HD1  TYR  14           HD1      TYR  14  -0.983  -6.938  -5.937
  101    HD2  TYR  14           HD2      TYR  14   0.764 -10.726  -6.966
  102    HE1  TYR  14           HE1      TYR  14   0.578  -5.797  -7.490
  103    HE2  TYR  14           HE2      TYR  14   2.324  -9.583  -8.518
  104    HH   TYR  14           HH       TYR  14   2.082  -7.088  -9.859
  105    H    SER  15           HN       SER  15  -2.036  -8.918  -2.160
  106    HA   SER  15           HA       SER  15  -2.510 -11.545  -0.937
  107   1HB   SER  15          HB2       SER  15  -3.807 -10.114   0.660
  108   2HB   SER  15          HB1       SER  15  -2.160  -9.542   0.412
  109    HG   SER  15           HG       SER  15  -3.654  -7.837   0.246
  110    H    HIS  16           HN       HIS  16  -4.379  -9.116  -2.753
  111    HA   HIS  16           HA       HIS  16  -6.470  -9.283  -3.834
  112   1HB   HIS  16          HB2       HIS  16  -5.000 -11.330  -4.631
  113   2HB   HIS  16          HB1       HIS  16  -6.166 -12.268  -3.696
  114    HD1  HIS  16           HD1      HIS  16  -6.588  -9.271  -6.032
  115    HD2  HIS  16           HD2      HIS  16  -8.100 -13.114  -5.469
  116    HE1  HIS  16           HE1      HIS  16  -8.396  -9.590  -7.775
  117    H    LYS  17           HN       LYS  17  -6.787  -8.879  -1.152
  118    HA   LYS  17           HA       LYS  17  -9.326 -10.212  -0.610
  119   1HB   LYS  17          HB2       LYS  17  -8.566 -11.380   1.403
  120   2HB   LYS  17          HB1       LYS  17  -7.601 -11.907   0.025
  121   1HG   LYS  17          HG2       LYS  17  -5.851 -10.239   0.672
  122   2HG   LYS  17          HG1       LYS  17  -6.797  -9.859   2.112
  123   1HD   LYS  17          HD2       LYS  17  -5.934 -12.681   1.465
  124   2HD   LYS  17          HD1       LYS  17  -4.922 -11.587   2.407
  125   1HE   LYS  17          HE2       LYS  17  -6.441 -11.512   4.197
  126   2HE   LYS  17          HE1       LYS  17  -7.809 -12.008   3.180
  127   1HZ   LYS  17          HZ1       LYS  17  -5.448 -13.746   3.585
  128   2HZ   LYS  17          HZ2       LYS  17  -6.983 -14.174   2.997
  129   3HZ   LYS  17          HZ3       LYS  17  -6.775 -13.793   4.640
  130    HA   PRO  18           HA       PRO  18  -9.829  -6.450   1.623
  131   1HB   PRO  18          HB2       PRO  18 -11.823  -7.150   3.359
  132   2HB   PRO  18          HB1       PRO  18 -12.101  -6.875   1.627
  133   1HG   PRO  18          HG2       PRO  18 -11.809  -9.435   3.115
  134   2HG   PRO  18          HG1       PRO  18 -12.894  -9.023   1.779
  135   1HD   PRO  18          HD2       PRO  18 -10.604 -10.468   1.462
  136   2HD   PRO  18          HD1       PRO  18 -11.308  -9.452   0.184
  137    H    LEU  19           HN       LEU  19  -8.115  -5.960   2.967
  138    HA   LEU  19           HA       LEU  19  -7.210  -7.638   5.141
  139   1HB   LEU  19          HB2       LEU  19  -5.956  -5.892   3.745
  140   2HB   LEU  19          HB1       LEU  19  -6.764  -4.668   4.722
  141    HG   LEU  19           HG       LEU  19  -5.839  -5.849   6.771
  142   1HD1  LEU  19          HD1       LEU  19  -3.948  -7.361   6.436
  143   2HD1  LEU  19          HD1       LEU  19  -4.094  -7.197   4.686
  144   3HD1  LEU  19          HD1       LEU  19  -5.363  -8.005   5.605
  145   1HD2  LEU  19          HD2       LEU  19  -3.426  -5.092   5.262
  146   2HD2  LEU  19          HD2       LEU  19  -4.114  -4.372   6.718
  147   3HD2  LEU  19          HD2       LEU  19  -4.741  -3.923   5.132
  148    HA   PRO  20           HA       PRO  20 -10.201  -6.415   8.170
  149   1HB   PRO  20          HB2       PRO  20  -8.754  -6.959  10.441
  150   2HB   PRO  20          HB1       PRO  20  -9.520  -8.216   9.448
  151   1HG   PRO  20          HG2       PRO  20  -6.682  -7.297   9.471
  152   2HG   PRO  20          HG1       PRO  20  -7.329  -8.942   9.383
  153   1HD   PRO  20          HD2       PRO  20  -6.416  -7.648   7.208
  154   2HD   PRO  20          HD1       PRO  20  -7.780  -8.787   7.124
  155    H    TRP  21           HN       TRP  21 -10.521  -4.225   8.271
  156    HA   TRP  21           HA       TRP  21  -8.685  -2.143   8.398
  157   1HB   TRP  21          HB2       TRP  21 -11.442  -2.430   9.620
  158   2HB   TRP  21          HB1       TRP  21 -10.618  -0.883   9.410
  159    HD1  TRP  21           HD1      TRP  21 -12.413  -3.610   7.503
  160    HE1  TRP  21           HE1      TRP  21 -12.727  -2.871   5.052
  161    HE3  TRP  21           HE3      TRP  21  -9.538   0.610   7.479
  162    HZ2  TRP  21           HZ2      TRP  21 -11.866  -0.769   3.313
  163    HZ3  TRP  21           HZ3      TRP  21  -9.304   1.960   5.414
  164    HH2  TRP  21           HH2      TRP  21 -10.464   1.276   3.332
  165    H    THR  22           HN       THR  22  -9.930  -4.068  11.101
  166    HA   THR  22           HA       THR  22  -9.018  -2.531  13.287
  167    HB   THR  22           HB       THR  22  -8.686  -5.011  14.197
  168    HG1  THR  22           HG1      THR  22  -8.651  -6.022  12.216
  169   1HG2  THR  22          HG2       THR  22 -11.481  -4.787  13.485
  170   2HG2  THR  22          HG2       THR  22 -10.837  -3.212  13.949
  171   3HG2  THR  22          HG2       THR  22 -10.718  -4.577  15.061
  172    H    TRP  23           HN       TRP  23  -7.243  -4.533  11.020
  173    HA   TRP  23           HA       TRP  23  -4.717  -4.088  12.547
  174   1HB   TRP  23          HB2       TRP  23  -5.862  -6.193  10.791
  175   2HB   TRP  23          HB1       TRP  23  -4.131  -5.915  10.631
  176    HD1  TRP  23           HD1      TRP  23  -5.923  -5.477  13.975
  177    HE1  TRP  23           HE1      TRP  23  -5.059  -7.271  15.614
  178    HE3  TRP  23           HE3      TRP  23  -3.085  -8.277  10.790
  179    HZ2  TRP  23           HZ2      TRP  23  -3.383  -9.592  15.574
  180    HZ3  TRP  23           HZ3      TRP  23  -1.867 -10.272  11.612
  181    HH2  TRP  23           HH2      TRP  23  -2.013 -10.934  13.997
  182    H    VAL  24           HN       VAL  24  -6.455  -2.852   9.926
  183    HA   VAL  24           HA       VAL  24  -4.127  -2.381   8.183
  184    HB   VAL  24           HB       VAL  24  -6.972  -1.342   8.060
  185   1HG1  VAL  24          HG1       VAL  24  -5.203  -1.813   5.690
  186   2HG1  VAL  24          HG1       VAL  24  -4.943  -0.362   6.657
  187   3HG1  VAL  24          HG1       VAL  24  -6.509  -0.646   5.895
  188   1HG2  VAL  24          HG2       VAL  24  -6.016  -3.998   7.831
  189   2HG2  VAL  24          HG2       VAL  24  -6.337  -3.447   6.187
  190   3HG2  VAL  24          HG2       VAL  24  -7.617  -3.400   7.396
  191    H    ARG  25           HN       ARG  25  -3.052  -0.394   8.000
  192    HA   ARG  25           HA       ARG  25  -3.926   1.761   9.899
  193   1HB   ARG  25          HB2       ARG  25  -1.829   0.328  10.379
  194   2HB   ARG  25          HB1       ARG  25  -1.091   1.191   9.029
  195   1HG   ARG  25          HG2       ARG  25  -1.728   3.352  10.179
  196   2HG   ARG  25          HG1       ARG  25  -2.201   2.391  11.580
  197   1HD   ARG  25          HD2       ARG  25   0.194   1.366  11.410
  198   2HD   ARG  25          HD1       ARG  25   0.556   2.797  10.424
  199    HE   ARG  25           HE       ARG  25  -0.865   3.364  12.935
  200   1HH1  ARG  25          HH1       ARG  25   0.874   5.361  11.561
  201   2HH1  ARG  25          HH1       ARG  25   2.303   5.344  12.541
  202   1HH2  ARG  25          HH2       ARG  25   1.525   2.340  14.089
  203   2HH2  ARG  25          HH2       ARG  25   2.671   3.633  13.971
  204    H    SER  26           HN       SER  26  -2.346   1.052   6.770
  205    HA   SER  26           HA       SER  26  -3.534   3.359   5.504
  206   1HB   SER  26          HB2       SER  26  -1.758   4.896   5.539
  207   2HB   SER  26          HB1       SER  26  -1.705   4.224   7.163
  208    HG   SER  26           HG       SER  26   0.233   3.594   6.697
  209    H    TYR  27           HN       TYR  27  -1.377   3.862   3.649
  210    HA   TYR  27           HA       TYR  27  -0.720   1.203   2.515
  211   1HB   TYR  27          HB2       TYR  27  -2.001   1.535   0.539
  212   2HB   TYR  27          HB1       TYR  27  -3.066   2.065   1.836
  213    HD1  TYR  27           HD1      TYR  27  -3.077   4.590   2.418
  214    HD2  TYR  27           HD2      TYR  27  -1.440   2.993  -1.216
  215    HE1  TYR  27           HE1      TYR  27  -3.219   6.832   1.367
  216    HE2  TYR  27           HE2      TYR  27  -1.585   5.231  -2.268
  217    HH   TYR  27           HH       TYR  27  -2.743   7.303  -2.027
  218    H    GLU  28           HN       GLU  28   0.188   1.945   0.050
  219    HA   GLU  28           HA       GLU  28   1.687   4.388  -0.088
  220   1HB   GLU  28          HB2       GLU  28   3.935   3.386   0.418
  221   2HB   GLU  28          HB1       GLU  28   2.871   3.416   1.824
  222   1HG   GLU  28          HG2       GLU  28   2.174   1.019   1.023
  223   2HG   GLU  28          HG1       GLU  28   3.694   1.072   0.131
  224    H    PHE  29           HN       PHE  29   2.370   4.599  -2.210
  225    HA   PHE  29           HA       PHE  29   1.901   2.360  -4.054
  226   1HB   PHE  29          HB2       PHE  29   2.055   5.236  -4.076
  227   2HB   PHE  29          HB1       PHE  29   3.126   4.592  -5.321
  228    HD1  PHE  29           HD1      PHE  29   2.230   3.046  -7.070
  229    HD2  PHE  29           HD2      PHE  29  -0.329   5.045  -4.258
  230    HE1  PHE  29           HE1      PHE  29   0.267   2.544  -8.500
  231    HE2  PHE  29           HE2      PHE  29  -2.293   4.543  -5.689
  232    HZ   PHE  29           HZ       PHE  29  -1.994   3.292  -7.809
  233    H    THR  30           HN       THR  30   3.508   1.228  -5.183
  234    HA   THR  30           HA       THR  30   6.048   0.779  -4.068
  235    HB   THR  30           HB       THR  30   6.476   0.114  -6.618
  236    HG1  THR  30           HG1      THR  30   4.840   1.098  -7.621
  237   1HG2  THR  30          HG2       THR  30   4.448  -1.118  -4.742
  238   2HG2  THR  30          HG2       THR  30   6.149  -1.548  -4.918
  239   3HG2  THR  30          HG2       THR  30   5.008  -1.912  -6.213
  240    H    SER  31           HN       SER  31   8.200   1.465  -4.849
  241    HA   SER  31           HA       SER  31   8.450   4.303  -5.202
  242   1HB   SER  31          HB2       SER  31  10.868   3.565  -5.717
  243   2HB   SER  31          HB1       SER  31  10.207   3.088  -4.156
  244    HG   SER  31           HG       SER  31  11.275   1.476  -5.750
  245    H    ASN  32           HN       ASN  32   9.536   5.336  -7.119
  246    HA   ASN  32           HA       ASN  32   8.199   4.588  -9.598
  247   1HB   ASN  32          HB2       ASN  32   9.375   6.601 -10.424
  248   2HB   ASN  32          HB1       ASN  32   8.618   6.911  -8.861
  249   1HD2  ASN  32          HD2       ASN  32  11.243   7.928 -10.296
  250   2HD2  ASN  32          HD2       ASN  32  12.405   7.807  -9.065
  251    H    SER  33           HN       SER  33  10.989   3.401  -8.124
  252    HA   SER  33           HA       SER  33  12.333   2.859 -10.730
  253   1HB   SER  33          HB2       SER  33  13.252   3.841  -8.325
  254   2HB   SER  33          HB1       SER  33  13.665   2.133  -8.206
  255    HG   SER  33           HG       SER  33  15.209   2.513  -9.565
  256    H    CYS  34           HN       CYS  34   9.976   1.363 -10.033
  257    HA   CYS  34           HA       CYS  34  11.163  -1.324  -9.405
  258   1HB   CYS  34          HB2       CYS  34   8.675   0.123  -8.598
  259   2HB   CYS  34          HB1       CYS  34   8.572  -1.626  -8.793
  260    H    SER  35           HN       SER  35  10.510  -3.052 -10.757
  261    HA   SER  35           HA       SER  35   9.512  -2.292 -13.414
  262   1HB   SER  35          HB2       SER  35  11.157  -4.263 -12.256
  263   2HB   SER  35          HB1       SER  35   9.762  -5.135 -12.885
  264    HG   SER  35           HG       SER  35  11.700  -4.529 -14.312
  265    H    GLN  36           HN       GLN  36   8.200  -3.597 -10.471
  266    HA   GLN  36           HA       GLN  36   5.677  -4.349 -11.909
  267   1HB   GLN  36          HB2       GLN  36   7.318  -5.522  -9.770
  268   2HB   GLN  36          HB1       GLN  36   5.600  -5.458  -9.372
  269   1HG   GLN  36          HG2       GLN  36   5.685  -7.478 -10.512
  270   2HG   GLN  36          HG1       GLN  36   5.328  -6.377 -11.843
  271   1HE2  GLN  36          HE2       GLN  36   7.553  -8.743 -10.756
  272   2HE2  GLN  36          HE2       GLN  36   8.784  -8.439 -11.884
  273    H    ARG  37           HN       ARG  37   4.814  -2.169 -11.806
  274    HA   ARG  37           HA       ARG  37   4.690  -0.577  -9.424
  275   1HB   ARG  37          HB2       ARG  37   4.162  -0.231 -12.045
  276   2HB   ARG  37          HB1       ARG  37   2.514  -0.474 -11.462
  277   1HG   ARG  37          HG2       ARG  37   2.530   1.452 -10.187
  278   2HG   ARG  37          HG1       ARG  37   4.275   1.390  -9.926
  279   1HD   ARG  37          HD2       ARG  37   4.703   2.143 -12.201
  280   2HD   ARG  37          HD1       ARG  37   2.974   2.052 -12.594
  281    HE   ARG  37           HE       ARG  37   4.233   4.215 -11.161
  282   1HH1  ARG  37          HH2       ARG  37   1.336   3.095 -12.342
  283   2HH1  ARG  37          HH2       ARG  37   0.333   3.877 -11.165
  284   1HH2  ARG  37          HH1       ARG  37   2.988   4.843  -9.154
  285   2HH2  ARG  37          HH1       ARG  37   1.269   4.866  -9.361
  286    H    ALA  38           HN       ALA  38   3.328  -0.755  -7.662
  287    HA   ALA  38           HA       ALA  38   0.699  -2.016  -7.863
  288   1HB   ALA  38          HB1       ALA  38   1.587  -3.738  -6.040
  289   2HB   ALA  38          HB2       ALA  38   3.132  -3.422  -6.831
  290   3HB   ALA  38          HB3       ALA  38   1.781  -4.071  -7.761
  291    H    VAL  39           HN       VAL  39  -0.593  -1.392  -6.109
  292    HA   VAL  39           HA       VAL  39   0.528   0.591  -4.255
  293    HB   VAL  39           HB       VAL  39  -2.226  -0.680  -4.432
  294   1HG1  VAL  39          HG1       VAL  39  -2.229   2.040  -3.555
  295   2HG1  VAL  39          HG1       VAL  39  -1.043   1.164  -2.589
  296   3HG1  VAL  39          HG1       VAL  39  -2.715   0.606  -2.650
  297   1HG2  VAL  39          HG2       VAL  39  -2.114   1.987  -5.463
  298   2HG2  VAL  39          HG2       VAL  39  -2.526   0.506  -6.325
  299   3HG2  VAL  39          HG2       VAL  39  -0.849   1.045  -6.252
  300    H    ILE  40           HN       ILE  40   0.612   0.307  -1.947
  301    HA   ILE  40           HA       ILE  40   0.397  -2.540  -1.039
  302    HB   ILE  40           HB       ILE  40   2.449  -0.397  -0.426
  303   1HG1  ILE  40          HG1       ILE  40   3.290  -3.020  -1.439
  304   2HG1  ILE  40          HG1       ILE  40   2.274  -2.126  -2.569
  305   1HG2  ILE  40          HG2       ILE  40   1.587  -2.526   1.207
  306   2HG2  ILE  40          HG2       ILE  40   3.045  -1.554   1.408
  307   3HG2  ILE  40          HG2       ILE  40   3.107  -3.057   0.488
  308   1HD1  ILE  40          HD1       ILE  40   3.812  -0.430  -2.827
  309   2HD1  ILE  40          HD1       ILE  40   4.922  -1.753  -2.464
  310   3HD1  ILE  40          HD1       ILE  40   4.453  -0.621  -1.194
  311    H    PHE  41           HN       PHE  41  -0.741  -2.836   0.833
  312    HA   PHE  41           HA       PHE  41  -1.724  -0.412   2.285
  313   1HB   PHE  41          HB2       PHE  41  -2.752  -3.267   2.076
  314   2HB   PHE  41          HB1       PHE  41  -3.547  -1.972   2.974
  315    HD1  PHE  41           HD1      PHE  41  -3.792   0.302   1.516
  316    HD2  PHE  41           HD2      PHE  41  -3.551  -3.682  -0.068
  317    HE1  PHE  41           HE1      PHE  41  -4.905   1.064  -0.565
  318    HE2  PHE  41           HE2      PHE  41  -4.665  -2.921  -2.150
  319    HZ   PHE  41           HZ       PHE  41  -5.341  -0.548  -2.398
  320    H    THR  42           HN       THR  42  -0.743  -0.108   4.272
  321    HA   THR  42           HA       THR  42   0.780  -2.365   5.435
  322    HB   THR  42           HB       THR  42   1.900  -0.221   5.228
  323    HG1  THR  42           HG1      THR  42   1.938  -1.534   7.317
  324   1HG2  THR  42          HG2       THR  42   0.518   1.413   7.078
  325   2HG2  THR  42          HG2       THR  42  -0.685   0.763   5.968
  326   3HG2  THR  42          HG2       THR  42   0.695   1.658   5.342
  327    H    THR  43           HN       THR  43   0.559  -2.869   7.730
  328    HA   THR  43           HA       THR  43  -2.273  -2.632   8.631
  329    HB   THR  43           HB       THR  43  -1.602  -4.628  10.020
  330    HG1  THR  43           HG1      THR  43   0.505  -4.625  10.255
  331   1HG2  THR  43          HG2       THR  43  -0.772  -5.352   7.270
  332   2HG2  THR  43          HG2       THR  43  -2.314  -4.510   7.405
  333   3HG2  THR  43          HG2       THR  43  -2.057  -6.023   8.273
  334    H    LYS  44           HN       LYS  44  -1.982  -3.206  11.310
  335    HA   LYS  44           HA       LYS  44  -1.001  -0.649  12.373
  336   1HB   LYS  44          HB2       LYS  44  -2.914  -2.694  13.000
  337   2HB   LYS  44          HB1       LYS  44  -1.869  -2.448  14.400
  338   1HG   LYS  44          HG2       LYS  44  -2.651  -0.340  14.776
  339   2HG   LYS  44          HG1       LYS  44  -2.756   0.032  13.054
  340   1HD   LYS  44          HD2       LYS  44  -4.771  -1.522  12.965
  341   2HD   LYS  44          HD1       LYS  44  -4.730  -1.533  14.729
  342   1HE   LYS  44          HE2       LYS  44  -5.168   0.811  14.859
  343   2HE   LYS  44          HE1       LYS  44  -4.828   1.042  13.132
  344   1HZ   LYS  44          HZ1       LYS  44  -7.170   0.894  13.335
  345   2HZ   LYS  44          HZ2       LYS  44  -7.075  -0.464  14.350
  346   3HZ   LYS  44          HZ3       LYS  44  -6.657  -0.596  12.709
  347    H    ARG  45           HN       ARG  45   0.052  -3.999  12.293
  348    HA   ARG  45           HA       ARG  45   1.967  -3.711  14.490
  349   1HB   ARG  45          HB2       ARG  45   0.684  -5.790  13.570
  350   2HB   ARG  45          HB1       ARG  45   1.973  -5.850  12.366
  351   1HG   ARG  45          HG2       ARG  45   3.167  -5.436  14.935
  352   2HG   ARG  45          HG1       ARG  45   2.046  -6.792  15.058
  353   1HD   ARG  45          HD2       ARG  45   3.237  -7.392  12.689
  354   2HD   ARG  45          HD1       ARG  45   4.577  -6.581  13.524
  355    HE   ARG  45           HE       ARG  45   3.304  -8.335  15.375
  356   1HH1  ARG  45          HH1       ARG  45   3.265 -10.238  13.135
  357   2HH1  ARG  45          HH1       ARG  45   4.847 -10.942  13.187
  358   1HH2  ARG  45          HH2       ARG  45   6.184  -8.446  15.186
  359   2HH2  ARG  45          HH2       ARG  45   6.498  -9.931  14.353
  360    H    GLY  46           HN       GLY  46   1.970  -3.014  11.098
  361   1HA   GLY  46          HA2       GLY  46   3.860  -1.584  10.315
  362   2HA   GLY  46          HA1       GLY  46   4.935  -2.644  11.224
  363    H    LYS  47           HN       LYS  47   2.555  -4.551   9.826
  364    HA   LYS  47           HA       LYS  47   4.445  -5.614   7.860
  365   1HB   LYS  47          HB2       LYS  47   1.785  -6.281   9.037
  366   2HB   LYS  47          HB1       LYS  47   2.152  -6.969   7.454
  367   1HG   LYS  47          HG2       LYS  47   4.504  -7.329   8.914
  368   2HG   LYS  47          HG1       LYS  47   3.221  -7.691  10.068
  369   1HD   LYS  47          HD2       LYS  47   2.622  -9.589   8.980
  370   2HD   LYS  47          HD1       LYS  47   2.759  -8.827   7.395
  371   1HE   LYS  47          HE2       LYS  47   5.095  -9.242   7.269
  372   2HE   LYS  47          HE1       LYS  47   5.210  -9.569   9.010
  373   1HZ   LYS  47          HZ1       LYS  47   4.053 -11.560   8.796
  374   2HZ   LYS  47          HZ2       LYS  47   5.069 -11.567   7.434
  375   3HZ   LYS  47          HZ3       LYS  47   3.427 -11.160   7.272
  376    H    LYS  48           HN       LYS  48   4.245  -5.412   5.596
  377    HA   LYS  48           HA       LYS  48   2.189  -3.439   4.659
  378   1HB   LYS  48          HB2       LYS  48   4.849  -4.170   3.398
  379   2HB   LYS  48          HB1       LYS  48   3.830  -2.787   3.007
  380   1HG   LYS  48          HG2       LYS  48   5.104  -3.235   5.719
  381   2HG   LYS  48          HG1       LYS  48   5.792  -2.205   4.464
  382   1HD   LYS  48          HD2       LYS  48   3.652  -0.897   4.448
  383   2HD   LYS  48          HD1       LYS  48   3.110  -1.858   5.824
  384   1HE   LYS  48          HE2       LYS  48   4.072   0.150   6.748
  385   2HE   LYS  48          HE1       LYS  48   5.279  -1.127   6.998
  386   1HZ   LYS  48          HZ1       LYS  48   6.520  -0.431   5.178
  387   2HZ   LYS  48          HZ2       LYS  48   6.049   1.038   5.891
  388   3HZ   LYS  48          HZ3       LYS  48   5.242   0.464   4.510
  389    H    VAL  49           HN       VAL  49   0.814  -4.092   3.024
  390    HA   VAL  49           HA       VAL  49   1.273  -6.832   1.878
  391    HB   VAL  49           HB       VAL  49  -1.295  -5.279   2.340
  392   1HG1  VAL  49          HG1       VAL  49  -2.448  -7.212   1.645
  393   2HG1  VAL  49          HG1       VAL  49  -1.028  -8.240   1.839
  394   3HG1  VAL  49          HG1       VAL  49  -1.118  -7.105   0.492
  395   1HG2  VAL  49          HG2       VAL  49  -1.233  -6.023   4.467
  396   2HG2  VAL  49          HG2       VAL  49   0.390  -6.648   4.175
  397   3HG2  VAL  49          HG2       VAL  49  -1.015  -7.680   3.905
  398    H    CYS  50           HN       CYS  50   1.748  -6.803  -0.284
  399    HA   CYS  50           HA       CYS  50   1.476  -4.379  -1.888
  400   1HB   CYS  50          HB2       CYS  50   2.428  -7.211  -2.222
  401   2HB   CYS  50          HB1       CYS  50   2.179  -6.222  -3.660
  402    H    THR  51           HN       THR  51   0.120  -4.206  -3.815
  403    HA   THR  51           HA       THR  51  -1.953  -6.239  -4.316
  404    HB   THR  51           HB       THR  51  -3.684  -4.280  -3.886
  405    HG1  THR  51           HG1      THR  51  -2.586  -2.615  -3.199
  406   1HG2  THR  51          HG2       THR  51  -4.187  -5.267  -1.823
  407   2HG2  THR  51          HG2       THR  51  -2.489  -5.518  -1.420
  408   3HG2  THR  51          HG2       THR  51  -3.266  -6.533  -2.635
  409    H    HIS  52           HN       HIS  52  -3.121  -5.774  -6.307
  410    HA   HIS  52           HA       HIS  52  -1.599  -4.252  -8.254
  411   1HB   HIS  52          HB2       HIS  52  -3.853  -6.106  -8.104
  412   2HB   HIS  52          HB1       HIS  52  -4.108  -4.853  -9.320
  413    HD1  HIS  52           HD1      HIS  52  -1.086  -4.489 -10.116
  414    HD2  HIS  52           HD2      HIS  52  -3.052  -8.154  -9.853
  415    HE1  HIS  52           HE1      HIS  52   0.206  -6.099 -11.579
  416    HA   PRO  53           HA       PRO  53  -3.788  -0.450  -7.603
  417   1HB   PRO  53          HB2       PRO  53  -2.741   0.953  -9.700
  418   2HB   PRO  53          HB1       PRO  53  -1.823   0.593  -8.225
  419   1HG   PRO  53          HG2       PRO  53  -1.601  -0.589 -10.910
  420   2HG   PRO  53          HG1       PRO  53  -0.391  -0.453  -9.628
  421   1HD   PRO  53          HD2       PRO  53  -1.890  -2.746 -10.322
  422   2HD   PRO  53          HD1       PRO  53  -0.827  -2.548  -8.915
  423    H    ARG  54           HN       ARG  54  -4.350  -2.587 -10.160
  424    HA   ARG  54           HA       ARG  54  -6.185  -0.818 -11.659
  425   1HB   ARG  54          HB2       ARG  54  -4.571  -2.755 -12.460
  426   2HB   ARG  54          HB1       ARG  54  -5.933  -3.788 -12.024
  427   1HG   ARG  54          HG2       ARG  54  -7.084  -3.174 -13.862
  428   2HG   ARG  54          HG1       ARG  54  -6.824  -1.462 -13.521
  429   1HD   ARG  54          HD2       ARG  54  -5.309  -1.365 -15.199
  430   2HD   ARG  54          HD1       ARG  54  -4.332  -2.607 -14.389
  431    HE   ARG  54           HE       ARG  54  -6.647  -3.280 -16.170
  432   1HH1  ARG  54          HH1       ARG  54  -3.895  -3.324 -17.367
  433   2HH1  ARG  54          HH1       ARG  54  -3.444  -4.984 -17.170
  434   1HH2  ARG  54          HH2       ARG  54  -5.904  -5.654 -14.822
  435   2HH2  ARG  54          HH2       ARG  54  -4.580  -6.302 -15.730
  436    H    LYS  55           HN       LYS  55  -6.344  -3.609  -9.449
  437    HA   LYS  55           HA       LYS  55  -9.089  -4.226  -9.611
  438   1HB   LYS  55          HB2       LYS  55  -6.834  -4.706  -7.911
  439   2HB   LYS  55          HB1       LYS  55  -8.222  -4.333  -6.888
  440   1HG   LYS  55          HG2       LYS  55  -8.794  -6.508  -7.184
  441   2HG   LYS  55          HG1       LYS  55  -9.319  -6.004  -8.791
  442   1HD   LYS  55          HD2       LYS  55  -6.563  -7.041  -8.066
  443   2HD   LYS  55          HD1       LYS  55  -7.801  -7.928  -8.957
  444   1HE   LYS  55          HE2       LYS  55  -7.689  -5.681 -10.472
  445   2HE   LYS  55          HE1       LYS  55  -6.014  -5.741  -9.887
  446   1HZ   LYS  55          HZ1       LYS  55  -6.033  -7.139 -11.748
  447   2HZ   LYS  55          HZ2       LYS  55  -7.528  -7.833 -11.334
  448   3HZ   LYS  55          HZ3       LYS  55  -6.137  -8.203 -10.433
  449    H    LYS  56           HN       LYS  56 -10.866  -2.995  -9.187
  450    HA   LYS  56           HA       LYS  56 -10.852  -0.303  -8.372
  451   1HB   LYS  56          HB2       LYS  56 -12.707  -1.471  -9.485
  452   2HB   LYS  56          HB1       LYS  56 -12.967  -2.457  -8.047
  453   1HG   LYS  56          HG2       LYS  56 -14.546  -0.802  -7.687
  454   2HG   LYS  56          HG1       LYS  56 -13.160  -0.082  -6.869
  455   1HD   LYS  56          HD2       LYS  56 -12.687   1.354  -8.698
  456   2HD   LYS  56          HD1       LYS  56 -13.718   0.431  -9.792
  457   1HE   LYS  56          HE2       LYS  56 -15.038   1.570  -7.370
  458   2HE   LYS  56          HE1       LYS  56 -14.572   2.711  -8.648
  459   1HZ   LYS  56          HZ1       LYS  56 -15.908   0.154  -9.289
  460   2HZ   LYS  56          HZ2       LYS  56 -15.796   1.560 -10.236
  461   3HZ   LYS  56          HZ3       LYS  56 -16.816   1.527  -8.878
  462    H    TRP  57           HN       TRP  57 -11.371  -3.221  -6.353
  463    HA   TRP  57           HA       TRP  57 -11.946  -1.934  -3.918
  464   1HB   TRP  57          HB2       TRP  57 -11.787  -4.076  -3.097
  465   2HB   TRP  57          HB1       TRP  57 -11.712  -4.480  -4.806
  466    HD1  TRP  57           HD1      TRP  57  -9.447  -5.385  -5.759
  467    HE1  TRP  57           HE1      TRP  57  -7.248  -6.154  -4.651
  468    HE3  TRP  57           HE3      TRP  57 -10.171  -3.590  -1.039
  469    HZ2  TRP  57           HZ2      TRP  57  -5.967  -6.014  -2.095
  470    HZ3  TRP  57           HZ3      TRP  57  -8.450  -3.921   0.713
  471    HH2  TRP  57           HH2      TRP  57  -6.350  -5.132   0.192
  472    H    VAL  58           HN       VAL  58  -8.803  -2.440  -5.493
  473    HA   VAL  58           HA       VAL  58  -7.127  -1.696  -3.286
  474    HB   VAL  58           HB       VAL  58  -6.726  -1.271  -6.266
  475   1HG1  VAL  58          HG1       VAL  58  -4.436  -1.113  -5.819
  476   2HG1  VAL  58          HG1       VAL  58  -4.586  -1.910  -4.254
  477   3HG1  VAL  58          HG1       VAL  58  -5.134  -0.246  -4.452
  478   1HG2  VAL  58          HG2       VAL  58  -5.556  -3.626  -4.909
  479   2HG2  VAL  58          HG2       VAL  58  -6.298  -3.499  -6.501
  480   3HG2  VAL  58          HG2       VAL  58  -7.311  -3.657  -5.070
  481    H    GLN  59           HN       GLN  59  -8.229   0.278  -6.083
  482    HA   GLN  59           HA       GLN  59  -7.250   2.776  -5.159
  483   1HB   GLN  59          HB2       GLN  59  -9.729   2.087  -6.778
  484   2HB   GLN  59          HB1       GLN  59  -8.956   3.672  -6.728
  485   1HG   GLN  59          HG2       GLN  59  -6.807   2.228  -7.391
  486   2HG   GLN  59          HG1       GLN  59  -8.044   1.160  -8.057
  487   1HE2  GLN  59          HE2       GLN  59  -9.950   3.236  -8.780
  488   2HE2  GLN  59          HE2       GLN  59  -9.282   4.114 -10.070
  489    H    LYS  60           HN       LYS  60 -10.027   0.868  -4.247
  490    HA   LYS  60           HA       LYS  60 -11.469   2.981  -2.894
  491   1HB   LYS  60          HB2       LYS  60 -11.749   0.222  -3.595
  492   2HB   LYS  60          HB1       LYS  60 -12.046   0.373  -1.862
  493   1HG   LYS  60          HG2       LYS  60 -13.312   2.285  -3.817
  494   2HG   LYS  60          HG1       LYS  60 -14.052   0.721  -3.473
  495   1HD   LYS  60          HD2       LYS  60 -14.987   1.648  -1.645
  496   2HD   LYS  60          HD1       LYS  60 -13.367   1.790  -0.961
  497   1HE   LYS  60          HE2       LYS  60 -13.098   4.017  -1.873
  498   2HE   LYS  60          HE1       LYS  60 -14.607   3.869  -2.797
  499   1HZ   LYS  60          HZ1       LYS  60 -14.977   5.034  -0.700
  500   2HZ   LYS  60          HZ2       LYS  60 -14.369   3.703   0.162
  501   3HZ   LYS  60          HZ3       LYS  60 -15.809   3.557  -0.727
  502    H    TYR  61           HN       TYR  61  -9.073   0.531  -1.943
  503    HA   TYR  61           HA       TYR  61  -9.252   1.184   0.903
  504   1HB   TYR  61          HB2       TYR  61  -7.903  -0.699  -0.894
  505   2HB   TYR  61          HB1       TYR  61  -6.868  -0.164   0.432
  506    HD1  TYR  61           HD1      TYR  61  -6.961  -1.431   2.381
  507    HD2  TYR  61           HD2      TYR  61 -10.467  -1.121  -0.081
  508    HE1  TYR  61           HE1      TYR  61  -8.191  -2.910   3.946
  509    HE2  TYR  61           HE2      TYR  61 -11.697  -2.600   1.482
  510    HH   TYR  61           HH       TYR  61 -10.452  -3.436   4.582
  511    H    ILE  62           HN       ILE  62  -7.250   2.150  -1.837
  512    HA   ILE  62           HA       ILE  62  -5.148   3.451  -0.387
  513    HB   ILE  62           HB       ILE  62  -6.410   4.032  -3.092
  514   1HG1  ILE  62          HG1       ILE  62  -3.887   2.466  -2.589
  515   2HG1  ILE  62          HG1       ILE  62  -5.458   1.671  -2.495
  516   1HG2  ILE  62          HG2       ILE  62  -4.432   5.459  -1.666
  517   2HG2  ILE  62          HG2       ILE  62  -4.853   5.636  -3.369
  518   3HG2  ILE  62          HG2       ILE  62  -3.572   4.526  -2.890
  519   1HD1  ILE  62          HD1       ILE  62  -3.975   2.175  -4.824
  520   2HD1  ILE  62          HD1       ILE  62  -5.290   3.350  -4.856
  521   3HD1  ILE  62          HD1       ILE  62  -5.650   1.627  -4.740
  522    H    SER  63           HN       SER  63  -8.132   4.789  -1.861
  523    HA   SER  63           HA       SER  63  -7.840   7.443  -0.831
  524   1HB   SER  63          HB2       SER  63  -9.924   5.710  -2.040
  525   2HB   SER  63          HB1       SER  63 -10.529   7.071  -1.100
  526    HG   SER  63           HG       SER  63  -8.689   7.130  -3.264
  527    H    LEU  64           HN       LEU  64  -9.537   4.567   0.430
  528    HA   LEU  64           HA       LEU  64 -10.654   5.796   2.763
  529   1HB   LEU  64          HB2       LEU  64 -10.045   3.077   1.723
  530   2HB   LEU  64          HB1       LEU  64 -10.278   3.202   3.466
  531    HG   LEU  64           HG       LEU  64 -12.229   4.470   1.548
  532   1HD1  LEU  64          HD1       LEU  64 -11.831   1.924   1.172
  533   2HD1  LEU  64          HD1       LEU  64 -13.488   2.485   1.395
  534   3HD1  LEU  64          HD1       LEU  64 -12.627   1.727   2.734
  535   1HD2  LEU  64          HD2       LEU  64 -11.953   4.632   4.261
  536   2HD2  LEU  64          HD2       LEU  64 -13.050   3.257   4.122
  537   3HD2  LEU  64          HD2       LEU  64 -13.493   4.814   3.420
  538    H    LEU  65           HN       LEU  65  -7.599   3.994   2.269
  539    HA   LEU  65           HA       LEU  65  -6.688   4.438   5.001
  540   1HB   LEU  65          HB2       LEU  65  -5.501   3.409   2.417
  541   2HB   LEU  65          HB1       LEU  65  -4.504   3.600   3.854
  542    HG   LEU  65           HG       LEU  65  -6.963   1.848   3.560
  543   1HD1  LEU  65          HD1       LEU  65  -5.405   0.329   2.946
  544   2HD1  LEU  65          HD1       LEU  65  -4.781   0.418   4.593
  545   3HD1  LEU  65          HD1       LEU  65  -4.091   1.437   3.333
  546   1HD2  LEU  65          HD2       LEU  65  -7.254   2.168   5.782
  547   2HD2  LEU  65          HD2       LEU  65  -5.729   3.043   5.927
  548   3HD2  LEU  65          HD2       LEU  65  -5.745   1.283   6.000
  549    H    LYS  66           HN       LYS  66  -7.323   6.948   4.329
  550    HA   LYS  66           HA       LYS  66  -6.488   9.139   4.003
  551   1HB   LYS  66          HB2       LYS  66  -3.952   7.684   4.828
  552   2HB   LYS  66          HB1       LYS  66  -4.251   9.415   4.986
  553   1HG   LYS  66          HG2       LYS  66  -5.314   9.098   6.943
  554   2HG   LYS  66          HG1       LYS  66  -6.420   7.949   6.193
  555   1HD   LYS  66          HD2       LYS  66  -4.511   6.238   6.380
  556   2HD   LYS  66          HD1       LYS  66  -3.738   7.392   7.466
  557   1HE   LYS  66          HE2       LYS  66  -4.980   6.473   9.132
  558   2HE   LYS  66          HE1       LYS  66  -6.396   7.227   8.375
  559   1HZ   LYS  66          HZ1       LYS  66  -6.600   5.320   6.913
  560   2HZ   LYS  66          HZ2       LYS  66  -6.658   4.815   8.535
  561   3HZ   LYS  66          HZ3       LYS  66  -5.241   4.593   7.623
  562    H    THR  67           HN       THR  67  -4.229  10.198   2.971
  563    HA   THR  67           HA       THR  67  -3.407   8.718   0.552
  564    HB   THR  67           HB       THR  67  -4.737  11.424   0.360
  565    HG1  THR  67           HG1      THR  67  -6.467  10.315   0.821
  566   1HG2  THR  67          HG2       THR  67  -3.569   9.444  -1.507
  567   2HG2  THR  67          HG2       THR  67  -3.709  11.195  -1.665
  568   3HG2  THR  67          HG2       THR  67  -5.096  10.164  -2.018
  569    HA   PRO  68           HA       PRO  68  -0.531  12.027   2.367
  570   1HB   PRO  68          HB2       PRO  68   1.226  10.424   3.715
  571   2HB   PRO  68          HB1       PRO  68  -0.223  11.116   4.473
  572   1HG   PRO  68          HG2       PRO  68   0.241   8.367   3.439
  573   2HG   PRO  68          HG1       PRO  68  -0.657   8.901   4.867
  574   1HD   PRO  68          HD2       PRO  68  -1.832   8.149   2.513
  575   2HD   PRO  68          HD1       PRO  68  -2.571   9.263   3.684
  576    H    LYS  69           HN       LYS  69   0.019  12.079   0.050
  577    HA   LYS  69           HA       LYS  69   1.938  10.070  -0.954
  578   1HB   LYS  69          HB2       LYS  69  -0.054  11.824  -1.988
  579   2HB   LYS  69          HB1       LYS  69   1.485  12.297  -2.711
  580   1HG   LYS  69          HG2       LYS  69   0.599   9.411  -2.587
  581   2HG   LYS  69          HG1       LYS  69   0.163  10.466  -3.932
  582   1HD   LYS  69          HD2       LYS  69   2.363  10.671  -4.663
  583   2HD   LYS  69          HD1       LYS  69   3.032  10.311  -3.070
  584   1HE   LYS  69          HE2       LYS  69   1.440   8.090  -4.136
  585   2HE   LYS  69          HE1       LYS  69   2.840   8.490  -5.153
  586   1HZ   LYS  69          HZ1       LYS  69   4.297   8.299  -3.352
  587   2HZ   LYS  69          HZ2       LYS  69   3.259   6.964  -3.177
  588   3HZ   LYS  69          HZ3       LYS  69   3.047   8.342  -2.205
  589    H    GLN  70           HN       GLN  70   1.849  13.479   0.006
  590    HA   GLN  70           HA       GLN  70   4.729  13.521   0.456
  591   1HB   GLN  70          HB2       GLN  70   4.306  13.674  -2.087
  592   2HB   GLN  70          HB1       GLN  70   3.669  15.285  -1.757
  593   1HG   GLN  70          HG2       GLN  70   6.063  15.390  -2.350
  594   2HG   GLN  70          HG1       GLN  70   5.801  15.912  -0.686
  595   1HE2  GLN  70          HE2       GLN  70   7.394  15.067   0.655
  596   2HE2  GLN  70          HE2       GLN  70   8.075  13.519   0.511
  597    H    LEU  71           HN       LEU  71   5.305  15.351   1.708
  598    HA   LEU  71           HA       LEU  71   3.136  17.356   2.221
  599   1HB   LEU  71          HB2       LEU  71   3.766  15.300   3.883
  600   2HB   LEU  71          HB1       LEU  71   4.900  16.521   4.462
  601    HG   LEU  71           HG       LEU  71   2.121  17.445   3.969
  602   1HD1  LEU  71          HD1       LEU  71   1.285  16.540   6.072
  603   2HD1  LEU  71          HD1       LEU  71   2.833  15.754   6.386
  604   3HD1  LEU  71          HD1       LEU  71   1.821  15.208   5.047
  605   1HD2  LEU  71          HD2       LEU  71   3.893  18.927   4.843
  606   2HD2  LEU  71          HD2       LEU  71   4.130  17.842   6.212
  607   3HD2  LEU  71          HD2       LEU  71   2.610  18.718   6.035
  Start of MODEL    8
    1   1H    THR   1          HT1       THR   1   5.382 -18.193  -2.302
    2   2H    THR   1          HT2       THR   1   6.532 -17.375  -3.249
    3   3H    THR   1          HT3       THR   1   6.074 -16.752  -1.736
    4    HA   THR   1           HA       THR   1   7.339 -19.420  -1.980
    5    HB   THR   1           HB       THR   1   8.739 -16.776  -1.517
    6    HG1  THR   1           HG1      THR   1   8.640 -18.283  -3.911
    7   1HG2  THR   1          HG2       THR   1   9.532 -19.366  -1.035
    8   2HG2  THR   1          HG2       THR   1  10.626 -18.012  -1.317
    9   3HG2  THR   1          HG2       THR   1  10.176 -19.073  -2.650
   10    H    ARG   2           HN       ARG   2   5.649 -19.616  -0.154
   11    HA   ARG   2           HA       ARG   2   5.158 -19.661   2.158
   12   1HB   ARG   2          HB2       ARG   2   8.148 -19.406   1.915
   13   2HB   ARG   2          HB1       ARG   2   7.394 -19.463   3.508
   14   1HG   ARG   2          HG2       ARG   2   6.111 -21.530   2.333
   15   2HG   ARG   2          HG1       ARG   2   7.640 -21.595   1.454
   16   1HD   ARG   2          HD2       ARG   2   8.046 -22.954   3.354
   17   2HD   ARG   2          HD1       ARG   2   8.727 -21.388   3.834
   18    HE   ARG   2           HE       ARG   2   6.259 -21.014   4.737
   19   1HH1  ARG   2          HH2       ARG   2   8.064 -22.020   6.793
   20   2HH1  ARG   2          HH2       ARG   2   7.331 -23.508   7.290
   21   1HH2  ARG   2          HH1       ARG   2   5.321 -23.761   4.474
   22   2HH2  ARG   2          HH1       ARG   2   5.775 -24.494   5.975
   23    H    GLY   3           HN       GLY   3   5.762 -18.257   4.301
   24   1HA   GLY   3          HA2       GLY   3   4.930 -15.539   3.660
   25   2HA   GLY   3          HA1       GLY   3   5.245 -16.171   5.278
   26    H    SER   4           HN       SER   4   6.960 -15.168   2.310
   27    HA   SER   4           HA       SER   4   9.438 -14.703   3.862
   28   1HB   SER   4          HB2       SER   4   9.540 -15.754   1.658
   29   2HB   SER   4          HB1       SER   4   8.668 -14.401   0.942
   30    HG   SER   4           HG       SER   4  10.638 -13.696   0.626
   31    H    ASP   5           HN       ASP   5  10.494 -12.564   3.777
   32    HA   ASP   5           HA       ASP   5   8.687 -10.383   4.349
   33   1HB   ASP   5          HB2       ASP   5  11.628 -10.868   4.097
   34   2HB   ASP   5          HB1       ASP   5  11.073  -9.194   4.082
   35    H    ILE   6           HN       ILE   6   7.403 -10.111   2.409
   36    HA   ILE   6           HA       ILE   6   8.903  -9.130   0.006
   37    HB   ILE   6           HB       ILE   6   6.061 -10.140   0.317
   38   1HG1  ILE   6          HG1       ILE   6   7.720 -11.901   0.804
   39   2HG1  ILE   6          HG1       ILE   6   6.923 -12.211  -0.738
   40   1HG2  ILE   6          HG2       ILE   6   6.913 -10.480  -2.310
   41   2HG2  ILE   6          HG2       ILE   6   7.573  -8.907  -1.862
   42   3HG2  ILE   6          HG2       ILE   6   5.839  -9.206  -1.730
   43   1HD1  ILE   6          HD1       ILE   6   9.036 -12.410  -1.550
   44   2HD1  ILE   6          HD1       ILE   6   9.742 -11.553  -0.181
   45   3HD1  ILE   6          HD1       ILE   6   9.037 -10.647  -1.520
   46    H    SER   7           HN       SER   7   8.384  -7.445   2.334
   47    HA   SER   7           HA       SER   7   6.262  -5.620   1.308
   48   1HB   SER   7          HB2       SER   7   7.595  -5.443   3.994
   49   2HB   SER   7          HB1       SER   7   5.952  -4.993   3.543
   50    HG   SER   7           HG       SER   7   6.155  -6.998   4.742
   51    H    LYS   8           HN       LYS   8   9.082  -5.825   0.277
   52    HA   LYS   8           HA       LYS   8  10.678  -3.652   1.250
   53   1HB   LYS   8          HB2       LYS   8  10.478  -4.920  -1.503
   54   2HB   LYS   8          HB1       LYS   8  11.846  -3.980  -0.906
   55   1HG   LYS   8          HG2       LYS   8  11.058  -6.153   0.904
   56   2HG   LYS   8          HG1       LYS   8  11.586  -6.722  -0.680
   57   1HD   LYS   8          HD2       LYS   8  13.724  -5.819  -0.443
   58   2HD   LYS   8          HD1       LYS   8  13.196  -4.625   0.744
   59   1HE   LYS   8          HE2       LYS   8  13.041  -6.271   2.479
   60   2HE   LYS   8          HE1       LYS   8  13.186  -7.605   1.316
   61   1HZ   LYS   8          HZ1       LYS   8  15.295  -6.859   2.540
   62   2HZ   LYS   8          HZ2       LYS   8  15.263  -5.511   1.505
   63   3HZ   LYS   8          HZ3       LYS   8  15.390  -7.079   0.861
   64    H    THR   9           HN       THR   9  11.150  -2.181  -1.176
   65    HA   THR   9           HA       THR   9   9.018  -0.200  -0.976
   66    HB   THR   9           HB       THR   9  11.059  -0.165  -3.159
   67    HG1  THR   9           HG1      THR   9  12.626  -0.528  -1.837
   68   1HG2  THR   9          HG2       THR   9   9.398   1.673  -1.792
   69   2HG2  THR   9          HG2       THR   9  10.593   2.029  -3.038
   70   3HG2  THR   9          HG2       THR   9  11.056   2.064  -1.337
   71    H    CYS  10           HN       CYS  10  10.256  -2.199  -3.690
   72    HA   CYS  10           HA       CYS  10   8.112  -1.526  -5.491
   73   1HB   CYS  10          HB2       CYS  10   9.965  -3.930  -5.370
   74   2HB   CYS  10          HB1       CYS  10   9.075  -3.390  -6.791
   75    H    CYS  11           HN       CYS  11   7.135  -3.952  -6.417
   76    HA   CYS  11           HA       CYS  11   5.942  -5.401  -4.120
   77   1HB   CYS  11          HB2       CYS  11   4.519  -3.565  -6.038
   78   2HB   CYS  11          HB1       CYS  11   3.656  -4.911  -5.294
   79    H    PHE  12           HN       PHE  12   6.695  -7.406  -4.866
   80    HA   PHE  12           HA       PHE  12   6.159  -8.147  -7.696
   81   1HB   PHE  12          HB2       PHE  12   7.960  -9.110  -5.482
   82   2HB   PHE  12          HB1       PHE  12   7.656 -10.129  -6.889
   83    HD1  PHE  12           HD1      PHE  12   9.016  -6.868  -5.763
   84    HD2  PHE  12           HD2      PHE  12   8.585  -9.603  -9.046
   85    HE1  PHE  12           HE1      PHE  12  10.679  -5.567  -7.064
   86    HE2  PHE  12           HE2      PHE  12  10.247  -8.303 -10.348
   87    HZ   PHE  12           HZ       PHE  12  11.294  -6.285  -9.357
   88    H    GLN  13           HN       GLN  13   4.190  -8.088  -5.294
   89    HA   GLN  13           HA       GLN  13   2.932 -10.683  -5.910
   90   1HB   GLN  13          HB2       GLN  13   4.691 -10.724  -3.923
   91   2HB   GLN  13          HB1       GLN  13   3.356 -10.009  -3.017
   92   1HG   GLN  13          HG2       GLN  13   3.159 -12.380  -2.735
   93   2HG   GLN  13          HG1       GLN  13   1.905 -11.915  -3.887
   94   1HE2  GLN  13          HE2       GLN  13   1.951 -14.105  -4.838
   95   2HE2  GLN  13          HE2       GLN  13   3.229 -14.579  -5.851
   96    H    TYR  14           HN       TYR  14   0.672 -10.602  -5.543
   97    HA   TYR  14           HA       TYR  14  -0.393  -8.082  -4.343
   98   1HB   TYR  14          HB2       TYR  14  -1.306  -9.520  -6.854
   99   2HB   TYR  14          HB1       TYR  14  -2.031  -8.053  -6.195
  100    HD1  TYR  14           HD1      TYR  14   0.313  -6.507  -5.334
  101    HD2  TYR  14           HD2      TYR  14  -0.274  -8.875  -8.871
  102    HE1  TYR  14           HE1      TYR  14   2.000  -5.139  -6.528
  103    HE2  TYR  14           HE2      TYR  14   1.413  -7.506 -10.066
  104    HH   TYR  14           HH       TYR  14   2.596  -5.559  -9.983
  105    H    SER  15           HN       SER  15  -1.574  -8.690  -2.574
  106    HA   SER  15           HA       SER  15  -2.576 -11.385  -2.191
  107   1HB   SER  15          HB2       SER  15  -3.388  -8.888  -0.698
  108   2HB   SER  15          HB1       SER  15  -3.243 -10.529  -0.075
  109    HG   SER  15           HG       SER  15  -1.139 -10.287   0.087
  110    H    HIS  16           HN       HIS  16  -5.035 -11.442  -1.360
  111    HA   HIS  16           HA       HIS  16  -6.842  -9.853  -3.095
  112   1HB   HIS  16          HB2       HIS  16  -5.814 -12.157  -4.058
  113   2HB   HIS  16          HB1       HIS  16  -7.183 -12.814  -3.160
  114    HD1  HIS  16           HD1      HIS  16  -9.559 -11.486  -3.704
  115    HD2  HIS  16           HD2      HIS  16  -6.535 -11.236  -6.562
  116    HE1  HIS  16           HE1      HIS  16 -10.672 -10.771  -5.865
  117    H    LYS  17           HN       LYS  17  -6.661  -9.723  -0.308
  118    HA   LYS  17           HA       LYS  17  -9.257 -10.933   0.498
  119   1HB   LYS  17          HB2       LYS  17  -6.538 -11.241   1.764
  120   2HB   LYS  17          HB1       LYS  17  -8.007 -11.437   2.722
  121   1HG   LYS  17          HG2       LYS  17  -8.803 -13.126   1.042
  122   2HG   LYS  17          HG1       LYS  17  -7.231 -13.010   0.251
  123   1HD   LYS  17          HD2       LYS  17  -6.092 -13.871   2.162
  124   2HD   LYS  17          HD1       LYS  17  -7.513 -13.669   3.188
  125   1HE   LYS  17          HE2       LYS  17  -8.345 -15.689   2.568
  126   2HE   LYS  17          HE1       LYS  17  -8.074 -15.343   0.849
  127   1HZ   LYS  17          HZ1       LYS  17  -6.135 -16.362   2.841
  128   2HZ   LYS  17          HZ2       LYS  17  -5.627 -15.637   1.390
  129   3HZ   LYS  17          HZ3       LYS  17  -6.571 -17.051   1.353
  130    HA   PRO  18           HA       PRO  18  -9.791  -6.899   2.211
  131   1HB   PRO  18          HB2       PRO  18 -11.801  -7.417   3.989
  132   2HB   PRO  18          HB1       PRO  18 -12.058  -7.344   2.235
  133   1HG   PRO  18          HG2       PRO  18 -11.809  -9.706   4.016
  134   2HG   PRO  18          HG1       PRO  18 -12.829  -9.467   2.591
  135   1HD   PRO  18          HD2       PRO  18 -10.490 -10.909   2.597
  136   2HD   PRO  18          HD1       PRO  18 -11.196 -10.149   1.155
  137    H    LEU  19           HN       LEU  19  -8.045  -6.302   3.488
  138    HA   LEU  19           HA       LEU  19  -7.199  -7.708   5.869
  139   1HB   LEU  19          HB2       LEU  19  -5.885  -6.188   4.281
  140   2HB   LEU  19          HB1       LEU  19  -6.679  -4.828   5.074
  141    HG   LEU  19           HG       LEU  19  -5.813  -5.764   7.277
  142   1HD1  LEU  19          HD1       LEU  19  -4.047  -7.365   5.398
  143   2HD1  LEU  19          HD1       LEU  19  -5.344  -8.050   6.377
  144   3HD1  LEU  19          HD1       LEU  19  -3.937  -7.327   7.158
  145   1HD2  LEU  19          HD2       LEU  19  -4.690  -4.031   5.484
  146   2HD2  LEU  19          HD2       LEU  19  -3.391  -5.207   5.677
  147   3HD2  LEU  19          HD2       LEU  19  -4.028  -4.360   7.085
  148    HA   PRO  20           HA       PRO  20 -10.170  -6.044   8.690
  149   1HB   PRO  20          HB2       PRO  20  -8.731  -6.265  11.021
  150   2HB   PRO  20          HB1       PRO  20  -9.509  -7.646  10.219
  151   1HG   PRO  20          HG2       PRO  20  -6.661  -6.755  10.107
  152   2HG   PRO  20          HG1       PRO  20  -7.322  -8.391  10.271
  153   1HD   PRO  20          HD2       PRO  20  -6.410  -7.470   7.919
  154   2HD   PRO  20          HD1       PRO  20  -7.802  -8.571   8.016
  155    H    TRP  21           HN       TRP  21 -10.456  -3.862   8.441
  156    HA   TRP  21           HA       TRP  21  -8.594  -1.804   8.294
  157   1HB   TRP  21          HB2       TRP  21 -11.380  -1.899   9.485
  158   2HB   TRP  21          HB1       TRP  21 -10.536  -0.398   9.100
  159    HD1  TRP  21           HD1      TRP  21 -12.486  -3.198   7.542
  160    HE1  TRP  21           HE1      TRP  21 -12.682  -2.814   5.001
  161    HE3  TRP  21           HE3      TRP  21  -9.165   0.638   6.973
  162    HZ2  TRP  21           HZ2      TRP  21 -11.574  -1.108   2.991
  163    HZ3  TRP  21           HZ3      TRP  21  -8.753   1.621   4.736
  164    HH2  TRP  21           HH2      TRP  21  -9.952   0.755   2.747
  165    H    THR  22           HN       THR  22  -9.746  -3.441  11.196
  166    HA   THR  22           HA       THR  22  -8.934  -1.563  13.174
  167    HB   THR  22           HB       THR  22  -8.599  -3.856  14.445
  168    HG1  THR  22           HG1      THR  22  -8.447  -5.252  12.794
  169   1HG2  THR  22          HG2       THR  22 -11.361  -3.754  13.454
  170   2HG2  THR  22          HG2       THR  22 -10.741  -2.189  13.980
  171   3HG2  THR  22          HG2       THR  22 -10.748  -3.555  15.096
  172    H    TRP  23           HN       TRP  23  -7.103  -3.954  11.324
  173    HA   TRP  23           HA       TRP  23  -4.612  -3.269  12.787
  174   1HB   TRP  23          HB2       TRP  23  -5.780  -5.586  11.588
  175   2HB   TRP  23          HB1       TRP  23  -4.296  -5.220  10.709
  176    HD1  TRP  23           HD1      TRP  23  -4.831  -4.541  14.451
  177    HE1  TRP  23           HE1      TRP  23  -3.123  -5.937  15.785
  178    HE3  TRP  23           HE3      TRP  23  -2.757  -7.258  10.657
  179    HZ2  TRP  23           HZ2      TRP  23  -1.139  -7.944  15.306
  180    HZ3  TRP  23           HZ3      TRP  23  -0.963  -8.903  11.123
  181    HH2  TRP  23           HH2      TRP  23  -0.152  -9.249  13.440
  182    H    VAL  24           HN       VAL  24  -6.307  -2.360   9.964
  183    HA   VAL  24           HA       VAL  24  -3.935  -1.895   8.300
  184    HB   VAL  24           HB       VAL  24  -6.804  -0.945   8.033
  185   1HG1  VAL  24          HG1       VAL  24  -6.257  -0.694   5.672
  186   2HG1  VAL  24          HG1       VAL  24  -4.639  -1.341   5.946
  187   3HG1  VAL  24          HG1       VAL  24  -5.090   0.222   6.626
  188   1HG2  VAL  24          HG2       VAL  24  -6.209  -3.076   6.260
  189   2HG2  VAL  24          HG2       VAL  24  -7.319  -3.105   7.628
  190   3HG2  VAL  24          HG2       VAL  24  -5.637  -3.579   7.849
  191    H    ARG  25           HN       ARG  25  -2.762   0.018   8.262
  192    HA   ARG  25           HA       ARG  25  -3.761   2.240  10.004
  193   1HB   ARG  25          HB2       ARG  25  -1.666   1.187  10.688
  194   2HB   ARG  25          HB1       ARG  25  -0.989   1.426   9.078
  195   1HG   ARG  25          HG2       ARG  25  -0.391   3.543   9.564
  196   2HG   ARG  25          HG1       ARG  25  -2.011   3.923  10.147
  197   1HD   ARG  25          HD2       ARG  25  -1.206   2.455  12.238
  198   2HD   ARG  25          HD1       ARG  25   0.385   3.019  11.687
  199    HE   ARG  25           HE       ARG  25  -1.841   4.981  12.034
  200   1HH1  ARG  25          HH1       ARG  25  -0.331   4.130  14.545
  201   2HH1  ARG  25          HH1       ARG  25   0.876   5.368  14.644
  202   1HH2  ARG  25          HH2       ARG  25   0.424   6.436  11.375
  203   2HH2  ARG  25          HH2       ARG  25   1.304   6.674  12.847
  204    H    SER  26           HN       SER  26  -2.285   1.550   6.821
  205    HA   SER  26           HA       SER  26  -3.642   3.766   5.556
  206   1HB   SER  26          HB2       SER  26  -1.604   5.189   5.253
  207   2HB   SER  26          HB1       SER  26  -2.088   5.051   6.941
  208    HG   SER  26           HG       SER  26   0.171   4.173   5.665
  209    H    TYR  27           HN       TYR  27  -1.825   4.348   3.511
  210    HA   TYR  27           HA       TYR  27  -0.965   1.702   2.455
  211   1HB   TYR  27          HB2       TYR  27  -2.502   1.733   0.750
  212   2HB   TYR  27          HB1       TYR  27  -3.396   2.771   1.852
  213    HD1  TYR  27           HD1      TYR  27  -2.987   5.331   1.665
  214    HD2  TYR  27           HD2      TYR  27  -1.870   2.505  -1.369
  215    HE1  TYR  27           HE1      TYR  27  -2.870   7.164  -0.001
  216    HE2  TYR  27           HE2      TYR  27  -1.756   4.334  -3.035
  217    HH   TYR  27           HH       TYR  27  -1.315   7.061  -2.739
  218    H    GLU  28           HN       GLU  28  -0.010   2.332   0.040
  219    HA   GLU  28           HA       GLU  28   1.296   4.875  -0.250
  220   1HB   GLU  28          HB2       GLU  28   3.578   4.157   0.408
  221   2HB   GLU  28          HB1       GLU  28   2.466   4.068   1.774
  222   1HG   GLU  28          HG2       GLU  28   2.131   1.636   1.274
  223   2HG   GLU  28          HG1       GLU  28   3.374   1.764   0.029
  224    H    PHE  29           HN       PHE  29   2.025   4.998  -2.364
  225    HA   PHE  29           HA       PHE  29   1.832   2.570  -4.034
  226   1HB   PHE  29          HB2       PHE  29   1.134   5.170  -4.362
  227   2HB   PHE  29          HB1       PHE  29   2.724   5.190  -5.125
  228    HD1  PHE  29           HD1      PHE  29   3.195   3.101  -6.727
  229    HD2  PHE  29           HD2      PHE  29  -0.698   4.579  -5.674
  230    HE1  PHE  29           HE1      PHE  29   2.241   2.028  -8.749
  231    HE2  PHE  29           HE2      PHE  29  -1.653   3.506  -7.696
  232    HZ   PHE  29           HZ       PHE  29  -0.183   2.232  -9.233
  233    H    THR  30           HN       THR  30   3.604   1.754  -5.280
  234    HA   THR  30           HA       THR  30   6.170   1.713  -4.062
  235    HB   THR  30           HB       THR  30   6.789   0.814  -6.408
  236    HG1  THR  30           HG1      THR  30   5.384   1.428  -7.836
  237   1HG2  THR  30          HG2       THR  30   6.216  -0.733  -4.670
  238   2HG2  THR  30          HG2       THR  30   5.271  -1.196  -6.085
  239   3HG2  THR  30          HG2       THR  30   4.509  -0.306  -4.768
  240    H    SER  31           HN       SER  31   8.167   2.722  -4.749
  241    HA   SER  31           HA       SER  31   7.849   5.486  -5.659
  242   1HB   SER  31          HB2       SER  31  10.007   3.696  -4.606
  243   2HB   SER  31          HB1       SER  31  10.483   5.178  -5.430
  244    HG   SER  31           HG       SER  31   9.481   4.840  -2.957
  245    H    ASN  32           HN       ASN  32   9.258   6.330  -7.461
  246    HA   ASN  32           HA       ASN  32   8.871   4.819  -9.896
  247   1HB   ASN  32          HB2       ASN  32   9.407   7.448  -9.083
  248   2HB   ASN  32          HB1       ASN  32  10.828   6.979 -10.017
  249   1HD2  ASN  32          HD2       ASN  32  10.408   8.017 -12.013
  250   2HD2  ASN  32          HD2       ASN  32   9.016   7.742 -12.945
  251    H    SER  33           HN       SER  33  10.139   2.876  -8.857
  252    HA   SER  33           HA       SER  33  12.779   2.782 -10.109
  253   1HB   SER  33          HB2       SER  33  13.868   2.268  -7.855
  254   2HB   SER  33          HB1       SER  33  13.383   3.945  -8.095
  255    HG   SER  33           HG       SER  33  12.734   2.570  -6.087
  256    H    CYS  34           HN       CYS  34  10.205   1.297 -10.160
  257    HA   CYS  34           HA       CYS  34  11.285  -1.416  -9.493
  258   1HB   CYS  34          HB2       CYS  34   8.477  -0.372  -8.987
  259   2HB   CYS  34          HB1       CYS  34   9.068  -1.986  -8.593
  260    H    SER  35           HN       SER  35  11.016  -2.841 -11.188
  261    HA   SER  35           HA       SER  35  10.163  -2.044 -13.765
  262   1HB   SER  35          HB2       SER  35  10.052  -4.583 -14.087
  263   2HB   SER  35          HB1       SER  35  11.568  -3.958 -13.446
  264    HG   SER  35           HG       SER  35  11.203  -5.010 -11.666
  265    H    GLN  36           HN       GLN  36   8.299  -3.076 -11.009
  266    HA   GLN  36           HA       GLN  36   5.810  -2.862 -12.656
  267   1HB   GLN  36          HB2       GLN  36   6.762  -5.073 -10.837
  268   2HB   GLN  36          HB1       GLN  36   5.039  -4.838 -11.141
  269   1HG   GLN  36          HG2       GLN  36   5.653  -4.851 -13.640
  270   2HG   GLN  36          HG1       GLN  36   7.212  -5.503 -13.131
  271   1HE2  GLN  36          HE2       GLN  36   7.251  -7.669 -12.205
  272   2HE2  GLN  36          HE2       GLN  36   5.914  -8.709 -12.323
  273    H    ARG  37           HN       ARG  37   5.174  -0.887 -11.724
  274    HA   ARG  37           HA       ARG  37   5.425  -0.235  -8.934
  275   1HB   ARG  37          HB2       ARG  37   4.005   1.652  -9.574
  276   2HB   ARG  37          HB1       ARG  37   5.164   1.339 -10.867
  277   1HG   ARG  37          HG2       ARG  37   3.306  -0.167 -11.878
  278   2HG   ARG  37          HG1       ARG  37   2.220   0.694 -10.787
  279   1HD   ARG  37          HD2       ARG  37   3.240   2.861 -11.773
  280   2HD   ARG  37          HD1       ARG  37   3.851   1.816 -13.072
  281    HE   ARG  37           HE       ARG  37   0.966   1.653 -12.343
  282   1HH1  ARG  37          HH1       ARG  37   2.962   3.542 -14.252
  283   2HH1  ARG  37          HH1       ARG  37   2.166   3.192 -15.750
  284   1HH2  ARG  37          HH2       ARG  37   0.155   0.708 -14.405
  285   2HH2  ARG  37          HH2       ARG  37   0.576   1.587 -15.837
  286    H    ALA  38           HN       ALA  38   3.593  -0.014  -7.398
  287    HA   ALA  38           HA       ALA  38   1.048  -1.313  -7.936
  288   1HB   ALA  38          HB1       ALA  38   2.377  -2.859  -5.851
  289   2HB   ALA  38          HB2       ALA  38   3.243  -2.956  -7.384
  290   3HB   ALA  38          HB3       ALA  38   1.546  -3.425  -7.298
  291    H    VAL  39           HN       VAL  39  -0.402  -1.101  -6.124
  292    HA   VAL  39           HA       VAL  39   0.339   1.040  -4.244
  293    HB   VAL  39           HB       VAL  39  -2.192  -0.584  -4.678
  294   1HG1  VAL  39          HG1       VAL  39  -3.226   0.705  -3.111
  295   2HG1  VAL  39          HG1       VAL  39  -2.314   2.148  -3.554
  296   3HG1  VAL  39          HG1       VAL  39  -1.592   0.939  -2.492
  297   1HG2  VAL  39          HG2       VAL  39  -1.224   0.872  -6.591
  298   2HG2  VAL  39          HG2       VAL  39  -1.653   2.249  -5.577
  299   3HG2  VAL  39          HG2       VAL  39  -2.906   1.141  -6.135
  300    H    ILE  40           HN       ILE  40   0.346   0.761  -1.930
  301    HA   ILE  40           HA       ILE  40   0.370  -2.087  -0.998
  302    HB   ILE  40           HB       ILE  40   2.244   0.213  -0.376
  303   1HG1  ILE  40          HG1       ILE  40   3.012  -2.459  -1.517
  304   2HG1  ILE  40          HG1       ILE  40   2.379  -1.203  -2.580
  305   1HG2  ILE  40          HG2       ILE  40   2.021  -2.571   0.774
  306   2HG2  ILE  40          HG2       ILE  40   1.998  -1.036   1.643
  307   3HG2  ILE  40          HG2       ILE  40   3.490  -1.604   0.895
  308   1HD1  ILE  40          HD1       ILE  40   5.027  -1.462  -1.614
  309   2HD1  ILE  40          HD1       ILE  40   4.334  -0.059  -0.802
  310   3HD1  ILE  40          HD1       ILE  40   4.357  -0.136  -2.564
  311    H    PHE  41           HN       PHE  41  -0.527  -2.432   1.041
  312    HA   PHE  41           HA       PHE  41  -1.758  -0.060   2.413
  313   1HB   PHE  41          HB2       PHE  41  -2.631  -2.971   2.223
  314   2HB   PHE  41          HB1       PHE  41  -3.485  -1.719   3.124
  315    HD1  PHE  41           HD1      PHE  41  -3.527  -3.477   0.144
  316    HD2  PHE  41           HD2      PHE  41  -3.795   0.552   1.609
  317    HE1  PHE  41           HE1      PHE  41  -4.729  -2.807  -1.918
  318    HE2  PHE  41           HE2      PHE  41  -4.994   1.223  -0.454
  319    HZ   PHE  41           HZ       PHE  41  -5.462  -0.459  -2.217
  320    H    THR  42           HN       THR  42  -0.696   0.304   4.374
  321    HA   THR  42           HA       THR  42   0.862  -1.934   5.535
  322    HB   THR  42           HB       THR  42   1.912   0.261   5.162
  323    HG1  THR  42           HG1      THR  42   2.975  -0.048   6.931
  324   1HG2  THR  42          HG2       THR  42   0.611   1.713   7.283
  325   2HG2  THR  42          HG2       THR  42  -0.574   1.202   6.083
  326   3HG2  THR  42          HG2       THR  42   0.815   2.167   5.592
  327    H    THR  43           HN       THR  43   0.657  -2.505   7.773
  328    HA   THR  43           HA       THR  43  -2.100  -2.079   8.838
  329    HB   THR  43           HB       THR  43  -1.423  -4.179  10.152
  330    HG1  THR  43           HG1      THR  43   0.563  -4.764   9.935
  331   1HG2  THR  43          HG2       THR  43  -2.775  -4.891   8.476
  332   2HG2  THR  43          HG2       THR  43  -1.279  -5.424   7.710
  333   3HG2  THR  43          HG2       THR  43  -1.983  -3.865   7.280
  334    H    LYS  44           HN       LYS  44  -1.758  -2.764  11.458
  335    HA   LYS  44           HA       LYS  44  -0.479  -0.376  12.577
  336   1HB   LYS  44          HB2       LYS  44  -2.023  -2.733  13.684
  337   2HB   LYS  44          HB1       LYS  44  -1.448  -1.404  14.692
  338   1HG   LYS  44          HG2       LYS  44  -2.900  -0.578  12.253
  339   2HG   LYS  44          HG1       LYS  44  -3.878  -1.427  13.449
  340   1HD   LYS  44          HD2       LYS  44  -3.231   0.146  15.179
  341   2HD   LYS  44          HD1       LYS  44  -2.093   0.938  14.088
  342   1HE   LYS  44          HE2       LYS  44  -4.326   1.158  12.587
  343   2HE   LYS  44          HE1       LYS  44  -5.062   1.160  14.204
  344   1HZ   LYS  44          HZ1       LYS  44  -4.280   3.389  13.386
  345   2HZ   LYS  44          HZ2       LYS  44  -2.690   2.799  13.506
  346   3HZ   LYS  44          HZ3       LYS  44  -3.664   2.916  14.894
  347    H    ARG  45           HN       ARG  45   0.314  -3.770  12.220
  348    HA   ARG  45           HA       ARG  45   2.390  -3.719  14.308
  349   1HB   ARG  45          HB2       ARG  45   0.959  -5.630  12.625
  350   2HB   ARG  45          HB1       ARG  45   2.680  -6.000  12.733
  351   1HG   ARG  45          HG2       ARG  45   0.866  -5.486  15.109
  352   2HG   ARG  45          HG1       ARG  45   1.380  -7.081  14.557
  353   1HD   ARG  45          HD2       ARG  45   3.456  -6.853  15.480
  354   2HD   ARG  45          HD1       ARG  45   3.598  -5.163  14.958
  355    HE   ARG  45           HE       ARG  45   1.633  -5.656  17.098
  356   1HH1  ARG  45          HH2       ARG  45   4.518  -6.298  17.950
  357   2HH1  ARG  45          HH2       ARG  45   4.992  -4.782  18.642
  358   1HH2  ARG  45          HH1       ARG  45   2.367  -3.013  17.227
  359   2HH2  ARG  45          HH1       ARG  45   3.775  -2.924  18.231
  360    H    GLY  46           HN       GLY  46   2.377  -2.175  11.481
  361   1HA   GLY  46          HA2       GLY  46   4.203  -1.286  10.267
  362   2HA   GLY  46          HA1       GLY  46   5.280  -2.336  11.189
  363    H    LYS  47           HN       LYS  47   2.506  -3.739   9.629
  364    HA   LYS  47           HA       LYS  47   4.335  -5.213   7.812
  365   1HB   LYS  47          HB2       LYS  47   2.246  -5.927   9.489
  366   2HB   LYS  47          HB1       LYS  47   1.495  -5.949   7.893
  367   1HG   LYS  47          HG2       LYS  47   2.378  -8.049   7.786
  368   2HG   LYS  47          HG1       LYS  47   3.855  -7.190   7.345
  369   1HD   LYS  47          HD2       LYS  47   4.863  -7.661   9.325
  370   2HD   LYS  47          HD1       LYS  47   3.389  -7.367  10.250
  371   1HE   LYS  47          HE2       LYS  47   3.302  -9.629  10.514
  372   2HE   LYS  47          HE1       LYS  47   2.804  -9.687   8.812
  373   1HZ   LYS  47          HZ1       LYS  47   5.234  -9.548   8.259
  374   2HZ   LYS  47          HZ2       LYS  47   4.742 -11.008   8.975
  375   3HZ   LYS  47          HZ3       LYS  47   5.560  -9.840   9.898
  376    H    LYS  48           HN       LYS  48   4.453  -4.514   5.711
  377    HA   LYS  48           HA       LYS  48   2.213  -2.855   4.638
  378   1HB   LYS  48          HB2       LYS  48   5.135  -3.208   3.957
  379   2HB   LYS  48          HB1       LYS  48   4.030  -2.295   2.928
  380   1HG   LYS  48          HG2       LYS  48   4.502  -0.517   4.240
  381   2HG   LYS  48          HG1       LYS  48   3.507  -1.301   5.466
  382   1HD   LYS  48          HD2       LYS  48   5.609  -0.834   6.513
  383   2HD   LYS  48          HD1       LYS  48   5.597  -2.567   6.179
  384   1HE   LYS  48          HE2       LYS  48   7.721  -1.903   5.383
  385   2HE   LYS  48          HE1       LYS  48   6.733  -1.857   3.908
  386   1HZ   LYS  48          HZ1       LYS  48   7.398   0.414   5.700
  387   2HZ   LYS  48          HZ2       LYS  48   6.213   0.498   4.487
  388   3HZ   LYS  48          HZ3       LYS  48   7.838   0.228   4.074
  389    H    VAL  49           HN       VAL  49   0.797  -3.958   3.365
  390    HA   VAL  49           HA       VAL  49   1.721  -6.431   1.972
  391    HB   VAL  49           HB       VAL  49  -1.026  -5.230   2.454
  392   1HG1  VAL  49          HG1       VAL  49  -1.949  -7.177   1.528
  393   2HG1  VAL  49          HG1       VAL  49  -0.450  -8.088   1.706
  394   3HG1  VAL  49          HG1       VAL  49  -0.590  -6.857   0.451
  395   1HG2  VAL  49          HG2       VAL  49  -0.876  -7.552   3.894
  396   2HG2  VAL  49          HG2       VAL  49  -0.561  -5.953   4.566
  397   3HG2  VAL  49          HG2       VAL  49   0.780  -6.963   4.028
  398    H    CYS  50           HN       CYS  50   2.161  -6.327  -0.193
  399    HA   CYS  50           HA       CYS  50   1.715  -3.882  -1.719
  400   1HB   CYS  50          HB2       CYS  50   2.896  -6.611  -2.130
  401   2HB   CYS  50          HB1       CYS  50   2.548  -5.624  -3.550
  402    H    THR  51           HN       THR  51   0.337  -3.699  -3.586
  403    HA   THR  51           HA       THR  51  -1.595  -5.856  -4.174
  404    HB   THR  51           HB       THR  51  -3.485  -4.187  -3.711
  405    HG1  THR  51           HG1      THR  51  -2.761  -2.278  -3.260
  406   1HG2  THR  51          HG2       THR  51  -2.793  -6.119  -2.217
  407   2HG2  THR  51          HG2       THR  51  -3.610  -4.791  -1.394
  408   3HG2  THR  51          HG2       THR  51  -1.858  -4.955  -1.279
  409    H    HIS  52           HN       HIS  52  -2.684  -5.471  -6.201
  410    HA   HIS  52           HA       HIS  52  -1.240  -3.682  -8.013
  411   1HB   HIS  52          HB2       HIS  52  -2.571  -6.102  -8.161
  412   2HB   HIS  52          HB1       HIS  52  -3.692  -4.997  -8.956
  413    HD1  HIS  52           HD1      HIS  52  -3.025  -6.266 -11.221
  414    HD2  HIS  52           HD2      HIS  52   0.033  -4.059  -9.444
  415    HE1  HIS  52           HE1      HIS  52  -1.226  -5.989 -12.981
  416    HA   PRO  53           HA       PRO  53  -4.171  -0.378  -7.554
  417   1HB   PRO  53          HB2       PRO  53  -3.433   1.118  -9.720
  418   2HB   PRO  53          HB1       PRO  53  -2.470   1.041  -8.230
  419   1HG   PRO  53          HG2       PRO  53  -2.045  -0.327 -10.830
  420   2HG   PRO  53          HG1       PRO  53  -0.861   0.325  -9.688
  421   1HD   PRO  53          HD2       PRO  53  -1.490  -2.344  -9.932
  422   2HD   PRO  53          HD1       PRO  53  -0.789  -1.602  -8.479
  423    H    ARG  54           HN       ARG  54  -3.901  -2.377 -10.399
  424    HA   ARG  54           HA       ARG  54  -6.114  -1.294 -11.900
  425   1HB   ARG  54          HB2       ARG  54  -4.660  -3.947 -11.797
  426   2HB   ARG  54          HB1       ARG  54  -5.946  -3.627 -12.961
  427   1HG   ARG  54          HG2       ARG  54  -4.497  -2.531 -14.284
  428   2HG   ARG  54          HG1       ARG  54  -4.146  -1.400 -12.977
  429   1HD   ARG  54          HD2       ARG  54  -2.545  -3.152 -12.039
  430   2HD   ARG  54          HD1       ARG  54  -2.748  -4.023 -13.572
  431    HE   ARG  54           HE       ARG  54  -2.219  -1.363 -14.286
  432   1HH1  ARG  54          HH1       ARG  54  -0.459  -3.614 -15.131
  433   2HH1  ARG  54          HH1       ARG  54   1.040  -3.227 -14.354
  434   1HH2  ARG  54          HH2       ARG  54  -0.384  -0.971 -12.140
  435   2HH2  ARG  54          HH2       ARG  54   1.083  -1.732 -12.661
  436    H    LYS  55           HN       LYS  55  -5.845  -3.790  -9.383
  437    HA   LYS  55           HA       LYS  55  -8.486  -4.866  -9.609
  438   1HB   LYS  55          HB2       LYS  55  -6.209  -4.856  -7.751
  439   2HB   LYS  55          HB1       LYS  55  -7.764  -5.043  -6.938
  440   1HG   LYS  55          HG2       LYS  55  -7.825  -7.197  -7.584
  441   2HG   LYS  55          HG1       LYS  55  -7.833  -6.675  -9.269
  442   1HD   LYS  55          HD2       LYS  55  -5.202  -6.589  -7.893
  443   2HD   LYS  55          HD1       LYS  55  -5.858  -8.194  -8.209
  444   1HE   LYS  55          HE2       LYS  55  -6.343  -6.881 -10.598
  445   2HE   LYS  55          HE1       LYS  55  -4.762  -6.239 -10.106
  446   1HZ   LYS  55          HZ1       LYS  55  -5.567  -9.060 -10.478
  447   2HZ   LYS  55          HZ2       LYS  55  -4.240  -8.650  -9.499
  448   3HZ   LYS  55          HZ3       LYS  55  -4.241  -8.242 -11.149
  449    H    LYS  56           HN       LYS  56 -10.380  -3.792  -9.284
  450    HA   LYS  56           HA       LYS  56 -10.691  -1.144  -8.403
  451   1HB   LYS  56          HB2       LYS  56 -12.282  -3.427  -9.106
  452   2HB   LYS  56          HB1       LYS  56 -12.997  -2.658  -7.689
  453   1HG   LYS  56          HG2       LYS  56 -13.930  -1.204  -9.152
  454   2HG   LYS  56          HG1       LYS  56 -12.319  -0.496  -9.274
  455   1HD   LYS  56          HD2       LYS  56 -12.064  -1.234 -11.390
  456   2HD   LYS  56          HD1       LYS  56 -12.571  -2.865 -10.948
  457   1HE   LYS  56          HE2       LYS  56 -14.978  -1.695 -10.842
  458   2HE   LYS  56          HE1       LYS  56 -14.210  -0.601 -12.009
  459   1HZ   LYS  56          HZ1       LYS  56 -13.467  -2.537 -13.270
  460   2HZ   LYS  56          HZ2       LYS  56 -15.162  -2.512 -13.141
  461   3HZ   LYS  56          HZ3       LYS  56 -14.250  -3.570 -12.174
  462    H    TRP  57           HN       TRP  57 -11.080  -4.137  -6.452
  463    HA   TRP  57           HA       TRP  57 -11.855  -2.967  -4.024
  464   1HB   TRP  57          HB2       TRP  57 -11.486  -5.097  -3.209
  465   2HB   TRP  57          HB1       TRP  57 -11.378  -5.454  -4.926
  466    HD1  TRP  57           HD1      TRP  57  -9.248  -6.646  -5.675
  467    HE1  TRP  57           HE1      TRP  57  -6.907  -7.037  -4.664
  468    HE3  TRP  57           HE3      TRP  57  -9.627  -3.807  -1.450
  469    HZ2  TRP  57           HZ2      TRP  57  -5.398  -6.242  -2.365
  470    HZ3  TRP  57           HZ3      TRP  57  -7.726  -3.642   0.132
  471    HH2  TRP  57           HH2      TRP  57  -5.613  -4.856  -0.320
  472    H    VAL  58           HN       VAL  58  -8.575  -3.275  -5.366
  473    HA   VAL  58           HA       VAL  58  -7.135  -2.343  -3.062
  474    HB   VAL  58           HB       VAL  58  -6.552  -2.107  -6.030
  475   1HG1  VAL  58          HG1       VAL  58  -4.962  -0.736  -4.983
  476   2HG1  VAL  58          HG1       VAL  58  -4.140  -2.295  -5.047
  477   3HG1  VAL  58          HG1       VAL  58  -4.891  -1.755  -3.546
  478   1HG2  VAL  58          HG2       VAL  58  -5.469  -4.245  -5.841
  479   2HG2  VAL  58          HG2       VAL  58  -7.060  -4.428  -5.110
  480   3HG2  VAL  58          HG2       VAL  58  -5.638  -4.244  -4.087
  481    H    GLN  59           HN       GLN  59  -8.205  -0.595  -6.006
  482    HA   GLN  59           HA       GLN  59  -7.360   2.000  -5.255
  483   1HB   GLN  59          HB2       GLN  59  -9.655   0.919  -6.914
  484   2HB   GLN  59          HB1       GLN  59  -9.288   2.641  -6.827
  485   1HG   GLN  59          HG2       GLN  59  -6.877   1.109  -7.327
  486   2HG   GLN  59          HG1       GLN  59  -8.104   0.756  -8.543
  487   1HE2  GLN  59          HE2       GLN  59  -6.657   1.993 -10.080
  488   2HE2  GLN  59          HE2       GLN  59  -6.732   3.688 -10.086
  489    H    LYS  60           HN       LYS  60 -10.071   0.049  -4.222
  490    HA   LYS  60           HA       LYS  60 -11.603   2.214  -3.058
  491   1HB   LYS  60          HB2       LYS  60 -11.603  -0.763  -3.150
  492   2HB   LYS  60          HB1       LYS  60 -12.480  -0.014  -1.815
  493   1HG   LYS  60          HG2       LYS  60 -13.836   1.280  -3.345
  494   2HG   LYS  60          HG1       LYS  60 -12.871   0.747  -4.722
  495   1HD   LYS  60          HD2       LYS  60 -13.653  -1.504  -4.521
  496   2HD   LYS  60          HD1       LYS  60 -14.362  -1.187  -2.936
  497   1HE   LYS  60          HE2       LYS  60 -16.307  -0.832  -4.073
  498   2HE   LYS  60          HE1       LYS  60 -15.584   0.709  -4.575
  499   1HZ   LYS  60          HZ1       LYS  60 -15.564  -1.882  -6.000
  500   2HZ   LYS  60          HZ2       LYS  60 -14.401  -0.689  -6.332
  501   3HZ   LYS  60          HZ3       LYS  60 -16.051  -0.364  -6.578
  502    H    TYR  61           HN       TYR  61  -9.085  -0.015  -1.910
  503    HA   TYR  61           HA       TYR  61  -9.382   0.797   0.889
  504   1HB   TYR  61          HB2       TYR  61  -7.689  -0.999  -0.776
  505   2HB   TYR  61          HB1       TYR  61  -6.978  -0.438   0.737
  506    HD1  TYR  61           HD1      TYR  61  -7.383  -1.731   2.638
  507    HD2  TYR  61           HD2      TYR  61 -10.287  -1.690  -0.527
  508    HE1  TYR  61           HE1      TYR  61  -8.773  -3.359   3.890
  509    HE2  TYR  61           HE2      TYR  61 -11.675  -3.318   0.724
  510    HH   TYR  61           HH       TYR  61 -11.309  -3.961   3.933
  511    H    ILE  62           HN       ILE  62  -7.537   1.856  -1.900
  512    HA   ILE  62           HA       ILE  62  -5.526   3.363  -0.468
  513    HB   ILE  62           HB       ILE  62  -6.727   3.690  -3.242
  514   1HG1  ILE  62          HG1       ILE  62  -4.170   2.277  -2.471
  515   2HG1  ILE  62          HG1       ILE  62  -5.711   1.427  -2.568
  516   1HG2  ILE  62          HG2       ILE  62  -5.435   5.555  -3.250
  517   2HG2  ILE  62          HG2       ILE  62  -4.070   4.444  -3.332
  518   3HG2  ILE  62          HG2       ILE  62  -4.597   5.081  -1.775
  519   1HD1  ILE  62          HD1       ILE  62  -5.492   2.992  -4.924
  520   2HD1  ILE  62          HD1       ILE  62  -5.432   1.234  -4.791
  521   3HD1  ILE  62          HD1       ILE  62  -3.943   2.175  -4.709
  522    H    SER  63           HN       SER  63  -8.611   4.286  -2.040
  523    HA   SER  63           HA       SER  63  -8.582   7.038  -1.273
  524   1HB   SER  63          HB2       SER  63 -11.092   5.393  -1.454
  525   2HB   SER  63          HB1       SER  63 -10.777   7.002  -2.095
  526    HG   SER  63           HG       SER  63 -10.340   5.993  -3.881
  527    H    LEU  64           HN       LEU  64  -9.932   4.143   0.324
  528    HA   LEU  64           HA       LEU  64 -11.098   5.473   2.571
  529   1HB   LEU  64          HB2       LEU  64 -10.040   2.714   1.965
  530   2HB   LEU  64          HB1       LEU  64 -10.662   3.097   3.572
  531    HG   LEU  64           HG       LEU  64 -12.249   3.712   1.080
  532   1HD1  LEU  64          HD1       LEU  64 -11.501   1.168   1.644
  533   2HD1  LEU  64          HD1       LEU  64 -13.063   1.580   0.935
  534   3HD1  LEU  64          HD1       LEU  64 -12.929   1.302   2.672
  535   1HD2  LEU  64          HD2       LEU  64 -13.952   3.083   3.155
  536   2HD2  LEU  64          HD2       LEU  64 -13.466   4.719   2.713
  537   3HD2  LEU  64          HD2       LEU  64 -12.612   3.863   3.996
  538    H    LEU  65           HN       LEU  65  -7.984   3.663   2.438
  539    HA   LEU  65           HA       LEU  65  -7.008   4.640   4.947
  540   1HB   LEU  65          HB2       LEU  65  -5.664   3.620   2.425
  541   2HB   LEU  65          HB1       LEU  65  -4.782   3.935   3.918
  542    HG   LEU  65           HG       LEU  65  -7.024   1.934   3.514
  543   1HD1  LEU  65          HD1       LEU  65  -5.338   0.478   3.166
  544   2HD1  LEU  65          HD1       LEU  65  -4.665   0.881   4.745
  545   3HD1  LEU  65          HD1       LEU  65  -4.171   1.789   3.320
  546   1HD2  LEU  65          HD2       LEU  65  -6.513   1.360   5.940
  547   2HD2  LEU  65          HD2       LEU  65  -7.353   2.889   5.696
  548   3HD2  LEU  65          HD2       LEU  65  -5.621   2.878   6.029
  549    H    LYS  66           HN       LYS  66  -5.540   5.486   1.833
  550    HA   LYS  66           HA       LYS  66  -4.548   7.507   1.111
  551   1HB   LYS  66          HB2       LYS  66  -7.189   7.719   1.268
  552   2HB   LYS  66          HB1       LYS  66  -6.797   8.898   2.519
  553   1HG   LYS  66          HG2       LYS  66  -6.276  10.423   0.952
  554   2HG   LYS  66          HG1       LYS  66  -5.067   9.335   0.272
  555   1HD   LYS  66          HD2       LYS  66  -6.655   9.826  -1.477
  556   2HD   LYS  66          HD1       LYS  66  -6.938   8.164  -0.958
  557   1HE   LYS  66          HE2       LYS  66  -9.122   9.042  -0.984
  558   2HE   LYS  66          HE1       LYS  66  -8.656   9.294   0.710
  559   1HZ   LYS  66          HZ1       LYS  66  -9.533  11.320  -0.458
  560   2HZ   LYS  66          HZ2       LYS  66  -8.136  11.286  -1.426
  561   3HZ   LYS  66          HZ3       LYS  66  -8.003  11.508   0.253
  562    H    THR  67           HN       THR  67  -2.653   7.693   2.391
  563    HA   THR  67           HA       THR  67  -2.815   9.704   4.561
  564    HB   THR  67           HB       THR  67  -1.320   7.112   4.916
  565    HG1  THR  67           HG1      THR  67  -3.933   7.728   5.828
  566   1HG2  THR  67          HG2       THR  67  -1.146   7.754   7.172
  567   2HG2  THR  67          HG2       THR  67  -2.482   8.898   7.042
  568   3HG2  THR  67          HG2       THR  67  -0.927   9.271   6.299
  569    HA   PRO  68           HA       PRO  68   0.734  10.319   1.695
  570   1HB   PRO  68          HB2       PRO  68   0.614  13.054   1.784
  571   2HB   PRO  68          HB1       PRO  68  -0.369  12.077   0.674
  572   1HG   PRO  68          HG2       PRO  68  -1.125  13.298   3.288
  573   2HG   PRO  68          HG1       PRO  68  -2.044  13.219   1.776
  574   1HD   PRO  68          HD2       PRO  68  -2.523  11.565   3.851
  575   2HD   PRO  68          HD1       PRO  68  -2.742  11.063   2.158
  576    H    LYS  69           HN       LYS  69   2.782  11.643   2.146
  577    HA   LYS  69           HA       LYS  69   3.261  12.716   4.796
  578   1HB   LYS  69          HB2       LYS  69   4.636  10.836   5.615
  579   2HB   LYS  69          HB1       LYS  69   2.989  10.297   5.289
  580   1HG   LYS  69          HG2       LYS  69   3.696   8.844   3.718
  581   2HG   LYS  69          HG1       LYS  69   4.648  10.091   2.911
  582   1HD   LYS  69          HD2       LYS  69   6.498   9.754   4.443
  583   2HD   LYS  69          HD1       LYS  69   5.542   8.634   5.414
  584   1HE   LYS  69          HE2       LYS  69   5.306   7.269   3.198
  585   2HE   LYS  69          HE1       LYS  69   6.711   8.214   2.665
  586   1HZ   LYS  69          HZ1       LYS  69   6.497   6.565   5.128
  587   2HZ   LYS  69          HZ2       LYS  69   7.789   7.619   4.801
  588   3HZ   LYS  69          HZ3       LYS  69   7.508   6.278   3.797
  589    H    GLN  70           HN       GLN  70   3.818  13.586   2.138
  590    HA   GLN  70           HA       GLN  70   6.801  13.305   1.968
  591   1HB   GLN  70          HB2       GLN  70   4.554  13.379   0.052
  592   2HB   GLN  70          HB1       GLN  70   5.937  14.367  -0.417
  593   1HG   GLN  70          HG2       GLN  70   7.433  12.440  -0.146
  594   2HG   GLN  70          HG1       GLN  70   6.074  11.443   0.376
  595   1HE2  GLN  70          HE2       GLN  70   4.331  11.044  -1.269
  596   2HE2  GLN  70          HE2       GLN  70   4.716  11.109  -2.921
  597    H    LEU  71           HN       LEU  71   4.087  15.603   1.818
  598    HA   LEU  71           HA       LEU  71   5.730  17.745   2.933
  599   1HB   LEU  71          HB2       LEU  71   5.554  19.156   0.869
  600   2HB   LEU  71          HB1       LEU  71   6.531  17.709   0.623
  601    HG   LEU  71           HG       LEU  71   3.936  16.864   0.053
  602   1HD1  LEU  71          HD1       LEU  71   2.742  18.692  -0.506
  603   2HD1  LEU  71          HD1       LEU  71   3.840  18.902  -1.870
  604   3HD1  LEU  71          HD1       LEU  71   4.156  19.735  -0.348
  605   1HD2  LEU  71          HD2       LEU  71   5.362  17.763  -2.316
  606   2HD2  LEU  71          HD2       LEU  71   5.044  16.118  -1.766
  607   3HD2  LEU  71          HD2       LEU  71   6.459  16.987  -1.173
  Start of MODEL    9
    1   1H    THR   1          HT1       THR   1   9.391  20.462   2.227
    2   2H    THR   1          HT2       THR   1   9.095  19.491   3.589
    3   3H    THR   1          HT3       THR   1   9.486  18.773   2.101
    4    HA   THR   1           HA       THR   1  11.705  19.842   2.200
    5    HB   THR   1           HB       THR   1  10.963  20.468   5.054
    6    HG1  THR   1           HG1      THR   1  10.637  22.660   4.108
    7   1HG2  THR   1          HG2       THR   1  12.897  21.728   5.052
    8   2HG2  THR   1          HG2       THR   1  12.786  22.089   3.329
    9   3HG2  THR   1          HG2       THR   1  13.345  20.504   3.864
   10    H    ARG   2           HN       ARG   2  13.214  18.260   2.670
   11    HA   ARG   2           HA       ARG   2  14.067  16.212   3.489
   12   1HB   ARG   2          HB2       ARG   2  13.645  17.908   5.530
   13   2HB   ARG   2          HB1       ARG   2  12.520  16.636   6.007
   14   1HG   ARG   2          HG2       ARG   2  14.192  15.209   6.557
   15   2HG   ARG   2          HG1       ARG   2  15.119  15.606   5.109
   16   1HD   ARG   2          HD2       ARG   2  15.060  17.865   6.944
   17   2HD   ARG   2          HD1       ARG   2  15.729  16.417   7.723
   18    HE   ARG   2           HE       ARG   2  17.053  16.261   5.423
   19   1HH1  ARG   2          HH1       ARG   2  18.131  17.865   7.829
   20   2HH1  ARG   2          HH1       ARG   2  18.637  19.319   7.036
   21   1HH2  ARG   2          HH2       ARG   2  16.874  18.660   4.124
   22   2HH2  ARG   2          HH2       ARG   2  17.926  19.770   4.939
   23    H    GLY   3           HN       GLY   3  12.073  15.581   1.846
   24   1HA   GLY   3          HA2       GLY   3  10.785  13.296   3.158
   25   2HA   GLY   3          HA1       GLY   3   9.661  14.523   2.568
   26    H    SER   4           HN       SER   4  12.696  13.202   1.210
   27    HA   SER   4           HA       SER   4  11.691  13.231  -1.494
   28   1HB   SER   4          HB2       SER   4  13.946  11.532  -0.417
   29   2HB   SER   4          HB1       SER   4  13.823  12.309  -1.994
   30    HG   SER   4           HG       SER   4  14.962  13.796  -1.009
   31    H    ASP   5           HN       ASP   5  11.783  11.058  -2.797
   32    HA   ASP   5           HA       ASP   5   9.929   9.169  -1.479
   33   1HB   ASP   5          HB2       ASP   5   9.423  10.084  -3.700
   34   2HB   ASP   5          HB1       ASP   5  10.958   9.471  -4.318
   35    H    ILE   6           HN       ILE   6  11.664   8.256  -0.053
   36    HA   ILE   6           HA       ILE   6  13.660   6.558  -1.495
   37    HB   ILE   6           HB       ILE   6  13.427   7.234   1.456
   38   1HG1  ILE   6          HG1       ILE   6  13.640   9.308   0.134
   39   2HG1  ILE   6          HG1       ILE   6  15.134   8.975   1.011
   40   1HG2  ILE   6          HG2       ILE   6  15.103   5.485  -0.048
   41   2HG2  ILE   6          HG2       ILE   6  15.200   5.870   1.671
   42   3HG2  ILE   6          HG2       ILE   6  16.096   6.835   0.498
   43   1HD1  ILE   6          HD1       ILE   6  16.270   8.975  -0.927
   44   2HD1  ILE   6          HD1       ILE   6  14.775   9.291  -1.808
   45   3HD1  ILE   6          HD1       ILE   6  15.284   7.631  -1.502
   46    H    SER   7           HN       SER   7  10.877   5.768  -1.455
   47    HA   SER   7           HA       SER   7  10.694   3.647   0.600
   48   1HB   SER   7          HB2       SER   7   8.844   5.279  -0.178
   49   2HB   SER   7          HB1       SER   7   8.751   4.279  -1.625
   50    HG   SER   7           HG       SER   7   8.110   2.577  -0.413
   51    H    LYS   8           HN       LYS   8  12.810   3.134  -1.139
   52    HA   LYS   8           HA       LYS   8  12.210   1.671  -3.504
   53   1HB   LYS   8          HB2       LYS   8  14.427   1.413  -1.447
   54   2HB   LYS   8          HB1       LYS   8  14.472   0.670  -3.047
   55   1HG   LYS   8          HG2       LYS   8  13.949   3.621  -2.768
   56   2HG   LYS   8          HG1       LYS   8  15.601   3.003  -2.712
   57   1HD   LYS   8          HD2       LYS   8  15.186   1.835  -4.887
   58   2HD   LYS   8          HD1       LYS   8  13.603   2.611  -4.959
   59   1HE   LYS   8          HE2       LYS   8  14.522   4.528  -5.743
   60   2HE   LYS   8          HE1       LYS   8  15.687   4.568  -4.405
   61   1HZ   LYS   8          HZ1       LYS   8  16.924   4.250  -6.397
   62   2HZ   LYS   8          HZ2       LYS   8  15.892   3.009  -6.924
   63   3HZ   LYS   8          HZ3       LYS   8  16.908   2.761  -5.586
   64    H    THR   9           HN       THR   9  10.486   0.216  -3.244
   65    HA   THR   9           HA       THR   9  11.141  -2.334  -1.956
   66    HB   THR   9           HB       THR   9   8.959  -0.494  -0.924
   67    HG1  THR   9           HG1      THR   9  10.184  -0.426   0.878
   68   1HG2  THR   9          HG2       THR   9   8.038  -2.686  -0.888
   69   2HG2  THR   9          HG2       THR   9   8.647  -2.404   0.742
   70   3HG2  THR   9          HG2       THR   9   9.570  -3.400  -0.385
   71    H    CYS  10           HN       CYS  10  10.775  -2.810  -4.331
   72    HA   CYS  10           HA       CYS  10   8.301  -2.405  -5.672
   73   1HB   CYS  10          HB2       CYS  10  10.266  -4.716  -5.856
   74   2HB   CYS  10          HB1       CYS  10   9.125  -4.230  -7.107
   75    H    CYS  11           HN       CYS  11   6.983  -4.578  -6.322
   76    HA   CYS  11           HA       CYS  11   6.421  -6.126  -3.821
   77   1HB   CYS  11          HB2       CYS  11   4.643  -4.377  -5.491
   78   2HB   CYS  11          HB1       CYS  11   3.942  -5.772  -4.671
   79    H    PHE  12           HN       PHE  12   6.187  -8.284  -4.235
   80    HA   PHE  12           HA       PHE  12   5.573  -9.139  -7.032
   81   1HB   PHE  12          HB2       PHE  12   7.201 -11.026  -6.546
   82   2HB   PHE  12          HB1       PHE  12   7.943  -9.430  -6.634
   83    HD1  PHE  12           HD1      PHE  12   6.714 -12.053  -4.303
   84    HD2  PHE  12           HD2      PHE  12   8.979  -8.429  -4.729
   85    HE1  PHE  12           HE1      PHE  12   7.572 -12.317  -1.992
   86    HE2  PHE  12           HE2      PHE  12   9.838  -8.692  -2.418
   87    HZ   PHE  12           HZ       PHE  12   9.134 -10.637  -1.049
   88    H    GLN  13           HN       GLN  13   3.961  -8.862  -4.462
   89    HA   GLN  13           HA       GLN  13   2.718 -11.543  -4.573
   90   1HB   GLN  13          HB2       GLN  13   4.607 -11.290  -2.776
   91   2HB   GLN  13          HB1       GLN  13   3.413 -10.325  -1.907
   92   1HG   GLN  13          HG2       GLN  13   2.129 -12.135  -1.400
   93   2HG   GLN  13          HG1       GLN  13   2.396 -12.885  -2.974
   94   1HE2  GLN  13          HE2       GLN  13   3.992 -14.515  -3.108
   95   2HE2  GLN  13          HE2       GLN  13   5.015 -14.944  -1.824
   96    H    TYR  14           HN       TYR  14   0.619 -10.947  -5.029
   97    HA   TYR  14           HA       TYR  14  -0.489  -8.542  -3.650
   98   1HB   TYR  14          HB2       TYR  14  -1.370  -9.967  -6.178
   99   2HB   TYR  14          HB1       TYR  14  -2.002  -8.435  -5.576
  100    HD1  TYR  14           HD1      TYR  14   0.444  -7.061  -4.667
  101    HD2  TYR  14           HD2      TYR  14  -0.251  -9.436  -8.179
  102    HE1  TYR  14           HE1      TYR  14   2.259  -5.849  -5.847
  103    HE2  TYR  14           HE2      TYR  14   1.563  -8.225  -9.358
  104    HH   TYR  14           HH       TYR  14   3.670  -5.986  -7.679
  105    H    SER  15           HN       SER  15  -2.039  -8.926  -2.127
  106    HA   SER  15           HA       SER  15  -3.053 -11.629  -1.664
  107   1HB   SER  15          HB2       SER  15  -4.155 -10.482   0.243
  108   2HB   SER  15          HB1       SER  15  -2.451 -10.050   0.136
  109    HG   SER  15           HG       SER  15  -4.741  -8.553  -0.522
  110    H    HIS  16           HN       HIS  16  -5.429 -12.069  -1.568
  111    HA   HIS  16           HA       HIS  16  -6.955 -10.411  -3.555
  112   1HB   HIS  16          HB2       HIS  16  -6.094 -13.050  -3.722
  113   2HB   HIS  16          HB1       HIS  16  -7.777 -13.203  -3.215
  114    HD1  HIS  16           HD1      HIS  16  -5.737 -12.685  -6.167
  115    HD2  HIS  16           HD2      HIS  16  -9.581 -11.574  -4.995
  116    HE1  HIS  16           HE1      HIS  16  -6.968 -12.028  -8.280
  117    H    LYS  17           HN       LYS  17  -7.019  -9.891  -0.732
  118    HA   LYS  17           HA       LYS  17  -9.890 -10.385  -0.221
  119   1HB   LYS  17          HB2       LYS  17  -7.594 -11.643   1.156
  120   2HB   LYS  17          HB1       LYS  17  -8.823 -10.974   2.231
  121   1HG   LYS  17          HG2       LYS  17 -10.115 -12.358   0.064
  122   2HG   LYS  17          HG1       LYS  17  -8.924 -13.426   0.806
  123   1HD   LYS  17          HD2       LYS  17 -10.995 -11.853   2.364
  124   2HD   LYS  17          HD1       LYS  17 -11.185 -13.543   1.894
  125   1HE   LYS  17          HE2       LYS  17  -8.606 -13.025   3.198
  126   2HE   LYS  17          HE1       LYS  17  -9.998 -12.686   4.245
  127   1HZ   LYS  17          HZ1       LYS  17  -9.583 -15.161   2.651
  128   2HZ   LYS  17          HZ2       LYS  17 -10.944 -14.826   3.611
  129   3HZ   LYS  17          HZ3       LYS  17  -9.420 -15.033   4.334
  130    HA   PRO  18           HA       PRO  18  -9.460  -6.279   1.333
  131   1HB   PRO  18          HB2       PRO  18 -11.729  -6.118   2.849
  132   2HB   PRO  18          HB1       PRO  18 -11.748  -6.065   1.074
  133   1HG   PRO  18          HG2       PRO  18 -12.369  -8.320   2.906
  134   2HG   PRO  18          HG1       PRO  18 -13.134  -7.863   1.377
  135   1HD   PRO  18          HD2       PRO  18 -11.330  -9.903   1.623
  136   2HD   PRO  18          HD1       PRO  18 -11.595  -8.994   0.121
  137    H    LEU  19           HN       LEU  19  -8.028  -5.760   2.915
  138    HA   LEU  19           HA       LEU  19  -7.572  -7.368   5.265
  139   1HB   LEU  19          HB2       LEU  19  -6.184  -5.588   3.802
  140   2HB   LEU  19          HB1       LEU  19  -6.758  -4.492   5.054
  141    HG   LEU  19           HG       LEU  19  -4.497  -5.510   5.510
  142   1HD1  LEU  19          HD1       LEU  19  -5.099  -4.942   7.594
  143   2HD1  LEU  19          HD1       LEU  19  -5.692  -6.587   7.815
  144   3HD1  LEU  19          HD1       LEU  19  -6.789  -5.322   7.264
  145   1HD2  LEU  19          HD2       LEU  19  -5.579  -8.033   6.490
  146   2HD2  LEU  19          HD2       LEU  19  -4.169  -7.741   5.472
  147   3HD2  LEU  19          HD2       LEU  19  -5.769  -7.876   4.744
  148    HA   PRO  20           HA       PRO  20 -10.885  -5.703   7.716
  149   1HB   PRO  20          HB2       PRO  20  -9.898  -6.373  10.196
  150   2HB   PRO  20          HB1       PRO  20 -10.680  -7.538   9.109
  151   1HG   PRO  20          HG2       PRO  20  -7.766  -7.010   9.528
  152   2HG   PRO  20          HG1       PRO  20  -8.622  -8.560   9.416
  153   1HD   PRO  20          HD2       PRO  20  -7.275  -7.589   7.325
  154   2HD   PRO  20          HD1       PRO  20  -8.822  -8.434   7.101
  155    H    TRP  21           HN       TRP  21 -10.865  -3.496   7.682
  156    HA   TRP  21           HA       TRP  21  -8.828  -1.676   8.057
  157   1HB   TRP  21          HB2       TRP  21 -11.753  -1.595   8.817
  158   2HB   TRP  21          HB1       TRP  21 -10.726  -0.158   8.816
  159    HD1  TRP  21           HD1      TRP  21 -12.467  -2.603   6.514
  160    HE1  TRP  21           HE1      TRP  21 -12.215  -1.803   4.075
  161    HE3  TRP  21           HE3      TRP  21  -9.109   1.186   7.171
  162    HZ2  TRP  21           HZ2      TRP  21 -10.774   0.179   2.599
  163    HZ3  TRP  21           HZ3      TRP  21  -8.311   2.510   5.234
  164    HH2  TRP  21           HH2      TRP  21  -9.140   2.013   2.951
  165    H    THR  22           HN       THR  22 -10.453  -3.503  10.578
  166    HA   THR  22           HA       THR  22  -9.857  -1.976  12.870
  167    HB   THR  22           HB       THR  22  -9.680  -4.371  13.875
  168    HG1  THR  22           HG1      THR  22 -10.078  -5.999  12.499
  169   1HG2  THR  22          HG2       THR  22 -12.159  -3.927  12.229
  170   2HG2  THR  22          HG2       THR  22 -11.756  -2.829  13.549
  171   3HG2  THR  22          HG2       THR  22 -12.023  -4.542  13.876
  172    H    TRP  23           HN       TRP  23  -7.755  -4.079  10.939
  173    HA   TRP  23           HA       TRP  23  -5.466  -3.384  12.726
  174   1HB   TRP  23          HB2       TRP  23  -5.705  -5.609  10.680
  175   2HB   TRP  23          HB1       TRP  23  -4.468  -5.442  11.924
  176    HD1  TRP  23           HD1      TRP  23  -6.503  -4.632  14.294
  177    HE1  TRP  23           HE1      TRP  23  -7.959  -6.483  15.342
  178    HE3  TRP  23           HE3      TRP  23  -6.348  -8.100  10.547
  179    HZ2  TRP  23           HZ2      TRP  23  -8.929  -9.091  14.678
  180    HZ3  TRP  23           HZ3      TRP  23  -7.547 -10.258  10.782
  181    HH2  TRP  23           HH2      TRP  23  -8.836 -10.757  12.841
  182    H    VAL  24           HN       VAL  24  -6.820  -2.196  10.009
  183    HA   VAL  24           HA       VAL  24  -4.391  -2.118   8.332
  184    HB   VAL  24           HB       VAL  24  -7.120  -0.832   8.047
  185   1HG1  VAL  24          HG1       VAL  24  -4.755  -0.270   6.688
  186   2HG1  VAL  24          HG1       VAL  24  -6.386   0.088   6.116
  187   3HG1  VAL  24          HG1       VAL  24  -5.588  -1.406   5.627
  188   1HG2  VAL  24          HG2       VAL  24  -7.780  -2.725   6.827
  189   2HG2  VAL  24          HG2       VAL  24  -6.802  -3.444   8.106
  190   3HG2  VAL  24          HG2       VAL  24  -6.116  -3.208   6.500
  191    H    ARG  25           HN       ARG  25  -2.900  -0.501   8.510
  192    HA   ARG  25           HA       ARG  25  -3.549   1.854  10.211
  193   1HB   ARG  25          HB2       ARG  25  -1.577   0.436  10.691
  194   2HB   ARG  25          HB1       ARG  25  -0.947   0.776   9.078
  195   1HG   ARG  25          HG2       ARG  25  -0.309   2.904   9.625
  196   2HG   ARG  25          HG1       ARG  25  -1.673   3.142  10.719
  197   1HD   ARG  25          HD2       ARG  25  -0.559   2.210  12.528
  198   2HD   ARG  25          HD1       ARG  25   0.429   1.150  11.504
  199    HE   ARG  25           HE       ARG  25   1.884   3.008  11.029
  200   1HH1  ARG  25          HH2       ARG  25   0.367   3.359  13.924
  201   2HH1  ARG  25          HH2       ARG  25   0.459   5.087  14.002
  202   1HH2  ARG  25          HH1       ARG  25   1.491   5.446  10.711
  203   2HH2  ARG  25          HH1       ARG  25   1.094   6.270  12.183
  204    H    SER  26           HN       SER  26  -1.881   1.182   7.097
  205    HA   SER  26           HA       SER  26  -3.205   3.415   5.768
  206   1HB   SER  26          HB2       SER  26  -1.193   4.829   5.615
  207   2HB   SER  26          HB1       SER  26  -1.607   4.547   7.303
  208    HG   SER  26           HG       SER  26   0.326   3.142   5.764
  209    H    TYR  27           HN       TYR  27  -0.968   3.886   3.939
  210    HA   TYR  27           HA       TYR  27  -0.240   1.231   2.884
  211   1HB   TYR  27          HB2       TYR  27  -1.536   1.436   0.873
  212   2HB   TYR  27          HB1       TYR  27  -2.632   1.806   2.197
  213    HD1  TYR  27           HD1      TYR  27  -0.922   3.083  -0.746
  214    HD2  TYR  27           HD2      TYR  27  -3.217   4.191   2.710
  215    HE1  TYR  27           HE1      TYR  27  -1.365   5.301  -1.756
  216    HE2  TYR  27           HE2      TYR  27  -3.663   6.411   1.700
  217    HH   TYR  27           HH       TYR  27  -1.974   7.555  -1.045
  218    H    GLU  28           HN       GLU  28   0.549   1.901   0.368
  219    HA   GLU  28           HA       GLU  28   1.858   4.417   0.017
  220   1HB   GLU  28          HB2       GLU  28   4.205   3.576   0.523
  221   2HB   GLU  28          HB1       GLU  28   3.182   3.786   1.943
  222   1HG   GLU  28          HG2       GLU  28   2.632   1.367   1.885
  223   2HG   GLU  28          HG1       GLU  28   3.711   1.170   0.503
  224    H    PHE  29           HN       PHE  29   2.420   4.500  -2.144
  225    HA   PHE  29           HA       PHE  29   2.089   2.100  -3.780
  226   1HB   PHE  29          HB2       PHE  29   1.753   4.811  -4.085
  227   2HB   PHE  29          HB1       PHE  29   3.255   4.538  -4.967
  228    HD1  PHE  29           HD1      PHE  29  -0.296   4.375  -5.139
  229    HD2  PHE  29           HD2      PHE  29   3.275   2.489  -6.607
  230    HE1  PHE  29           HE1      PHE  29  -1.577   3.427  -7.040
  231    HE2  PHE  29           HE2      PHE  29   1.993   1.541  -8.506
  232    HZ   PHE  29           HZ       PHE  29  -0.433   2.010  -8.722
  233    H    THR  30           HN       THR  30   3.733   0.971  -4.861
  234    HA   THR  30           HA       THR  30   6.326   0.805  -3.715
  235    HB   THR  30           HB       THR  30   6.763  -0.376  -5.987
  236    HG1  THR  30           HG1      THR  30   5.177   0.747  -7.145
  237   1HG2  THR  30          HG2       THR  30   5.565  -1.189  -3.671
  238   2HG2  THR  30          HG2       THR  30   5.926  -2.258  -5.025
  239   3HG2  THR  30          HG2       THR  30   4.313  -1.568  -4.852
  240    H    SER  31           HN       SER  31   8.379   1.548  -4.531
  241    HA   SER  31           HA       SER  31   8.548   4.230  -5.387
  242   1HB   SER  31          HB2       SER  31  10.918   3.518  -5.978
  243   2HB   SER  31          HB1       SER  31  10.395   3.073  -4.356
  244    HG   SER  31           HG       SER  31  11.415   1.435  -5.916
  245    H    ASN  32           HN       ASN  32   9.575   4.930  -7.542
  246    HA   ASN  32           HA       ASN  32   7.961   3.847  -9.751
  247   1HB   ASN  32          HB2       ASN  32   9.624   6.220  -9.111
  248   2HB   ASN  32          HB1       ASN  32   9.565   5.772 -10.815
  249   1HD2  ASN  32          HD2       ASN  32   8.285   7.866 -11.046
  250   2HD2  ASN  32          HD2       ASN  32   6.620   7.831 -10.715
  251    H    SER  33           HN       SER  33  11.259   3.645  -8.594
  252    HA   SER  33           HA       SER  33  12.610   2.894 -10.983
  253   1HB   SER  33          HB2       SER  33  13.037   1.951  -8.130
  254   2HB   SER  33          HB1       SER  33  14.247   1.962  -9.410
  255    HG   SER  33           HG       SER  33  13.947   3.840  -7.774
  256    H    CYS  34           HN       CYS  34  10.407   1.113  -8.920
  257    HA   CYS  34           HA       CYS  34  11.108  -1.562  -9.632
  258   1HB   CYS  34          HB2       CYS  34   8.476  -0.241  -8.897
  259   2HB   CYS  34          HB1       CYS  34   8.728  -1.986  -8.929
  260    H    SER  35           HN       SER  35  10.210  -2.939 -11.275
  261    HA   SER  35           HA       SER  35   9.515  -1.547 -13.775
  262   1HB   SER  35          HB2       SER  35  10.648  -4.049 -12.892
  263   2HB   SER  35          HB1       SER  35   9.329  -4.368 -14.014
  264    HG   SER  35           HG       SER  35  11.463  -3.978 -14.964
  265    H    GLN  36           HN       GLN  36   7.864  -3.261 -11.221
  266    HA   GLN  36           HA       GLN  36   5.343  -3.216 -12.852
  267   1HB   GLN  36          HB2       GLN  36   6.683  -5.213 -11.169
  268   2HB   GLN  36          HB1       GLN  36   4.982  -4.995 -10.754
  269   1HG   GLN  36          HG2       GLN  36   5.972  -5.440 -13.582
  270   2HG   GLN  36          HG1       GLN  36   5.389  -6.734 -12.535
  271   1HE2  GLN  36          HE2       GLN  36   4.394  -3.915 -14.416
  272   2HE2  GLN  36          HE2       GLN  36   2.723  -4.177 -14.262
  273    H    ARG  37           HN       ARG  37   4.603  -1.159 -12.142
  274    HA   ARG  37           HA       ARG  37   4.724  -0.053  -9.561
  275   1HB   ARG  37          HB2       ARG  37   2.704   0.079 -11.810
  276   2HB   ARG  37          HB1       ARG  37   2.559   1.089 -10.371
  277   1HG   ARG  37          HG2       ARG  37   5.086   1.658 -10.890
  278   2HG   ARG  37          HG1       ARG  37   4.648   1.149 -12.521
  279   1HD   ARG  37          HD2       ARG  37   2.730   2.997 -11.194
  280   2HD   ARG  37          HD1       ARG  37   4.297   3.692 -11.655
  281    HE   ARG  37           HE       ARG  37   3.633   2.251 -13.887
  282   1HH1  ARG  37          HH2       ARG  37   0.759   2.535 -12.995
  283   2HH1  ARG  37          HH2       ARG  37   0.283   3.989 -13.807
  284   1HH2  ARG  37          HH1       ARG  37   3.532   4.991 -14.483
  285   2HH2  ARG  37          HH1       ARG  37   1.853   5.379 -14.649
  286    H    ALA  38           HN       ALA  38   3.621  -0.463  -7.652
  287    HA   ALA  38           HA       ALA  38   1.123  -2.033  -7.677
  288   1HB   ALA  38          HB1       ALA  38   3.791  -2.979  -6.630
  289   2HB   ALA  38          HB2       ALA  38   2.663  -3.832  -7.684
  290   3HB   ALA  38          HB3       ALA  38   2.284  -3.619  -5.975
  291    H    VAL  39           HN       VAL  39  -0.036  -1.815  -5.688
  292    HA   VAL  39           HA       VAL  39   0.940   0.401  -3.945
  293    HB   VAL  39           HB       VAL  39  -1.767  -0.928  -4.320
  294   1HG1  VAL  39          HG1       VAL  39  -2.678   0.724  -2.896
  295   2HG1  VAL  39          HG1       VAL  39  -1.223   1.717  -2.970
  296   3HG1  VAL  39          HG1       VAL  39  -1.216   0.207  -2.059
  297   1HG2  VAL  39          HG2       VAL  39  -1.922   0.381  -6.147
  298   2HG2  VAL  39          HG2       VAL  39  -0.321   1.051  -5.836
  299   3HG2  VAL  39          HG2       VAL  39  -1.744   1.798  -5.111
  300    H    ILE  40           HN       ILE  40   0.863   0.118  -1.607
  301    HA   ILE  40           HA       ILE  40   0.741  -2.745  -0.725
  302    HB   ILE  40           HB       ILE  40   2.658  -0.509  -0.006
  303   1HG1  ILE  40          HG1       ILE  40   3.558  -3.168  -0.962
  304   2HG1  ILE  40          HG1       ILE  40   2.732  -2.162  -2.153
  305   1HG2  ILE  40          HG2       ILE  40   1.791  -2.694   1.586
  306   2HG2  ILE  40          HG2       ILE  40   3.127  -1.588   1.908
  307   3HG2  ILE  40          HG2       ILE  40   3.415  -3.084   1.019
  308   1HD1  ILE  40          HD1       ILE  40   4.412  -0.615  -2.205
  309   2HD1  ILE  40          HD1       ILE  40   5.386  -1.969  -1.631
  310   3HD1  ILE  40          HD1       ILE  40   4.759  -0.784  -0.484
  311    H    PHE  41           HN       PHE  41  -0.582  -3.080   1.016
  312    HA   PHE  41           HA       PHE  41  -1.723  -0.698   2.417
  313   1HB   PHE  41          HB2       PHE  41  -2.566  -3.579   1.990
  314   2HB   PHE  41          HB1       PHE  41  -3.380  -2.538   3.156
  315    HD1  PHE  41           HD1      PHE  41  -4.023  -3.842   0.174
  316    HD2  PHE  41           HD2      PHE  41  -3.411   0.068   1.842
  317    HE1  PHE  41           HE1      PHE  41  -5.375  -2.851  -1.653
  318    HE2  PHE  41           HE2      PHE  41  -4.761   1.060   0.014
  319    HZ   PHE  41           HZ       PHE  41  -5.744  -0.401  -1.733
  320    H    THR  42           HN       THR  42  -0.968  -0.344   4.503
  321    HA   THR  42           HA       THR  42   0.621  -2.518   5.752
  322    HB   THR  42           HB       THR  42   0.594   0.113   7.029
  323    HG1  THR  42           HG1      THR  42   1.754   1.064   5.242
  324   1HG2  THR  42          HG2       THR  42   2.333  -1.450   7.519
  325   2HG2  THR  42          HG2       THR  42   3.073  -0.174   6.551
  326   3HG2  THR  42          HG2       THR  42   2.654  -1.715   5.806
  327    H    THR  43           HN       THR  43   0.122  -3.303   7.809
  328    HA   THR  43           HA       THR  43  -2.622  -2.727   8.776
  329    HB   THR  43           HB       THR  43  -2.183  -4.805  10.103
  330    HG1  THR  43           HG1      THR  43  -0.229  -5.555  10.225
  331   1HG2  THR  43          HG2       THR  43  -1.507  -4.980   7.153
  332   2HG2  THR  43          HG2       THR  43  -3.131  -4.961   7.838
  333   3HG2  THR  43          HG2       THR  43  -2.056  -6.322   8.158
  334    H    LYS  44           HN       LYS  44  -2.389  -3.346  11.454
  335    HA   LYS  44           HA       LYS  44  -1.060  -0.931  12.515
  336   1HB   LYS  44          HB2       LYS  44  -3.351  -2.509  13.061
  337   2HB   LYS  44          HB1       LYS  44  -2.311  -2.629  14.479
  338   1HG   LYS  44          HG2       LYS  44  -2.576  -0.432  15.021
  339   2HG   LYS  44          HG1       LYS  44  -2.548   0.087  13.335
  340   1HD   LYS  44          HD2       LYS  44  -4.910  -1.518  13.985
  341   2HD   LYS  44          HD1       LYS  44  -4.806  -0.039  14.941
  342   1HE   LYS  44          HE2       LYS  44  -4.095   0.539  12.198
  343   2HE   LYS  44          HE1       LYS  44  -5.681  -0.255  12.261
  344   1HZ   LYS  44          HZ1       LYS  44  -4.788   2.183  13.677
  345   2HZ   LYS  44          HZ2       LYS  44  -6.109   1.274  14.239
  346   3HZ   LYS  44          HZ3       LYS  44  -6.153   1.976  12.693
  347    H    ARG  45           HN       ARG  45  -0.587  -4.407  12.476
  348    HA   ARG  45           HA       ARG  45   1.280  -4.442  14.731
  349   1HB   ARG  45          HB2       ARG  45  -0.262  -6.299  13.835
  350   2HB   ARG  45          HB1       ARG  45   0.931  -6.511  12.552
  351   1HG   ARG  45          HG2       ARG  45   1.769  -8.011  14.099
  352   2HG   ARG  45          HG1       ARG  45   2.614  -6.552  14.619
  353   1HD   ARG  45          HD2       ARG  45   0.254  -6.312  16.001
  354   2HD   ARG  45          HD1       ARG  45   0.490  -8.072  15.998
  355    HE   ARG  45           HE       ARG  45   2.398  -6.084  17.122
  356   1HH1  ARG  45          HH2       ARG  45   2.907  -8.943  15.622
  357   2HH1  ARG  45          HH2       ARG  45   3.443  -9.828  17.011
  358   1HH2  ARG  45          HH1       ARG  45   2.476  -7.382  19.271
  359   2HH2  ARG  45          HH1       ARG  45   3.198  -8.943  19.078
  360    H    GLY  46           HN       GLY  46   1.484  -3.941  11.277
  361   1HA   GLY  46          HA2       GLY  46   3.577  -2.732  10.560
  362   2HA   GLY  46          HA1       GLY  46   4.468  -3.920  11.511
  363    H    LYS  47           HN       LYS  47   1.788  -5.306   9.922
  364    HA   LYS  47           HA       LYS  47   3.580  -6.758   8.099
  365   1HB   LYS  47          HB2       LYS  47   1.198  -7.227   9.527
  366   2HB   LYS  47          HB1       LYS  47   0.739  -7.278   7.825
  367   1HG   LYS  47          HG2       LYS  47   2.598  -8.875   7.396
  368   2HG   LYS  47          HG1       LYS  47   2.974  -8.867   9.120
  369   1HD   LYS  47          HD2       LYS  47   1.469 -10.522   9.377
  370   2HD   LYS  47          HD1       LYS  47   0.210  -9.355   8.975
  371   1HE   LYS  47          HE2       LYS  47   0.703  -9.872   6.513
  372   2HE   LYS  47          HE1       LYS  47   1.643 -11.257   7.102
  373   1HZ   LYS  47          HZ1       LYS  47  -0.276 -11.987   8.370
  374   2HZ   LYS  47          HZ2       LYS  47  -0.677 -11.867   6.723
  375   3HZ   LYS  47          HZ3       LYS  47  -1.183 -10.667   7.813
  376    H    LYS  48           HN       LYS  48   4.141  -5.221   6.463
  377    HA   LYS  48           HA       LYS  48   2.084  -3.631   5.114
  378   1HB   LYS  48          HB2       LYS  48   4.903  -4.210   4.170
  379   2HB   LYS  48          HB1       LYS  48   3.938  -2.766   3.876
  380   1HG   LYS  48          HG2       LYS  48   4.064  -2.949   6.663
  381   2HG   LYS  48          HG1       LYS  48   5.685  -3.387   6.123
  382   1HD   LYS  48          HD2       LYS  48   4.339  -1.014   4.878
  383   2HD   LYS  48          HD1       LYS  48   5.046  -0.847   6.486
  384   1HE   LYS  48          HE2       LYS  48   6.688  -2.152   4.334
  385   2HE   LYS  48          HE1       LYS  48   6.540  -0.383   4.350
  386   1HZ   LYS  48          HZ1       LYS  48   8.367  -1.427   5.783
  387   2HZ   LYS  48          HZ2       LYS  48   7.109  -1.893   6.825
  388   3HZ   LYS  48          HZ3       LYS  48   7.381  -0.248   6.499
  389    H    VAL  49           HN       VAL  49   0.705  -4.596   3.665
  390    HA   VAL  49           HA       VAL  49   1.615  -7.065   2.252
  391    HB   VAL  49           HB       VAL  49  -1.132  -5.799   2.503
  392   1HG1  VAL  49          HG1       VAL  49  -1.909  -8.064   1.891
  393   2HG1  VAL  49          HG1       VAL  49  -0.234  -8.594   1.734
  394   3HG1  VAL  49          HG1       VAL  49  -0.883  -7.383   0.629
  395   1HG2  VAL  49          HG2       VAL  49   0.497  -7.197   4.441
  396   2HG2  VAL  49          HG2       VAL  49  -0.923  -8.166   4.046
  397   3HG2  VAL  49          HG2       VAL  49  -1.119  -6.517   4.643
  398    H    CYS  50           HN       CYS  50   2.002  -7.035   0.067
  399    HA   CYS  50           HA       CYS  50   1.832  -4.508  -1.418
  400   1HB   CYS  50          HB2       CYS  50   2.802  -7.323  -1.904
  401   2HB   CYS  50          HB1       CYS  50   2.678  -6.188  -3.246
  402    H    THR  51           HN       THR  51   0.656  -4.367  -3.492
  403    HA   THR  51           HA       THR  51  -1.404  -6.368  -4.106
  404    HB   THR  51           HB       THR  51  -3.096  -4.295  -3.847
  405    HG1  THR  51           HG1      THR  51  -1.353  -2.975  -3.058
  406   1HG2  THR  51          HG2       THR  51  -2.441  -5.605  -1.263
  407   2HG2  THR  51          HG2       THR  51  -2.778  -6.676  -2.622
  408   3HG2  THR  51          HG2       THR  51  -3.983  -5.495  -2.110
  409    H    HIS  52           HN       HIS  52  -2.960  -5.149  -5.863
  410    HA   HIS  52           HA       HIS  52  -1.100  -3.713  -7.709
  411   1HB   HIS  52          HB2       HIS  52  -2.276  -6.176  -7.981
  412   2HB   HIS  52          HB1       HIS  52  -3.430  -5.138  -8.819
  413    HD1  HIS  52           HD1      HIS  52   0.354  -4.767  -8.688
  414    HD2  HIS  52           HD2      HIS  52  -2.666  -5.490 -11.469
  415    HE1  HIS  52           HE1      HIS  52   1.458  -4.743 -10.967
  416    HA   PRO  53           HA       PRO  53  -4.103  -0.460  -7.586
  417   1HB   PRO  53          HB2       PRO  53  -3.330   0.908  -9.824
  418   2HB   PRO  53          HB1       PRO  53  -2.417   0.952  -8.303
  419   1HG   PRO  53          HG2       PRO  53  -1.890  -0.601 -10.783
  420   2HG   PRO  53          HG1       PRO  53  -0.752   0.186  -9.679
  421   1HD   PRO  53          HD2       PRO  53  -1.252  -2.504  -9.693
  422   2HD   PRO  53          HD1       PRO  53  -0.683  -1.607  -8.268
  423    H    ARG  54           HN       ARG  54  -3.750  -2.677 -10.237
  424    HA   ARG  54           HA       ARG  54  -5.801  -1.772 -11.999
  425   1HB   ARG  54          HB2       ARG  54  -4.308  -4.266 -11.381
  426   2HB   ARG  54          HB1       ARG  54  -5.809  -4.470 -12.284
  427   1HG   ARG  54          HG2       ARG  54  -4.205  -4.143 -13.976
  428   2HG   ARG  54          HG1       ARG  54  -4.917  -2.541 -13.778
  429   1HD   ARG  54          HD2       ARG  54  -3.044  -1.967 -12.193
  430   2HD   ARG  54          HD1       ARG  54  -2.290  -3.519 -12.609
  431    HE   ARG  54           HE       ARG  54  -3.064  -1.857 -14.912
  432   1HH1  ARG  54          HH1       ARG  54  -0.861  -0.858 -12.824
  433   2HH1  ARG  54          HH1       ARG  54   0.556  -1.233 -13.747
  434   1HH2  ARG  54          HH2       ARG  54  -1.139  -3.196 -16.049
  435   2HH2  ARG  54          HH2       ARG  54   0.398  -2.557 -15.571
  436    H    LYS  55           HN       LYS  55  -5.942  -3.811  -9.087
  437    HA   LYS  55           HA       LYS  55  -8.716  -4.564  -9.379
  438   1HB   LYS  55          HB2       LYS  55  -6.492  -4.835  -7.513
  439   2HB   LYS  55          HB1       LYS  55  -8.026  -4.618  -6.668
  440   1HG   LYS  55          HG2       LYS  55  -8.587  -6.746  -7.124
  441   2HG   LYS  55          HG1       LYS  55  -8.459  -6.414  -8.852
  442   1HD   LYS  55          HD2       LYS  55  -6.020  -6.962  -7.157
  443   2HD   LYS  55          HD1       LYS  55  -6.938  -8.265  -7.913
  444   1HE   LYS  55          HE2       LYS  55  -6.255  -6.001  -9.708
  445   2HE   LYS  55          HE1       LYS  55  -4.888  -6.999  -9.169
  446   1HZ   LYS  55          HZ1       LYS  55  -5.872  -8.929  -9.972
  447   2HZ   LYS  55          HZ2       LYS  55  -6.218  -7.798 -11.192
  448   3HZ   LYS  55          HZ3       LYS  55  -7.416  -8.234 -10.069
  449    H    LYS  56           HN       LYS  56 -10.494  -3.310  -8.996
  450    HA   LYS  56           HA       LYS  56 -10.347  -0.551  -8.271
  451   1HB   LYS  56          HB2       LYS  56 -12.158  -2.130  -9.435
  452   2HB   LYS  56          HB1       LYS  56 -12.812  -2.181  -7.797
  453   1HG   LYS  56          HG2       LYS  56 -13.884  -0.325  -8.830
  454   2HG   LYS  56          HG1       LYS  56 -12.627   0.380  -7.813
  455   1HD   LYS  56          HD2       LYS  56 -12.458   1.483  -9.930
  456   2HD   LYS  56          HD1       LYS  56 -11.118   0.338  -9.867
  457   1HE   LYS  56          HE2       LYS  56 -13.215  -1.167 -10.931
  458   2HE   LYS  56          HE1       LYS  56 -13.373   0.415 -11.719
  459   1HZ   LYS  56          HZ1       LYS  56 -11.753  -1.086 -12.826
  460   2HZ   LYS  56          HZ2       LYS  56 -10.802  -1.041 -11.418
  461   3HZ   LYS  56          HZ3       LYS  56 -11.076   0.380 -12.308
  462    H    TRP  57           HN       TRP  57 -11.084  -3.461  -6.333
  463    HA   TRP  57           HA       TRP  57 -11.896  -2.179  -3.949
  464   1HB   TRP  57          HB2       TRP  57 -11.812  -4.330  -3.118
  465   2HB   TRP  57          HB1       TRP  57 -11.631  -4.719  -4.824
  466    HD1  TRP  57           HD1      TRP  57  -9.404  -5.811  -5.585
  467    HE1  TRP  57           HE1      TRP  57  -7.261  -6.556  -4.359
  468    HE3  TRP  57           HE3      TRP  57 -10.209  -3.667  -1.022
  469    HZ2  TRP  57           HZ2      TRP  57  -6.050  -6.271  -1.782
  470    HZ3  TRP  57           HZ3      TRP  57  -8.548  -3.920   0.799
  471    HH2  TRP  57           HH2      TRP  57  -6.471  -5.221   0.425
  472    H    VAL  58           HN       VAL  58  -8.675  -2.623  -5.306
  473    HA   VAL  58           HA       VAL  58  -7.166  -1.928  -2.942
  474    HB   VAL  58           HB       VAL  58  -6.604  -1.735  -5.913
  475   1HG1  VAL  58          HG1       VAL  58  -4.171  -1.989  -4.926
  476   2HG1  VAL  58          HG1       VAL  58  -4.900  -1.276  -3.488
  477   3HG1  VAL  58          HG1       VAL  58  -4.923  -0.398  -5.017
  478   1HG2  VAL  58          HG2       VAL  58  -6.050  -3.944  -5.840
  479   2HG2  VAL  58          HG2       VAL  58  -7.065  -3.968  -4.399
  480   3HG2  VAL  58          HG2       VAL  58  -5.317  -3.802  -4.242
  481    H    GLN  59           HN       GLN  59  -8.095  -0.025  -5.838
  482    HA   GLN  59           HA       GLN  59  -7.079   2.485  -4.997
  483   1HB   GLN  59          HB2       GLN  59  -9.426   1.619  -6.711
  484   2HB   GLN  59          HB1       GLN  59  -8.939   3.308  -6.563
  485   1HG   GLN  59          HG2       GLN  59  -6.842   1.280  -7.232
  486   2HG   GLN  59          HG1       GLN  59  -7.958   1.783  -8.502
  487   1HE2  GLN  59          HE2       GLN  59  -7.418   3.697  -9.577
  488   2HE2  GLN  59          HE2       GLN  59  -6.322   4.857  -8.997
  489    H    LYS  60           HN       LYS  60  -9.871   0.654  -3.998
  490    HA   LYS  60           HA       LYS  60 -11.282   2.876  -2.765
  491   1HB   LYS  60          HB2       LYS  60 -12.404   0.858  -3.599
  492   2HB   LYS  60          HB1       LYS  60 -11.462  -0.141  -2.491
  493   1HG   LYS  60          HG2       LYS  60 -12.455   1.266  -0.602
  494   2HG   LYS  60          HG1       LYS  60 -13.582   1.901  -1.800
  495   1HD   LYS  60          HD2       LYS  60 -13.543  -0.919  -2.122
  496   2HD   LYS  60          HD1       LYS  60 -13.695  -0.602  -0.394
  497   1HE   LYS  60          HE2       LYS  60 -15.449   1.240  -1.375
  498   2HE   LYS  60          HE1       LYS  60 -15.621  -0.054  -2.579
  499   1HZ   LYS  60          HZ1       LYS  60 -16.046  -1.634  -0.902
  500   2HZ   LYS  60          HZ2       LYS  60 -17.021  -0.299  -0.512
  501   3HZ   LYS  60          HZ3       LYS  60 -15.577  -0.577   0.339
  502    H    TYR  61           HN       TYR  61  -9.021   0.340  -1.706
  503    HA   TYR  61           HA       TYR  61  -9.229   1.036   1.121
  504   1HB   TYR  61          HB2       TYR  61  -7.785  -0.833  -0.652
  505   2HB   TYR  61          HB1       TYR  61  -6.891  -0.362   0.793
  506    HD1  TYR  61           HD1      TYR  61  -7.160  -1.786   2.608
  507    HD2  TYR  61           HD2      TYR  61 -10.464  -1.161  -0.065
  508    HE1  TYR  61           HE1      TYR  61  -8.557  -3.313   3.976
  509    HE2  TYR  61           HE2      TYR  61 -11.860  -2.689   1.301
  510    HH   TYR  61           HH       TYR  61 -11.138  -3.580   4.372
  511    H    ILE  62           HN       ILE  62  -7.374   2.167  -1.607
  512    HA   ILE  62           HA       ILE  62  -5.243   3.405  -0.039
  513    HB   ILE  62           HB       ILE  62  -6.226   3.739  -2.894
  514   1HG1  ILE  62          HG1       ILE  62  -3.837   2.209  -1.827
  515   2HG1  ILE  62          HG1       ILE  62  -5.393   1.458  -2.180
  516   1HG2  ILE  62          HG2       ILE  62  -4.471   5.379  -1.443
  517   2HG2  ILE  62          HG2       ILE  62  -4.649   5.323  -3.197
  518   3HG2  ILE  62          HG2       ILE  62  -3.425   4.332  -2.404
  519   1HD1  ILE  62          HD1       ILE  62  -5.178   2.508  -4.519
  520   2HD1  ILE  62          HD1       ILE  62  -4.117   1.147  -4.157
  521   3HD1  ILE  62          HD1       ILE  62  -3.487   2.793  -4.104
  522    H    SER  63           HN       SER  63  -8.212   4.522  -1.671
  523    HA   SER  63           HA       SER  63  -7.869   7.306  -0.916
  524   1HB   SER  63          HB2       SER  63 -10.362   5.781  -1.727
  525   2HB   SER  63          HB1       SER  63 -10.085   7.512  -1.890
  526    HG   SER  63           HG       SER  63  -9.491   5.594  -3.604
  527    H    LEU  64           HN       LEU  64  -9.264   4.473   0.597
  528    HA   LEU  64           HA       LEU  64 -10.824   5.998   2.566
  529   1HB   LEU  64          HB2       LEU  64 -10.249   3.161   1.841
  530   2HB   LEU  64          HB1       LEU  64 -10.782   3.474   3.493
  531    HG   LEU  64           HG       LEU  64 -12.241   4.563   1.077
  532   1HD1  LEU  64          HD1       LEU  64 -13.727   2.693   1.169
  533   2HD1  LEU  64          HD1       LEU  64 -13.009   2.108   2.669
  534   3HD1  LEU  64          HD1       LEU  64 -12.102   2.011   1.161
  535   1HD2  LEU  64          HD2       LEU  64 -14.107   4.623   2.804
  536   2HD2  LEU  64          HD2       LEU  64 -12.773   5.734   3.112
  537   3HD2  LEU  64          HD2       LEU  64 -12.892   4.226   4.018
  538    H    LEU  65           HN       LEU  65  -7.905   3.907   2.667
  539    HA   LEU  65           HA       LEU  65  -7.257   4.139   5.384
  540   1HB   LEU  65          HB2       LEU  65  -5.879   3.632   2.824
  541   2HB   LEU  65          HB1       LEU  65  -4.819   4.199   4.114
  542    HG   LEU  65           HG       LEU  65  -6.719   1.841   4.298
  543   1HD1  LEU  65          HD1       LEU  65  -4.221   0.879   4.774
  544   2HD1  LEU  65          HD1       LEU  65  -3.854   2.159   3.618
  545   3HD1  LEU  65          HD1       LEU  65  -4.975   0.871   3.178
  546   1HD2  LEU  65          HD2       LEU  65  -5.143   3.394   6.278
  547   2HD2  LEU  65          HD2       LEU  65  -5.051   1.639   6.425
  548   3HD2  LEU  65          HD2       LEU  65  -6.615   2.449   6.504
  549    H    LYS  66           HN       LYS  66  -6.614   6.447   2.769
  550    HA   LYS  66           HA       LYS  66  -6.068   8.529   4.818
  551   1HB   LYS  66          HB2       LYS  66  -4.048   7.179   3.588
  552   2HB   LYS  66          HB1       LYS  66  -4.290   8.501   2.446
  553   1HG   LYS  66          HG2       LYS  66  -3.490  10.064   3.893
  554   2HG   LYS  66          HG1       LYS  66  -4.284   9.319   5.282
  555   1HD   LYS  66          HD2       LYS  66  -2.544   7.733   5.569
  556   2HD   LYS  66          HD1       LYS  66  -1.883   8.047   3.963
  557   1HE   LYS  66          HE2       LYS  66  -0.504   9.599   4.864
  558   2HE   LYS  66          HE1       LYS  66  -1.921  10.530   5.391
  559   1HZ   LYS  66          HZ1       LYS  66  -2.092   8.796   7.230
  560   2HZ   LYS  66          HZ2       LYS  66  -0.856   9.953   7.372
  561   3HZ   LYS  66          HZ3       LYS  66  -0.495   8.381   6.840
  562    H    THR  67           HN       THR  67  -5.765  10.731   3.507
  563    HA   THR  67           HA       THR  67  -8.188  11.117   1.948
  564    HB   THR  67           HB       THR  67  -7.193  12.770   3.520
  565    HG1  THR  67           HG1      THR  67  -8.227  14.068   2.260
  566   1HG2  THR  67          HG2       THR  67  -5.045  13.475   3.372
  567   2HG2  THR  67          HG2       THR  67  -5.133  13.653   1.620
  568   3HG2  THR  67          HG2       THR  67  -4.810  12.071   2.331
  569    HA   PRO  68           HA       PRO  68  -6.454  10.292  -2.031
  570   1HB   PRO  68          HB2       PRO  68  -8.193  11.729  -3.582
  571   2HB   PRO  68          HB1       PRO  68  -8.626  10.185  -2.821
  572   1HG   PRO  68          HG2       PRO  68  -9.263  12.964  -1.959
  573   2HG   PRO  68          HG1       PRO  68 -10.274  11.511  -1.920
  574   1HD   PRO  68          HD2       PRO  68  -9.013  12.510   0.275
  575   2HD   PRO  68          HD1       PRO  68  -9.382  10.784   0.063
  576    H    LYS  69           HN       LYS  69  -5.175  11.369  -3.661
  577    HA   LYS  69           HA       LYS  69  -3.969  13.879  -2.814
  578   1HB   LYS  69          HB2       LYS  69  -3.496  11.680  -4.626
  579   2HB   LYS  69          HB1       LYS  69  -3.244  13.208  -5.472
  580   1HG   LYS  69          HG2       LYS  69  -1.463  13.810  -4.149
  581   2HG   LYS  69          HG1       LYS  69  -2.105  12.983  -2.728
  582   1HD   LYS  69          HD2       LYS  69  -1.040  11.045  -3.230
  583   2HD   LYS  69          HD1       LYS  69  -1.433  11.171  -4.944
  584   1HE   LYS  69          HE2       LYS  69   0.569  12.145  -5.445
  585   2HE   LYS  69          HE1       LYS  69   0.523  13.179  -4.004
  586   1HZ   LYS  69          HZ1       LYS  69   0.972  11.176  -2.659
  587   2HZ   LYS  69          HZ2       LYS  69   2.244  11.547  -3.721
  588   3HZ   LYS  69          HZ3       LYS  69   1.172  10.281  -4.085
  589    H    GLN  70           HN       GLN  70  -3.553  15.239  -5.198
  590    HA   GLN  70           HA       GLN  70  -6.280  15.913  -6.227
  591   1HB   GLN  70          HB2       GLN  70  -4.448  17.471  -4.533
  592   2HB   GLN  70          HB1       GLN  70  -5.002  18.349  -5.959
  593   1HG   GLN  70          HG2       GLN  70  -6.816  16.922  -3.990
  594   2HG   GLN  70          HG1       GLN  70  -6.528  18.662  -4.020
  595   1HE2  GLN  70          HE2       GLN  70  -9.156  17.719  -4.417
  596   2HE2  GLN  70          HE2       GLN  70  -9.607  17.972  -6.033
  597    H    LEU  71           HN       LEU  71  -6.186  17.082  -8.295
  598    HA   LEU  71           HA       LEU  71  -3.809  16.315  -9.896
  599   1HB   LEU  71          HB2       LEU  71  -6.581  16.366 -10.256
  600   2HB   LEU  71          HB1       LEU  71  -5.994  17.699 -11.251
  601    HG   LEU  71           HG       LEU  71  -4.166  15.848 -11.922
  602   1HD1  LEU  71          HD1       LEU  71  -6.090  13.845 -12.218
  603   2HD1  LEU  71          HD1       LEU  71  -6.294  14.400 -10.556
  604   3HD1  LEU  71          HD1       LEU  71  -4.722  13.817 -11.106
  605   1HD2  LEU  71          HD2       LEU  71  -5.667  15.315 -13.876
  606   2HD2  LEU  71          HD2       LEU  71  -5.535  17.040 -13.532
  607   3HD2  LEU  71          HD2       LEU  71  -6.972  16.149 -13.032
  Start of MODEL   10
    1   1H    THR   1          HT1       THR   1  12.129  20.016  -0.224
    2   2H    THR   1          HT2       THR   1  13.058  20.642  -1.502
    3   3H    THR   1          HT3       THR   1  13.774  19.621  -0.348
    4    HA   THR   1           HA       THR   1  11.853  18.903  -2.489
    5    HB   THR   1           HB       THR   1  14.416  17.557  -1.665
    6    HG1  THR   1           HG1      THR   1  14.116  19.948  -3.154
    7   1HG2  THR   1          HG2       THR   1  13.395  16.381  -3.401
    8   2HG2  THR   1          HG2       THR   1  14.461  17.470  -4.289
    9   3HG2  THR   1          HG2       THR   1  12.745  17.844  -4.143
   10    H    ARG   2           HN       ARG   2  13.620  17.472   0.291
   11    HA   ARG   2           HA       ARG   2  11.203  16.180   1.305
   12   1HB   ARG   2          HB2       ARG   2  11.966  13.886   0.786
   13   2HB   ARG   2          HB1       ARG   2  11.756  14.822  -0.692
   14   1HG   ARG   2          HG2       ARG   2  14.099  15.151  -0.943
   15   2HG   ARG   2          HG1       ARG   2  14.426  14.626   0.708
   16   1HD   ARG   2          HD2       ARG   2  14.669  12.496  -0.014
   17   2HD   ARG   2          HD1       ARG   2  13.018  12.523  -0.663
   18    HE   ARG   2           HE       ARG   2  15.019  13.943  -2.290
   19   1HH1  ARG   2          HH2       ARG   2  15.839  11.077  -2.268
   20   2HH1  ARG   2          HH2       ARG   2  14.919  10.417  -3.579
   21   1HH2  ARG   2          HH1       ARG   2  12.714  13.086  -3.730
   22   2HH2  ARG   2          HH1       ARG   2  13.154  11.553  -4.406
   23    H    GLY   3           HN       GLY   3  12.051  14.380   3.003
   24   1HA   GLY   3          HA2       GLY   3  14.381  15.605   4.429
   25   2HA   GLY   3          HA1       GLY   3  12.980  14.942   5.271
   26    H    SER   4           HN       SER   4  12.549  12.549   4.085
   27    HA   SER   4           HA       SER   4  14.985  11.016   3.643
   28   1HB   SER   4          HB2       SER   4  13.681  11.221   6.340
   29   2HB   SER   4          HB1       SER   4  14.442   9.702   5.872
   30    HG   SER   4           HG       SER   4  16.119  10.771   6.666
   31    H    ASP   5           HN       ASP   5  14.430   9.043   2.690
   32    HA   ASP   5           HA       ASP   5  11.926   7.675   3.205
   33   1HB   ASP   5          HB2       ASP   5  11.525   9.886   1.784
   34   2HB   ASP   5          HB1       ASP   5  12.055   8.856   0.454
   35    H    ILE   6           HN       ILE   6  13.289   5.811   3.270
   36    HA   ILE   6           HA       ILE   6  14.503   5.024   0.637
   37    HB   ILE   6           HB       ILE   6  15.286   4.185   3.450
   38   1HG1  ILE   6          HG1       ILE   6  17.309   5.749   2.236
   39   2HG1  ILE   6          HG1       ILE   6  15.801   6.634   2.003
   40   1HG2  ILE   6          HG2       ILE   6  16.165   2.534   2.086
   41   2HG2  ILE   6          HG2       ILE   6  17.463   3.725   1.991
   42   3HG2  ILE   6          HG2       ILE   6  16.280   3.603   0.688
   43   1HD1  ILE   6          HD1       ILE   6  17.172   6.956   4.230
   44   2HD1  ILE   6          HD1       ILE   6  16.402   5.438   4.691
   45   3HD1  ILE   6          HD1       ILE   6  15.413   6.844   4.292
   46    H    SER   7           HN       SER   7  11.786   4.507   1.091
   47    HA   SER   7           HA       SER   7  11.539   1.762   2.149
   48   1HB   SER   7          HB2       SER   7   9.180   2.209   1.964
   49   2HB   SER   7          HB1       SER   7   9.932   3.687   2.558
   50    HG   SER   7           HG       SER   7   9.961   4.411   0.363
   51    H    LYS   8           HN       LYS   8  13.170   1.952  -0.221
   52    HA   LYS   8           HA       LYS   8  11.713   1.446  -2.638
   53   1HB   LYS   8          HB2       LYS   8  14.477   0.748  -1.616
   54   2HB   LYS   8          HB1       LYS   8  13.962   0.367  -3.260
   55   1HG   LYS   8          HG2       LYS   8  13.233   2.910  -3.284
   56   2HG   LYS   8          HG1       LYS   8  14.430   3.043  -1.995
   57   1HD   LYS   8          HD2       LYS   8  16.180   2.222  -3.409
   58   2HD   LYS   8          HD1       LYS   8  15.030   1.723  -4.650
   59   1HE   LYS   8          HE2       LYS   8  14.631   4.521  -4.093
   60   2HE   LYS   8          HE1       LYS   8  16.344   4.231  -4.451
   61   1HZ   LYS   8          HZ1       LYS   8  15.667   2.918  -6.380
   62   2HZ   LYS   8          HZ2       LYS   8  15.099   4.515  -6.499
   63   3HZ   LYS   8          HZ3       LYS   8  14.037   3.264  -6.059
   64    H    THR   9           HN       THR   9  10.019  -0.040  -1.957
   65    HA   THR   9           HA       THR   9  10.995  -2.863  -1.697
   66    HB   THR   9           HB       THR   9   8.476  -1.867  -0.393
   67    HG1  THR   9           HG1      THR   9  11.090  -1.678   0.694
   68   1HG2  THR   9          HG2       THR   9  10.205  -3.674   1.081
   69   2HG2  THR   9          HG2       THR   9   9.846  -4.299  -0.528
   70   3HG2  THR   9          HG2       THR   9   8.530  -3.895   0.575
   71    H    CYS  10           HN       CYS  10  10.585  -3.093  -4.017
   72    HA   CYS  10           HA       CYS  10   8.189  -2.432  -5.372
   73   1HB   CYS  10          HB2       CYS  10  10.059  -4.799  -5.720
   74   2HB   CYS  10          HB1       CYS  10   8.964  -4.171  -6.950
   75    H    CYS  11           HN       CYS  11   6.734  -4.355  -6.283
   76    HA   CYS  11           HA       CYS  11   5.986  -6.166  -4.017
   77   1HB   CYS  11          HB2       CYS  11   4.324  -4.259  -5.665
   78   2HB   CYS  11          HB1       CYS  11   3.587  -5.611  -4.807
   79    H    PHE  12           HN       PHE  12   6.038  -8.248  -4.756
   80    HA   PHE  12           HA       PHE  12   5.513  -8.736  -7.655
   81   1HB   PHE  12          HB2       PHE  12   6.869 -10.849  -7.171
   82   2HB   PHE  12          HB1       PHE  12   7.759  -9.332  -7.070
   83    HD1  PHE  12           HD1      PHE  12   5.712 -11.609  -4.886
   84    HD2  PHE  12           HD2      PHE  12   9.061  -8.934  -5.186
   85    HE1  PHE  12           HE1      PHE  12   6.327 -12.112  -2.536
   86    HE2  PHE  12           HE2      PHE  12   9.675  -9.438  -2.838
   87    HZ   PHE  12           HZ       PHE  12   8.308 -11.027  -1.512
   88    H    GLN  13           HN       GLN  13   4.344  -9.309  -4.474
   89    HA   GLN  13           HA       GLN  13   2.483 -11.388  -5.543
   90   1HB   GLN  13          HB2       GLN  13   4.279 -11.296  -3.192
   91   2HB   GLN  13          HB1       GLN  13   2.662 -11.927  -2.876
   92   1HG   GLN  13          HG2       GLN  13   3.794 -12.977  -5.356
   93   2HG   GLN  13          HG1       GLN  13   4.784 -13.367  -3.951
   94   1HE2  GLN  13          HE2       GLN  13   1.208 -13.092  -4.404
   95   2HE2  GLN  13          HE2       GLN  13   0.866 -14.625  -3.763
   96    H    TYR  14           HN       TYR  14   0.327 -10.917  -5.191
   97    HA   TYR  14           HA       TYR  14  -0.293  -8.577  -3.441
   98   1HB   TYR  14          HB2       TYR  14  -1.777  -9.785  -5.796
   99   2HB   TYR  14          HB1       TYR  14  -2.256  -8.329  -4.928
  100    HD1  TYR  14           HD1      TYR  14   0.489  -7.127  -4.478
  101    HD2  TYR  14           HD2      TYR  14  -1.303  -8.905  -7.955
  102    HE1  TYR  14           HE1      TYR  14   1.972  -5.775  -5.934
  103    HE2  TYR  14           HE2      TYR  14   0.182  -7.552  -9.411
  104    HH   TYR  14           HH       TYR  14   2.856  -6.246  -8.603
  105    H    SER  15           HN       SER  15  -2.043  -8.770  -1.965
  106    HA   SER  15           HA       SER  15  -2.613 -11.478  -1.019
  107   1HB   SER  15          HB2       SER  15  -3.861 -10.182   0.717
  108   2HB   SER  15          HB1       SER  15  -2.215  -9.592   0.494
  109    HG   SER  15           HG       SER  15  -3.213  -7.754   0.201
  110    H    HIS  16           HN       HIS  16  -4.302  -8.972  -2.848
  111    HA   HIS  16           HA       HIS  16  -6.407  -9.001  -3.926
  112   1HB   HIS  16          HB2       HIS  16  -5.069 -11.047  -4.794
  113   2HB   HIS  16          HB1       HIS  16  -6.122 -12.004  -3.752
  114    HD1  HIS  16           HD1      HIS  16  -7.225  -8.945  -5.694
  115    HD2  HIS  16           HD2      HIS  16  -7.771 -13.078  -5.753
  116    HE1  HIS  16           HE1      HIS  16  -9.054  -9.402  -7.385
  117    H    LYS  17           HN       LYS  17  -6.901  -8.461  -1.379
  118    HA   LYS  17           HA       LYS  17  -9.449  -9.709  -0.808
  119   1HB   LYS  17          HB2       LYS  17  -7.140 -11.097  -0.001
  120   2HB   LYS  17          HB1       LYS  17  -7.748 -10.331   1.468
  121   1HG   LYS  17          HG2       LYS  17  -9.582 -11.664   1.542
  122   2HG   LYS  17          HG1       LYS  17  -9.856 -11.529  -0.196
  123   1HD   LYS  17          HD2       LYS  17  -7.440 -13.040   0.343
  124   2HD   LYS  17          HD1       LYS  17  -8.823 -13.756   1.172
  125   1HE   LYS  17          HE2       LYS  17 -10.038 -13.383  -1.146
  126   2HE   LYS  17          HE1       LYS  17  -8.378 -13.378  -1.775
  127   1HZ   LYS  17          HZ1       LYS  17  -9.267 -15.425   0.160
  128   2HZ   LYS  17          HZ2       LYS  17  -7.955 -15.480  -0.918
  129   3HZ   LYS  17          HZ3       LYS  17  -9.544 -15.631  -1.501
  130    HA   PRO  18           HA       PRO  18  -9.642  -5.886   1.395
  131   1HB   PRO  18          HB2       PRO  18 -11.894  -6.331   2.882
  132   2HB   PRO  18          HB1       PRO  18 -11.939  -5.990   1.141
  133   1HG   PRO  18          HG2       PRO  18 -12.181  -8.586   2.567
  134   2HG   PRO  18          HG1       PRO  18 -13.026  -8.006   1.125
  135   1HD   PRO  18          HD2       PRO  18 -10.926  -9.756   1.054
  136   2HD   PRO  18          HD1       PRO  18 -11.346  -8.661  -0.281
  137    H    LEU  19           HN       LEU  19  -8.088  -5.615   2.949
  138    HA   LEU  19           HA       LEU  19  -7.554  -7.475   5.088
  139   1HB   LEU  19          HB2       LEU  19  -6.287  -5.417   3.816
  140   2HB   LEU  19          HB1       LEU  19  -6.733  -4.636   5.331
  141    HG   LEU  19           HG       LEU  19  -5.652  -7.342   5.694
  142   1HD1  LEU  19          HD1       LEU  19  -4.366  -6.419   3.682
  143   2HD1  LEU  19          HD1       LEU  19  -3.393  -6.883   5.077
  144   3HD1  LEU  19          HD1       LEU  19  -3.746  -5.181   4.776
  145   1HD2  LEU  19          HD2       LEU  19  -6.091  -5.544   7.445
  146   2HD2  LEU  19          HD2       LEU  19  -4.712  -4.673   6.776
  147   3HD2  LEU  19          HD2       LEU  19  -4.483  -6.266   7.497
  148    HA   PRO  20           HA       PRO  20 -10.565  -6.117   8.023
  149   1HB   PRO  20          HB2       PRO  20  -9.263  -6.724  10.359
  150   2HB   PRO  20          HB1       PRO  20 -10.013  -7.953   9.321
  151   1HG   PRO  20          HG2       PRO  20  -7.152  -7.141   9.528
  152   2HG   PRO  20          HG1       PRO  20  -7.856  -8.759   9.360
  153   1HD   PRO  20          HD2       PRO  20  -6.756  -7.427   7.279
  154   2HD   PRO  20          HD1       PRO  20  -8.111  -8.560   7.082
  155    H    TRP  21           HN       TRP  21 -10.747  -3.896   8.046
  156    HA   TRP  21           HA       TRP  21  -8.830  -1.917   8.290
  157   1HB   TRP  21          HB2       TRP  21 -11.680  -2.116   9.279
  158   2HB   TRP  21          HB1       TRP  21 -10.781  -0.595   9.296
  159    HD1  TRP  21           HD1      TRP  21 -12.629  -2.936   7.020
  160    HE1  TRP  21           HE1      TRP  21 -12.591  -2.024   4.610
  161    HE3  TRP  21           HE3      TRP  21  -9.226   0.834   7.558
  162    HZ2  TRP  21           HZ2      TRP  21 -11.288   0.030   3.108
  163    HZ3  TRP  21           HZ3      TRP  21  -8.606   2.251   5.623
  164    HH2  TRP  21           HH2      TRP  21  -9.631   1.855   3.400
  165    H    THR  22           HN       THR  22 -10.068  -3.941  10.882
  166    HA   THR  22           HA       THR  22  -9.322  -2.386  13.141
  167    HB   THR  22           HB       THR  22  -9.101  -4.729  14.167
  168    HG1  THR  22           HG1      THR  22 -10.161  -5.660  11.748
  169   1HG2  THR  22          HG2       THR  22 -11.593  -5.246  13.525
  170   2HG2  THR  22          HG2       THR  22 -11.501  -3.695  12.690
  171   3HG2  THR  22          HG2       THR  22 -11.215  -3.777  14.428
  172    H    TRP  23           HN       TRP  23  -7.421  -4.572  11.084
  173    HA   TRP  23           HA       TRP  23  -4.972  -3.937  12.653
  174   1HB   TRP  23          HB2       TRP  23  -5.620  -6.007  10.533
  175   2HB   TRP  23          HB1       TRP  23  -4.071  -5.877  11.358
  176    HD1  TRP  23           HD1      TRP  23  -6.306  -5.043  14.002
  177    HE1  TRP  23           HE1      TRP  23  -6.984  -7.095  15.408
  178    HE3  TRP  23           HE3      TRP  23  -4.891  -8.788  10.834
  179    HZ2  TRP  23           HZ2      TRP  23  -6.932  -9.951  15.214
  180    HZ3  TRP  23           HZ3      TRP  23  -5.215 -11.163  11.468
  181    HH2  TRP  23           HH2      TRP  23  -6.233 -11.748  13.652
  182    H    VAL  24           HN       VAL  24  -6.505  -2.425  10.239
  183    HA   VAL  24           HA       VAL  24  -4.202  -2.217   8.387
  184    HB   VAL  24           HB       VAL  24  -6.975  -0.994   8.348
  185   1HG1  VAL  24          HG1       VAL  24  -6.398   0.055   6.412
  186   2HG1  VAL  24          HG1       VAL  24  -5.461  -1.326   5.843
  187   3HG1  VAL  24          HG1       VAL  24  -4.737  -0.171   6.962
  188   1HG2  VAL  24          HG2       VAL  24  -6.535  -3.598   8.159
  189   2HG2  VAL  24          HG2       VAL  24  -6.001  -3.180   6.532
  190   3HG2  VAL  24          HG2       VAL  24  -7.648  -2.808   7.041
  191    H    ARG  25           HN       ARG  25  -2.969  -0.332   8.182
  192    HA   ARG  25           HA       ARG  25  -3.541   1.834  10.178
  193   1HB   ARG  25          HB2       ARG  25  -1.485   0.156  10.271
  194   2HB   ARG  25          HB1       ARG  25  -0.815   1.261   9.072
  195   1HG   ARG  25          HG2       ARG  25  -0.941   3.117  10.555
  196   2HG   ARG  25          HG1       ARG  25  -1.992   2.247  11.674
  197   1HD   ARG  25          HD2       ARG  25  -0.240   1.074  12.618
  198   2HD   ARG  25          HD1       ARG  25   0.687   1.045  11.103
  199    HE   ARG  25           HE       ARG  25   0.940   3.598  11.522
  200   1HH1  ARG  25          HH1       ARG  25  -0.552   2.733  14.233
  201   2HH1  ARG  25          HH1       ARG  25   0.767   2.978  15.330
  202   1HH2  ARG  25          HH2       ARG  25   3.145   3.262  12.821
  203   2HH2  ARG  25          HH2       ARG  25   2.861   3.277  14.530
  204    H    SER  26           HN       SER  26  -1.968   1.188   7.017
  205    HA   SER  26           HA       SER  26  -3.197   3.545   5.813
  206   1HB   SER  26          HB2       SER  26  -1.133   4.844   5.618
  207   2HB   SER  26          HB1       SER  26  -1.430   4.486   7.317
  208    HG   SER  26           HG       SER  26   0.046   2.771   7.144
  209    H    TYR  27           HN       TYR  27  -1.043   3.937   3.890
  210    HA   TYR  27           HA       TYR  27  -0.464   1.305   2.715
  211   1HB   TYR  27          HB2       TYR  27  -1.936   1.515   0.850
  212   2HB   TYR  27          HB1       TYR  27  -2.911   1.967   2.243
  213    HD1  TYR  27           HD1      TYR  27  -1.520   3.036  -0.910
  214    HD2  TYR  27           HD2      TYR  27  -3.225   4.441   2.771
  215    HE1  TYR  27           HE1      TYR  27  -1.955   5.238  -1.957
  216    HE2  TYR  27           HE2      TYR  27  -3.663   6.645   1.725
  217    HH   TYR  27           HH       TYR  27  -4.020   7.505  -0.670
  218    H    GLU  28           HN       GLU  28   0.323   1.905   0.237
  219    HA   GLU  28           HA       GLU  28   1.569   4.480  -0.138
  220   1HB   GLU  28          HB2       GLU  28   3.890   3.776   0.361
  221   2HB   GLU  28          HB1       GLU  28   2.873   3.639   1.795
  222   1HG   GLU  28          HG2       GLU  28   2.502   1.204   1.157
  223   2HG   GLU  28          HG1       GLU  28   3.780   1.412  -0.041
  224    H    PHE  29           HN       PHE  29   2.257   4.625  -2.276
  225    HA   PHE  29           HA       PHE  29   1.818   2.295  -4.002
  226   1HB   PHE  29          HB2       PHE  29   1.645   5.073  -4.187
  227   2HB   PHE  29          HB1       PHE  29   3.036   4.671  -5.194
  228    HD1  PHE  29           HD1      PHE  29   2.736   2.691  -6.865
  229    HD2  PHE  29           HD2      PHE  29  -0.528   4.800  -5.035
  230    HE1  PHE  29           HE1      PHE  29   1.215   1.883  -8.648
  231    HE2  PHE  29           HE2      PHE  29  -2.050   3.992  -6.818
  232    HZ   PHE  29           HZ       PHE  29  -1.179   2.533  -8.625
  233    H    THR  30           HN       THR  30   3.465   1.177  -5.140
  234    HA   THR  30           HA       THR  30   5.995   0.795  -3.993
  235    HB   THR  30           HB       THR  30   6.476   0.144  -6.550
  236    HG1  THR  30           HG1      THR  30   4.511   1.354  -7.114
  237   1HG2  THR  30          HG2       THR  30   5.490  -1.149  -4.285
  238   2HG2  THR  30          HG2       THR  30   6.065  -1.925  -5.760
  239   3HG2  THR  30          HG2       THR  30   4.347  -1.578  -5.558
  240    H    SER  31           HN       SER  31   8.133   1.534  -4.655
  241    HA   SER  31           HA       SER  31   8.392   4.349  -5.030
  242   1HB   SER  31          HB2       SER  31  10.798   3.706  -5.418
  243   2HB   SER  31          HB1       SER  31  10.094   2.964  -3.984
  244    HG   SER  31           HG       SER  31  11.082   1.814  -6.227
  245    H    ASN  32           HN       ASN  32   9.944   5.108  -6.967
  246    HA   ASN  32           HA       ASN  32   8.448   4.544  -9.457
  247   1HB   ASN  32          HB2       ASN  32   9.066   6.837  -8.534
  248   2HB   ASN  32          HB1       ASN  32  10.738   6.461  -8.951
  249   1HD2  ASN  32          HD2       ASN  32  10.701   8.217 -10.585
  250   2HD2  ASN  32          HD2       ASN  32   9.904   7.990 -12.066
  251    H    SER  33           HN       SER  33  10.938   2.977  -8.006
  252    HA   SER  33           HA       SER  33  12.338   2.465 -10.597
  253   1HB   SER  33          HB2       SER  33  13.576   3.702  -8.745
  254   2HB   SER  33          HB1       SER  33  13.466   2.221  -7.799
  255    HG   SER  33           HG       SER  33  14.512   2.292 -10.429
  256    H    CYS  34           HN       CYS  34  10.082   0.958 -10.069
  257    HA   CYS  34           HA       CYS  34  11.201  -1.648  -9.085
  258   1HB   CYS  34          HB2       CYS  34   8.546  -0.264  -8.796
  259   2HB   CYS  34          HB1       CYS  34   8.622  -2.024  -8.704
  260    H    SER  35           HN       SER  35  10.665  -3.510 -10.331
  261    HA   SER  35           HA       SER  35  10.411  -3.152 -13.163
  262   1HB   SER  35          HB2       SER  35  10.436  -5.365 -11.172
  263   2HB   SER  35          HB1       SER  35   9.788  -5.748 -12.764
  264    HG   SER  35           HG       SER  35  12.339  -5.405 -12.000
  265    H    GLN  36           HN       GLN  36   8.030  -3.596 -10.614
  266    HA   GLN  36           HA       GLN  36   5.879  -3.364 -12.679
  267   1HB   GLN  36          HB2       GLN  36   6.469  -5.740 -11.731
  268   2HB   GLN  36          HB1       GLN  36   5.615  -5.179 -10.293
  269   1HG   GLN  36          HG2       GLN  36   3.764  -4.458 -12.012
  270   2HG   GLN  36          HG1       GLN  36   4.552  -5.635 -13.065
  271   1HE2  GLN  36          HE2       GLN  36   5.327  -7.561 -11.087
  272   2HE2  GLN  36          HE2       GLN  36   3.920  -8.254 -10.437
  273    H    ARG  37           HN       ARG  37   4.588  -1.657 -12.135
  274    HA   ARG  37           HA       ARG  37   4.794  -0.317  -9.569
  275   1HB   ARG  37          HB2       ARG  37   3.542   0.014 -12.197
  276   2HB   ARG  37          HB1       ARG  37   2.524   0.607 -10.885
  277   1HG   ARG  37          HG2       ARG  37   3.879   2.372 -10.504
  278   2HG   ARG  37          HG1       ARG  37   5.322   1.359 -10.526
  279   1HD   ARG  37          HD2       ARG  37   5.580   2.837 -12.390
  280   2HD   ARG  37          HD1       ARG  37   5.014   1.313 -13.104
  281    HE   ARG  37           HE       ARG  37   2.707   2.769 -12.382
  282   1HH1  ARG  37          HH2       ARG  37   4.962   2.319 -14.876
  283   2HH1  ARG  37          HH2       ARG  37   4.335   3.578 -15.886
  284   1HH2  ARG  37          HH1       ARG  37   2.085   4.728 -13.509
  285   2HH2  ARG  37          HH1       ARG  37   2.705   4.942 -15.113
  286    H    ALA  38           HN       ALA  38   3.239  -0.292  -7.890
  287    HA   ALA  38           HA       ALA  38   0.716  -1.747  -8.091
  288   1HB   ALA  38          HB1       ALA  38   1.345  -3.731  -7.129
  289   2HB   ALA  38          HB2       ALA  38   2.533  -2.958  -6.082
  290   3HB   ALA  38          HB3       ALA  38   2.930  -3.294  -7.768
  291    H    VAL  39           HN       VAL  39  -0.111  -2.043  -5.647
  292    HA   VAL  39           HA       VAL  39   0.614   0.464  -4.161
  293    HB   VAL  39           HB       VAL  39  -2.018  -1.009  -4.510
  294   1HG1  VAL  39          HG1       VAL  39  -1.814  -0.053  -2.244
  295   2HG1  VAL  39          HG1       VAL  39  -2.994   0.844  -3.200
  296   3HG1  VAL  39          HG1       VAL  39  -1.381   1.509  -2.940
  297   1HG2  VAL  39          HG2       VAL  39  -2.431   0.437  -6.195
  298   2HG2  VAL  39          HG2       VAL  39  -0.725   0.883  -6.124
  299   3HG2  VAL  39          HG2       VAL  39  -1.919   1.813  -5.217
  300    H    ILE  40           HN       ILE  40   0.541   0.264  -1.797
  301    HA   ILE  40           HA       ILE  40   0.580  -2.569  -0.833
  302    HB   ILE  40           HB       ILE  40   2.424  -0.243  -0.215
  303   1HG1  ILE  40          HG1       ILE  40   3.245  -2.937  -1.244
  304   2HG1  ILE  40          HG1       ILE  40   2.577  -1.757  -2.372
  305   1HG2  ILE  40          HG2       ILE  40   1.689  -2.215   1.564
  306   2HG2  ILE  40          HG2       ILE  40   3.223  -1.348   1.597
  307   3HG2  ILE  40          HG2       ILE  40   3.113  -2.916   0.798
  308   1HD1  ILE  40          HD1       ILE  40   4.270  -0.099  -1.535
  309   2HD1  ILE  40          HD1       ILE  40   4.986  -1.493  -2.346
  310   3HD1  ILE  40          HD1       ILE  40   4.998  -1.395  -0.585
  311    H    PHE  41           HN       PHE  41  -0.578  -2.923   1.023
  312    HA   PHE  41           HA       PHE  41  -1.838  -0.560   2.364
  313   1HB   PHE  41          HB2       PHE  41  -2.560  -3.491   2.065
  314   2HB   PHE  41          HB1       PHE  41  -3.424  -2.409   3.156
  315    HD1  PHE  41           HD1      PHE  41  -3.989  -3.920   0.258
  316    HD2  PHE  41           HD2      PHE  41  -3.531   0.108   1.680
  317    HE1  PHE  41           HE1      PHE  41  -5.353  -3.095  -1.642
  318    HE2  PHE  41           HE2      PHE  41  -4.896   0.933  -0.221
  319    HZ   PHE  41           HZ       PHE  41  -5.807  -0.669  -1.881
  320    H    THR  42           HN       THR  42  -0.954  -0.091   4.361
  321    HA   THR  42           HA       THR  42   0.767  -2.102   5.648
  322    HB   THR  42           HB       THR  42   0.468   0.449   6.996
  323    HG1  THR  42           HG1      THR  42   0.802   1.797   5.385
  324   1HG2  THR  42          HG2       THR  42   2.891   0.528   6.577
  325   2HG2  THR  42          HG2       THR  42   2.731  -0.830   5.465
  326   3HG2  THR  42          HG2       THR  42   2.403  -1.056   7.182
  327    H    THR  43           HN       THR  43   0.412  -2.895   7.747
  328    HA   THR  43           HA       THR  43  -2.379  -2.568   8.764
  329    HB   THR  43           HB       THR  43  -1.534  -4.785   9.964
  330    HG1  THR  43           HG1      THR  43   0.254  -5.540   9.185
  331   1HG2  THR  43          HG2       THR  43  -3.125  -4.232   7.810
  332   2HG2  THR  43          HG2       THR  43  -2.849  -5.851   8.454
  333   3HG2  THR  43          HG2       THR  43  -1.904  -5.274   7.081
  334    H    LYS  44           HN       LYS  44  -2.352  -3.202  11.277
  335    HA   LYS  44           HA       LYS  44  -0.771  -1.124  12.611
  336   1HB   LYS  44          HB2       LYS  44  -2.724  -3.218  13.616
  337   2HB   LYS  44          HB1       LYS  44  -2.142  -1.838  14.547
  338   1HG   LYS  44          HG2       LYS  44  -3.036  -0.719  12.149
  339   2HG   LYS  44          HG1       LYS  44  -4.245  -1.944  12.536
  340   1HD   LYS  44          HD2       LYS  44  -4.194  -0.966  14.927
  341   2HD   LYS  44          HD1       LYS  44  -3.369   0.415  14.202
  342   1HE   LYS  44          HE2       LYS  44  -5.578  -0.142  12.514
  343   2HE   LYS  44          HE1       LYS  44  -6.190  -0.189  14.180
  344   1HZ   LYS  44          HZ1       LYS  44  -5.368   1.923  14.633
  345   2HZ   LYS  44          HZ2       LYS  44  -5.985   2.089  13.058
  346   3HZ   LYS  44          HZ3       LYS  44  -4.313   1.916  13.306
  347    H    ARG  45           HN       ARG  45   0.055  -4.175  11.637
  348    HA   ARG  45           HA       ARG  45   1.461  -4.953  14.136
  349   1HB   ARG  45          HB2       ARG  45   0.251  -6.237  11.878
  350   2HB   ARG  45          HB1       ARG  45   1.952  -6.696  11.929
  351   1HG   ARG  45          HG2       ARG  45   0.648  -6.698  14.565
  352   2HG   ARG  45          HG1       ARG  45  -0.029  -7.870  13.434
  353   1HD   ARG  45          HD2       ARG  45   2.454  -8.494  12.934
  354   2HD   ARG  45          HD1       ARG  45   2.795  -7.680  14.475
  355    HE   ARG  45           HE       ARG  45   0.564  -9.598  14.553
  356   1HH1  ARG  45          HH2       ARG  45   3.851  -9.966  14.128
  357   2HH1  ARG  45          HH2       ARG  45   4.132 -10.848  15.591
  358   1HH2  ARG  45          HH1       ARG  45   0.943 -10.310  16.841
  359   2HH2  ARG  45          HH1       ARG  45   2.487 -11.043  17.127
  360    H    GLY  46           HN       GLY  46   2.100  -3.103  11.365
  361   1HA   GLY  46          HA2       GLY  46   4.194  -2.019  10.940
  362   2HA   GLY  46          HA1       GLY  46   5.003  -3.254  11.904
  363    H    LYS  47           HN       LYS  47   2.772  -4.635   9.743
  364    HA   LYS  47           HA       LYS  47   4.999  -5.374   7.905
  365   1HB   LYS  47          HB2       LYS  47   3.195  -6.863   9.427
  366   2HB   LYS  47          HB1       LYS  47   2.544  -6.952   7.790
  367   1HG   LYS  47          HG2       LYS  47   4.619  -7.816   6.927
  368   2HG   LYS  47          HG1       LYS  47   5.446  -7.506   8.454
  369   1HD   LYS  47          HD2       LYS  47   4.976  -9.715   8.826
  370   2HD   LYS  47          HD1       LYS  47   3.420  -9.063   9.343
  371   1HE   LYS  47          HE2       LYS  47   2.359 -10.110   7.636
  372   2HE   LYS  47          HE1       LYS  47   3.480  -9.407   6.453
  373   1HZ   LYS  47          HZ1       LYS  47   5.093 -11.070   6.950
  374   2HZ   LYS  47          HZ2       LYS  47   3.628 -11.872   6.639
  375   3HZ   LYS  47          HZ3       LYS  47   4.171 -11.678   8.237
  376    H    LYS  48           HN       LYS  48   4.864  -4.431   5.902
  377    HA   LYS  48           HA       LYS  48   2.322  -3.175   5.050
  378   1HB   LYS  48          HB2       LYS  48   4.975  -3.260   3.593
  379   2HB   LYS  48          HB1       LYS  48   3.707  -2.045   3.459
  380   1HG   LYS  48          HG2       LYS  48   4.239  -1.868   6.114
  381   2HG   LYS  48          HG1       LYS  48   5.828  -2.346   5.513
  382   1HD   LYS  48          HD2       LYS  48   4.378  -0.210   4.017
  383   2HD   LYS  48          HD1       LYS  48   5.074   0.219   5.580
  384   1HE   LYS  48          HE2       LYS  48   6.690  -1.237   3.473
  385   2HE   LYS  48          HE1       LYS  48   6.616   0.536   3.548
  386   1HZ   LYS  48          HZ1       LYS  48   8.425  -0.161   4.912
  387   2HZ   LYS  48          HZ2       LYS  48   7.469  -1.321   5.705
  388   3HZ   LYS  48          HZ3       LYS  48   7.178   0.334   5.950
  389    H    VAL  49           HN       VAL  49   0.953  -4.158   3.603
  390    HA   VAL  49           HA       VAL  49   1.895  -6.646   2.239
  391    HB   VAL  49           HB       VAL  49  -0.873  -5.502   2.739
  392   1HG1  VAL  49          HG1       VAL  49   0.168  -7.900   1.323
  393   2HG1  VAL  49          HG1       VAL  49  -1.320  -6.992   1.055
  394   3HG1  VAL  49          HG1       VAL  49  -1.224  -8.157   2.375
  395   1HG2  VAL  49          HG2       VAL  49   0.568  -6.215   4.752
  396   2HG2  VAL  49          HG2       VAL  49   0.435  -7.855   4.118
  397   3HG2  VAL  49          HG2       VAL  49  -1.016  -6.976   4.602
  398    H    CYS  50           HN       CYS  50   1.773  -6.813  -0.032
  399    HA   CYS  50           HA       CYS  50   1.527  -4.262  -1.509
  400   1HB   CYS  50          HB2       CYS  50   2.439  -7.081  -2.112
  401   2HB   CYS  50          HB1       CYS  50   2.294  -5.866  -3.380
  402    H    THR  51           HN       THR  51   0.273  -4.291  -3.598
  403    HA   THR  51           HA       THR  51  -1.921  -6.232  -3.872
  404    HB   THR  51           HB       THR  51  -3.528  -4.138  -3.693
  405    HG1  THR  51           HG1      THR  51  -2.695  -2.715  -2.069
  406   1HG2  THR  51          HG2       THR  51  -2.939  -6.250  -2.061
  407   2HG2  THR  51          HG2       THR  51  -4.198  -5.060  -1.728
  408   3HG2  THR  51          HG2       THR  51  -2.604  -4.887  -0.993
  409    H    HIS  52           HN       HIS  52  -3.563  -4.968  -5.594
  410    HA   HIS  52           HA       HIS  52  -1.755  -3.972  -7.758
  411   1HB   HIS  52          HB2       HIS  52  -3.090  -6.272  -7.758
  412   2HB   HIS  52          HB1       HIS  52  -4.428  -5.237  -8.254
  413    HD1  HIS  52           HD1      HIS  52  -0.753  -4.993  -9.239
  414    HD2  HIS  52           HD2      HIS  52  -4.481  -5.603 -11.004
  415    HE1  HIS  52           HE1      HIS  52  -0.365  -5.026 -11.742
  416    HA   PRO  53           HA       PRO  53  -4.303  -0.348  -7.612
  417   1HB   PRO  53          HB2       PRO  53  -3.484   0.821  -9.942
  418   2HB   PRO  53          HB1       PRO  53  -2.485   0.793  -8.477
  419   1HG   PRO  53          HG2       PRO  53  -2.277  -0.838 -10.938
  420   2HG   PRO  53          HG1       PRO  53  -1.007  -0.261  -9.853
  421   1HD   PRO  53          HD2       PRO  53  -2.031  -2.840  -9.900
  422   2HD   PRO  53          HD1       PRO  53  -1.124  -2.117  -8.555
  423    H    ARG  54           HN       ARG  54  -4.340  -2.592 -10.303
  424    HA   ARG  54           HA       ARG  54  -6.507  -1.411 -11.793
  425   1HB   ARG  54          HB2       ARG  54  -4.701  -3.492 -12.052
  426   2HB   ARG  54          HB1       ARG  54  -6.238  -4.337 -11.863
  427   1HG   ARG  54          HG2       ARG  54  -6.991  -2.397 -13.597
  428   2HG   ARG  54          HG1       ARG  54  -5.302  -2.584 -14.070
  429   1HD   ARG  54          HD2       ARG  54  -7.053  -5.018 -13.706
  430   2HD   ARG  54          HD1       ARG  54  -7.055  -4.118 -15.236
  431    HE   ARG  54           HE       ARG  54  -4.584  -5.290 -14.011
  432   1HH1  ARG  54          HH1       ARG  54  -6.406  -6.156 -16.491
  433   2HH1  ARG  54          HH1       ARG  54  -5.300  -5.772 -17.767
  434   1HH2  ARG  54          HH2       ARG  54  -3.166  -3.948 -15.734
  435   2HH2  ARG  54          HH2       ARG  54  -3.467  -4.524 -17.339
  436    H    LYS  55           HN       LYS  55  -6.419  -3.996  -9.314
  437    HA   LYS  55           HA       LYS  55  -9.139  -4.721  -9.300
  438   1HB   LYS  55          HB2       LYS  55  -6.788  -4.963  -7.664
  439   2HB   LYS  55          HB1       LYS  55  -8.172  -4.624  -6.623
  440   1HG   LYS  55          HG2       LYS  55  -8.040  -7.019  -6.894
  441   2HG   LYS  55          HG1       LYS  55  -9.420  -6.454  -7.837
  442   1HD   LYS  55          HD2       LYS  55  -8.295  -7.907  -9.318
  443   2HD   LYS  55          HD1       LYS  55  -7.748  -6.305  -9.811
  444   1HE   LYS  55          HE2       LYS  55  -5.600  -6.813  -9.298
  445   2HE   LYS  55          HE1       LYS  55  -6.068  -7.384  -7.683
  446   1HZ   LYS  55          HZ1       LYS  55  -6.983  -9.400  -8.829
  447   2HZ   LYS  55          HZ2       LYS  55  -5.290  -9.271  -8.855
  448   3HZ   LYS  55          HZ3       LYS  55  -6.195  -8.883 -10.240
  449    H    LYS  56           HN       LYS  56 -10.866  -3.341  -9.133
  450    HA   LYS  56           HA       LYS  56 -10.850  -0.667  -8.272
  451   1HB   LYS  56          HB2       LYS  56 -13.309  -1.029  -8.065
  452   2HB   LYS  56          HB1       LYS  56 -12.652  -1.753  -9.533
  453   1HG   LYS  56          HG2       LYS  56 -12.363  -3.846  -7.858
  454   2HG   LYS  56          HG1       LYS  56 -13.752  -3.067  -7.101
  455   1HD   LYS  56          HD2       LYS  56 -14.739  -2.952  -9.491
  456   2HD   LYS  56          HD1       LYS  56 -13.506  -4.141  -9.908
  457   1HE   LYS  56          HE2       LYS  56 -14.368  -5.706  -8.257
  458   2HE   LYS  56          HE1       LYS  56 -15.513  -4.491  -7.653
  459   1HZ   LYS  56          HZ1       LYS  56 -16.560  -4.393  -9.790
  460   2HZ   LYS  56          HZ2       LYS  56 -16.506  -6.022  -9.307
  461   3HZ   LYS  56          HZ3       LYS  56 -15.409  -5.438 -10.466
  462    H    TRP  57           HN       TRP  57 -11.135  -3.627  -6.343
  463    HA   TRP  57           HA       TRP  57 -12.039  -2.389  -3.919
  464   1HB   TRP  57          HB2       TRP  57 -11.935  -4.555  -3.176
  465   2HB   TRP  57          HB1       TRP  57 -11.630  -4.925  -4.867
  466    HD1  TRP  57           HD1      TRP  57  -9.441  -6.141  -5.390
  467    HE1  TRP  57           HE1      TRP  57  -7.287  -6.680  -4.079
  468    HE3  TRP  57           HE3      TRP  57 -10.314  -3.477  -1.125
  469    HZ2  TRP  57           HZ2      TRP  57  -6.094  -6.056  -1.556
  470    HZ3  TRP  57           HZ3      TRP  57  -8.654  -3.469   0.716
  471    HH2  TRP  57           HH2      TRP  57  -6.547  -4.756   0.505
  472    H    VAL  58           HN       VAL  58  -8.795  -2.902  -5.279
  473    HA   VAL  58           HA       VAL  58  -7.310  -2.050  -2.960
  474    HB   VAL  58           HB       VAL  58  -6.660  -1.964  -5.924
  475   1HG1  VAL  58          HG1       VAL  58  -4.582  -1.288  -5.358
  476   2HG1  VAL  58          HG1       VAL  58  -4.477  -2.482  -4.064
  477   3HG1  VAL  58          HG1       VAL  58  -5.234  -0.919  -3.762
  478   1HG2  VAL  58          HG2       VAL  58  -5.864  -4.189  -5.694
  479   2HG2  VAL  58          HG2       VAL  58  -7.399  -4.188  -4.828
  480   3HG2  VAL  58          HG2       VAL  58  -5.882  -4.100  -3.933
  481    H    GLN  59           HN       GLN  59  -8.322  -0.325  -5.934
  482    HA   GLN  59           HA       GLN  59  -7.259   2.230  -5.217
  483   1HB   GLN  59          HB2       GLN  59  -9.604   1.337  -6.929
  484   2HB   GLN  59          HB1       GLN  59  -8.986   2.990  -6.910
  485   1HG   GLN  59          HG2       GLN  59  -7.086   0.715  -7.390
  486   2HG   GLN  59          HG1       GLN  59  -8.097   1.293  -8.714
  487   1HE2  GLN  59          HE2       GLN  59  -5.440   1.715  -9.133
  488   2HE2  GLN  59          HE2       GLN  59  -5.014   3.336  -8.862
  489    H    LYS  60           HN       LYS  60 -10.256   0.549  -4.454
  490    HA   LYS  60           HA       LYS  60 -11.658   2.772  -3.285
  491   1HB   LYS  60          HB2       LYS  60 -11.944  -0.067  -3.713
  492   2HB   LYS  60          HB1       LYS  60 -12.401   0.322  -2.054
  493   1HG   LYS  60          HG2       LYS  60 -14.238   1.504  -2.701
  494   2HG   LYS  60          HG1       LYS  60 -13.416   2.201  -4.099
  495   1HD   LYS  60          HD2       LYS  60 -13.636   0.051  -5.299
  496   2HD   LYS  60          HD1       LYS  60 -14.476  -0.635  -3.906
  497   1HE   LYS  60          HE2       LYS  60 -15.916   1.678  -4.351
  498   2HE   LYS  60          HE1       LYS  60 -15.508   1.158  -5.999
  499   1HZ   LYS  60          HZ1       LYS  60 -17.493   0.020  -5.256
  500   2HZ   LYS  60          HZ2       LYS  60 -16.693  -0.540  -3.865
  501   3HZ   LYS  60          HZ3       LYS  60 -16.222  -1.094  -5.401
  502    H    TYR  61           HN       TYR  61  -9.283   0.444  -2.087
  503    HA   TYR  61           HA       TYR  61  -9.611   1.232   0.711
  504   1HB   TYR  61          HB2       TYR  61  -8.213  -0.742  -0.913
  505   2HB   TYR  61          HB1       TYR  61  -7.178  -0.096   0.361
  506    HD1  TYR  61           HD1      TYR  61  -7.276  -1.119   2.448
  507    HD2  TYR  61           HD2      TYR  61 -10.730  -1.228  -0.102
  508    HE1  TYR  61           HE1      TYR  61  -8.471  -2.501   4.124
  509    HE2  TYR  61           HE2      TYR  61 -11.924  -2.610   1.572
  510    HH   TYR  61           HH       TYR  61 -11.552  -3.987   3.419
  511    H    ILE  62           HN       ILE  62  -7.307   1.938  -1.908
  512    HA   ILE  62           HA       ILE  62  -5.375   3.370  -0.410
  513    HB   ILE  62           HB       ILE  62  -6.459   3.821  -3.215
  514   1HG1  ILE  62          HG1       ILE  62  -3.951   2.342  -2.417
  515   2HG1  ILE  62          HG1       ILE  62  -5.507   1.518  -2.502
  516   1HG2  ILE  62          HG2       ILE  62  -4.638   5.377  -1.719
  517   2HG2  ILE  62          HG2       ILE  62  -4.940   5.468  -3.454
  518   3HG2  ILE  62          HG2       ILE  62  -3.657   4.427  -2.835
  519   1HD1  ILE  62          HD1       ILE  62  -3.742   2.288  -4.662
  520   2HD1  ILE  62          HD1       ILE  62  -5.328   3.032  -4.872
  521   3HD1  ILE  62          HD1       ILE  62  -5.188   1.281  -4.718
  522    H    SER  63           HN       SER  63  -8.378   4.558  -1.963
  523    HA   SER  63           HA       SER  63  -8.058   7.279  -1.003
  524   1HB   SER  63          HB2       SER  63 -10.642   7.144  -1.605
  525   2HB   SER  63          HB1       SER  63  -9.427   7.076  -2.878
  526    HG   SER  63           HG       SER  63 -10.538   5.301  -3.297
  527    H    LEU  64           HN       LEU  64  -9.701   4.375   0.197
  528    HA   LEU  64           HA       LEU  64 -11.107   5.707   2.355
  529   1HB   LEU  64          HB2       LEU  64 -10.424   2.911   1.504
  530   2HB   LEU  64          HB1       LEU  64 -11.044   3.166   3.136
  531    HG   LEU  64           HG       LEU  64 -12.407   4.223   0.646
  532   1HD1  LEU  64          HD1       LEU  64 -13.530   2.264   0.406
  533   2HD1  LEU  64          HD1       LEU  64 -13.684   2.034   2.147
  534   3HD1  LEU  64          HD1       LEU  64 -12.197   1.562   1.324
  535   1HD2  LEU  64          HD2       LEU  64 -13.941   5.128   2.062
  536   2HD2  LEU  64          HD2       LEU  64 -12.675   4.971   3.281
  537   3HD2  LEU  64          HD2       LEU  64 -13.915   3.725   3.131
  538    H    LEU  65           HN       LEU  65  -7.947   4.130   2.023
  539    HA   LEU  65           HA       LEU  65  -7.323   4.320   4.878
  540   1HB   LEU  65          HB2       LEU  65  -6.165   3.240   2.396
  541   2HB   LEU  65          HB1       LEU  65  -4.958   3.901   3.491
  542    HG   LEU  65           HG       LEU  65  -7.041   1.805   4.181
  543   1HD1  LEU  65          HD1       LEU  65  -5.248   0.807   2.926
  544   2HD1  LEU  65          HD1       LEU  65  -4.928   0.450   4.623
  545   3HD1  LEU  65          HD1       LEU  65  -4.035   1.733   3.808
  546   1HD2  LEU  65          HD2       LEU  65  -5.349   1.821   6.276
  547   2HD2  LEU  65          HD2       LEU  65  -6.799   2.825   6.229
  548   3HD2  LEU  65          HD2       LEU  65  -5.231   3.518   5.813
  549    H    LYS  66           HN       LYS  66  -8.041   6.861   4.212
  550    HA   LYS  66           HA       LYS  66  -7.277   9.094   4.264
  551   1HB   LYS  66          HB2       LYS  66  -5.739   7.588   5.933
  552   2HB   LYS  66          HB1       LYS  66  -4.502   8.224   4.847
  553   1HG   LYS  66          HG2       LYS  66  -5.221  10.507   5.285
  554   2HG   LYS  66          HG1       LYS  66  -6.572   9.928   6.263
  555   1HD   LYS  66          HD2       LYS  66  -4.887  10.519   7.835
  556   2HD   LYS  66          HD1       LYS  66  -4.805   8.760   7.716
  557   1HE   LYS  66          HE2       LYS  66  -2.666   8.864   6.980
  558   2HE   LYS  66          HE1       LYS  66  -3.125   9.993   5.690
  559   1HZ   LYS  66          HZ1       LYS  66  -2.947  10.853   8.514
  560   2HZ   LYS  66          HZ2       LYS  66  -2.946  11.817   7.114
  561   3HZ   LYS  66          HZ3       LYS  66  -1.586  10.875   7.501
  562    H    THR  67           HN       THR  67  -5.604  10.581   3.200
  563    HA   THR  67           HA       THR  67  -4.340   9.364   0.797
  564    HB   THR  67           HB       THR  67  -5.961  11.896   0.637
  565    HG1  THR  67           HG1      THR  67  -7.420  10.447   1.425
  566   1HG2  THR  67          HG2       THR  67  -4.454  11.215  -1.228
  567   2HG2  THR  67          HG2       THR  67  -6.152  11.245  -1.706
  568   3HG2  THR  67          HG2       THR  67  -5.357   9.707  -1.370
  569    HA   PRO  68           HA       PRO  68  -1.190  12.191   2.186
  570   1HB   PRO  68          HB2       PRO  68   0.541  11.887   0.091
  571   2HB   PRO  68          HB1       PRO  68   0.356  10.673   1.372
  572   1HG   PRO  68          HG2       PRO  68  -0.744  10.696  -1.387
  573   2HG   PRO  68          HG1       PRO  68  -0.143   9.341  -0.421
  574   1HD   PRO  68          HD2       PRO  68  -2.801   9.906  -0.800
  575   2HD   PRO  68          HD1       PRO  68  -2.159   9.005   0.590
  576    H    LYS  69           HN       LYS  69  -1.085  14.402   1.913
  577    HA   LYS  69           HA       LYS  69  -1.216  15.625  -0.754
  578   1HB   LYS  69          HB2       LYS  69  -3.521  15.341   1.063
  579   2HB   LYS  69          HB1       LYS  69  -3.262  16.989   0.488
  580   1HG   LYS  69          HG2       LYS  69  -2.964  14.981  -1.629
  581   2HG   LYS  69          HG1       LYS  69  -4.576  14.997  -0.915
  582   1HD   LYS  69          HD2       LYS  69  -4.403  17.587  -1.168
  583   2HD   LYS  69          HD1       LYS  69  -3.116  17.223  -2.318
  584   1HE   LYS  69          HE2       LYS  69  -5.898  16.013  -2.479
  585   2HE   LYS  69          HE1       LYS  69  -5.377  17.433  -3.408
  586   1HZ   LYS  69          HZ1       LYS  69  -4.042  14.776  -3.409
  587   2HZ   LYS  69          HZ2       LYS  69  -3.522  16.143  -4.273
  588   3HZ   LYS  69          HZ3       LYS  69  -4.997  15.398  -4.666
  589    H    GLN  70           HN       GLN  70  -0.172  17.617  -0.698
  590    HA   GLN  70           HA       GLN  70   0.991  18.470   1.875
  591   1HB   GLN  70          HB2       GLN  70   1.358  18.956  -1.043
  592   2HB   GLN  70          HB1       GLN  70   1.880  20.242   0.047
  593   1HG   GLN  70          HG2       GLN  70   2.910  18.086   1.333
  594   2HG   GLN  70          HG1       GLN  70   2.995  17.521  -0.336
  595   1HE2  GLN  70          HE2       GLN  70   5.458  17.846   0.556
  596   2HE2  GLN  70          HE2       GLN  70   6.152  19.329   0.112
  597    H    LEU  71           HN       LEU  71  -1.380  19.643  -0.492
  598    HA   LEU  71           HA       LEU  71  -2.538  21.453   1.505
  599   1HB   LEU  71          HB2       LEU  71  -2.041  23.487   0.185
  600   2HB   LEU  71          HB1       LEU  71  -0.553  22.681   0.682
  601    HG   LEU  71           HG       LEU  71  -1.320  21.508  -1.780
  602   1HD1  LEU  71          HD1       LEU  71  -2.590  23.883  -1.749
  603   2HD1  LEU  71          HD1       LEU  71  -1.886  23.208  -3.218
  604   3HD1  LEU  71          HD1       LEU  71  -1.003  24.423  -2.295
  605   1HD2  LEU  71          HD2       LEU  71   0.952  21.612  -1.547
  606   2HD2  LEU  71          HD2       LEU  71   0.887  23.123  -0.640
  607   3HD2  LEU  71          HD2       LEU  71   0.767  23.145  -2.399
  Start of MODEL   11
    1   1H    THR   1          HT1       THR   1   0.731   7.343  17.796
    2   2H    THR   1          HT2       THR   1   0.236   6.097  16.751
    3   3H    THR   1          HT3       THR   1   0.790   7.573  16.117
    4    HA   THR   1           HA       THR   1   2.979   7.037  17.334
    5    HB   THR   1           HB       THR   1   1.568   4.352  17.171
    6    HG1  THR   1           HG1      THR   1   2.376   5.936  19.381
    7   1HG2  THR   1          HG2       THR   1   4.254   5.005  18.398
    8   2HG2  THR   1          HG2       THR   1   4.076   4.408  16.748
    9   3HG2  THR   1          HG2       THR   1   3.558   3.411  18.107
   10    H    ARG   2           HN       ARG   2   4.654   6.333  15.869
   11    HA   ARG   2           HA       ARG   2   3.809   5.232  13.239
   12   1HB   ARG   2          HB2       ARG   2   3.905   7.918  13.619
   13   2HB   ARG   2          HB1       ARG   2   5.584   7.617  13.169
   14   1HG   ARG   2          HG2       ARG   2   4.886   7.634  11.022
   15   2HG   ARG   2          HG1       ARG   2   4.119   6.082  11.360
   16   1HD   ARG   2          HD2       ARG   2   2.144   7.097  10.873
   17   2HD   ARG   2          HD1       ARG   2   2.334   7.985  12.399
   18    HE   ARG   2           HE       ARG   2   2.878   9.050   9.725
   19   1HH1  ARG   2          HH2       ARG   2   1.922  10.176  12.564
   20   2HH1  ARG   2          HH2       ARG   2   3.133  11.397  12.774
   21   1HH2  ARG   2          HH1       ARG   2   5.150  10.207  10.214
   22   2HH2  ARG   2          HH1       ARG   2   4.960  11.417  11.439
   23    H    GLY   3           HN       GLY   3   6.251   5.676  11.917
   24   1HA   GLY   3          HA2       GLY   3   8.483   4.883  13.620
   25   2HA   GLY   3          HA1       GLY   3   7.875   3.562  12.621
   26    H    SER   4           HN       SER   4   9.965   3.597  11.506
   27    HA   SER   4           HA       SER   4  10.824   5.956  10.031
   28   1HB   SER   4          HB2       SER   4  12.604   4.548   9.392
   29   2HB   SER   4          HB1       SER   4  12.118   3.877  10.946
   30    HG   SER   4           HG       SER   4  12.184   2.676   8.594
   31    H    ASP   5           HN       ASP   5  11.432   4.742   7.516
   32    HA   ASP   5           HA       ASP   5   8.739   4.155   6.375
   33   1HB   ASP   5          HB2       ASP   5  10.481   6.474   6.038
   34   2HB   ASP   5          HB1       ASP   5  10.087   5.716   4.494
   35    H    ILE   6           HN       ILE   6   8.920   2.210   5.344
   36    HA   ILE   6           HA       ILE   6  11.514   1.568   3.972
   37    HB   ILE   6           HB       ILE   6   9.471  -0.261   5.279
   38   1HG1  ILE   6          HG1       ILE   6  12.205  -0.101   6.365
   39   2HG1  ILE   6          HG1       ILE   6  11.280   1.391   6.541
   40   1HG2  ILE   6          HG2       ILE   6  11.893  -0.690   3.621
   41   2HG2  ILE   6          HG2       ILE   6  10.484  -1.726   3.843
   42   3HG2  ILE   6          HG2       ILE   6  11.761  -1.700   5.060
   43   1HD1  ILE   6          HD1       ILE   6  10.992  -0.195   8.467
   44   2HD1  ILE   6          HD1       ILE   6  10.254  -1.345   7.351
   45   3HD1  ILE   6          HD1       ILE   6   9.479   0.210   7.659
   46    H    SER   7           HN       SER   7   9.662   2.989   2.497
   47    HA   SER   7           HA       SER   7   8.056   1.013   0.968
   48   1HB   SER   7          HB2       SER   7   7.423   3.424   1.944
   49   2HB   SER   7          HB1       SER   7   8.084   3.942   0.396
   50    HG   SER   7           HG       SER   7   6.523   2.877  -0.643
   51    H    LYS   8           HN       LYS   8  11.126   1.520   0.814
   52    HA   LYS   8           HA       LYS   8  11.382   2.447  -1.984
   53   1HB   LYS   8          HB2       LYS   8  13.800   2.317  -1.444
   54   2HB   LYS   8          HB1       LYS   8  12.921   3.244  -0.227
   55   1HG   LYS   8          HG2       LYS   8  13.673   1.836   1.355
   56   2HG   LYS   8          HG1       LYS   8  12.810   0.516   0.565
   57   1HD   LYS   8          HD2       LYS   8  14.756   0.187  -0.951
   58   2HD   LYS   8          HD1       LYS   8  15.624   1.447  -0.075
   59   1HE   LYS   8          HE2       LYS   8  16.186   0.005   1.582
   60   2HE   LYS   8          HE1       LYS   8  14.509  -0.555   1.741
   61   1HZ   LYS   8          HZ1       LYS   8  16.156  -2.247   0.879
   62   2HZ   LYS   8          HZ2       LYS   8  16.231  -1.322  -0.545
   63   3HZ   LYS   8          HZ3       LYS   8  14.761  -2.022  -0.060
   64    H    THR   9           HN       THR   9  10.016  -0.100  -1.423
   65    HA   THR   9           HA       THR   9  11.895  -1.949  -2.847
   66    HB   THR   9           HB       THR   9  11.556  -2.412  -0.404
   67    HG1  THR   9           HG1      THR   9  10.433  -4.298  -2.198
   68   1HG2  THR   9          HG2       THR   9   8.739  -3.215  -1.103
   69   2HG2  THR   9          HG2       THR   9   9.101  -1.579  -0.554
   70   3HG2  THR   9          HG2       THR   9   9.451  -2.955   0.490
   71    H    CYS  10           HN       CYS  10  10.836  -3.423  -4.335
   72    HA   CYS  10           HA       CYS  10   8.374  -2.331  -5.521
   73   1HB   CYS  10          HB2       CYS  10  10.156  -4.686  -6.225
   74   2HB   CYS  10          HB1       CYS  10   8.918  -3.992  -7.268
   75    H    CYS  11           HN       CYS  11   6.810  -4.240  -6.325
   76    HA   CYS  11           HA       CYS  11   6.112  -5.827  -3.882
   77   1HB   CYS  11          HB2       CYS  11   4.611  -4.436  -6.071
   78   2HB   CYS  11          HB1       CYS  11   3.856  -5.828  -5.295
   79    H    PHE  12           HN       PHE  12   5.051  -7.968  -4.379
   80    HA   PHE  12           HA       PHE  12   5.839  -9.175  -6.975
   81   1HB   PHE  12          HB2       PHE  12   6.861  -9.814  -4.224
   82   2HB   PHE  12          HB1       PHE  12   6.724 -11.114  -5.409
   83    HD1  PHE  12           HD1      PHE  12   9.008  -8.933  -4.084
   84    HD2  PHE  12           HD2      PHE  12   7.497 -10.154  -7.915
   85    HE1  PHE  12           HE1      PHE  12  11.117  -8.185  -5.154
   86    HE2  PHE  12           HE2      PHE  12   9.605  -9.406  -8.985
   87    HZ   PHE  12           HZ       PHE  12  11.416  -8.421  -7.605
   88    H    GLN  13           HN       GLN  13   4.783 -10.502  -3.829
   89    HA   GLN  13           HA       GLN  13   2.658 -12.039  -5.151
   90   1HB   GLN  13          HB2       GLN  13   4.275 -12.198  -2.840
   91   2HB   GLN  13          HB1       GLN  13   2.619 -12.029  -2.255
   92   1HG   GLN  13          HG2       GLN  13   2.308 -14.214  -2.701
   93   2HG   GLN  13          HG1       GLN  13   2.475 -13.831  -4.415
   94   1HE2  GLN  13          HE2       GLN  13   4.053 -15.316  -1.676
   95   2HE2  GLN  13          HE2       GLN  13   5.472 -15.772  -2.488
   96    H    TYR  14           HN       TYR  14   0.764 -10.969  -5.622
   97    HA   TYR  14           HA       TYR  14  -0.081  -8.654  -3.995
   98   1HB   TYR  14          HB2       TYR  14  -1.127  -9.985  -6.512
   99   2HB   TYR  14          HB1       TYR  14  -1.797  -8.505  -5.824
  100    HD1  TYR  14           HD1      TYR  14   0.360  -6.876  -5.015
  101    HD2  TYR  14           HD2      TYR  14   0.195  -9.543  -8.379
  102    HE1  TYR  14           HE1      TYR  14   2.117  -5.548  -6.155
  103    HE2  TYR  14           HE2      TYR  14   1.951  -8.215  -9.518
  104    HH   TYR  14           HH       TYR  14   2.821  -5.861  -9.432
  105    H    SER  15           HN       SER  15  -1.878  -8.681  -2.641
  106    HA   SER  15           HA       SER  15  -3.029 -11.328  -1.994
  107   1HB   SER  15          HB2       SER  15  -3.571  -8.663  -0.679
  108   2HB   SER  15          HB1       SER  15  -3.659 -10.266   0.042
  109    HG   SER  15           HG       SER  15  -1.579 -10.216   0.372
  110    H    HIS  16           HN       HIS  16  -5.480 -11.299  -1.524
  111    HA   HIS  16           HA       HIS  16  -7.022  -9.395  -3.197
  112   1HB   HIS  16          HB2       HIS  16  -6.418 -12.246  -3.803
  113   2HB   HIS  16          HB1       HIS  16  -8.077 -11.720  -4.093
  114    HD1  HIS  16           HD1      HIS  16  -6.168 -12.406  -6.460
  115    HD2  HIS  16           HD2      HIS  16  -6.760  -8.560  -4.964
  116    HE1  HIS  16           HE1      HIS  16  -5.536 -10.808  -8.321
  117    H    LYS  17           HN       LYS  17  -7.262  -9.347  -0.535
  118    HA   LYS  17           HA       LYS  17  -9.935 -10.515  -0.056
  119   1HB   LYS  17          HB2       LYS  17  -7.397 -11.494   1.025
  120   2HB   LYS  17          HB1       LYS  17  -8.554 -11.090   2.294
  121   1HG   LYS  17          HG2       LYS  17 -10.214 -12.558   1.366
  122   2HG   LYS  17          HG1       LYS  17  -9.265 -12.798  -0.102
  123   1HD   LYS  17          HD2       LYS  17  -8.234 -14.547   0.863
  124   2HD   LYS  17          HD1       LYS  17  -7.596 -13.469   2.106
  125   1HE   LYS  17          HE2       LYS  17  -8.895 -15.265   3.171
  126   2HE   LYS  17          HE1       LYS  17  -9.765 -13.730   3.361
  127   1HZ   LYS  17          HZ1       LYS  17 -11.211 -14.237   1.632
  128   2HZ   LYS  17          HZ2       LYS  17 -11.056 -15.726   2.436
  129   3HZ   LYS  17          HZ3       LYS  17 -10.201 -15.442   0.996
  130    HA   PRO  18           HA       PRO  18 -10.384  -6.685   2.069
  131   1HB   PRO  18          HB2       PRO  18 -12.360  -7.312   3.856
  132   2HB   PRO  18          HB1       PRO  18 -12.661  -7.086   2.121
  133   1HG   PRO  18          HG2       PRO  18 -12.370  -9.604   3.680
  134   2HG   PRO  18          HG1       PRO  18 -13.473  -9.221   2.348
  135   1HD   PRO  18          HD2       PRO  18 -11.203 -10.698   2.037
  136   2HD   PRO  18          HD1       PRO  18 -11.914  -9.708   0.742
  137    H    LEU  19           HN       LEU  19  -8.618  -6.197   3.354
  138    HA   LEU  19           HA       LEU  19  -7.706  -7.808   5.574
  139   1HB   LEU  19          HB2       LEU  19  -6.436  -6.147   4.097
  140   2HB   LEU  19          HB1       LEU  19  -7.215  -4.865   5.023
  141    HG   LEU  19           HG       LEU  19  -6.290  -5.983   7.116
  142   1HD1  LEU  19          HD1       LEU  19  -4.146  -7.236   5.527
  143   2HD1  LEU  19          HD1       LEU  19  -5.709  -8.042   5.389
  144   3HD1  LEU  19          HD1       LEU  19  -4.965  -7.827   6.974
  145   1HD2  LEU  19          HD2       LEU  19  -4.618  -4.465   6.990
  146   2HD2  LEU  19          HD2       LEU  19  -5.155  -4.161   5.338
  147   3HD2  LEU  19          HD2       LEU  19  -3.857  -5.314   5.645
  148    HA   PRO  20           HA       PRO  20 -10.605  -6.416   8.611
  149   1HB   PRO  20          HB2       PRO  20  -9.106  -6.838  10.874
  150   2HB   PRO  20          HB1       PRO  20  -9.896  -8.147   9.971
  151   1HG   PRO  20          HG2       PRO  20  -7.057  -7.226   9.865
  152   2HG   PRO  20          HG1       PRO  20  -7.704  -8.875   9.904
  153   1HD   PRO  20          HD2       PRO  20  -6.863  -7.749   7.618
  154   2HD   PRO  20          HD1       PRO  20  -8.249  -8.861   7.655
  155    H    TRP  21           HN       TRP  21 -10.893  -4.217   8.541
  156    HA   TRP  21           HA       TRP  21  -9.045  -2.144   8.534
  157   1HB   TRP  21          HB2       TRP  21 -11.800  -2.372   9.774
  158   2HB   TRP  21          HB1       TRP  21 -10.972  -0.832   9.530
  159    HD1  TRP  21           HD1      TRP  21 -12.957  -3.452   7.738
  160    HE1  TRP  21           HE1      TRP  21 -13.181  -2.829   5.246
  161    HE3  TRP  21           HE3      TRP  21  -9.612   0.397   7.490
  162    HZ2  TRP  21           HZ2      TRP  21 -12.080  -0.945   3.392
  163    HZ3  TRP  21           HZ3      TRP  21  -9.218   1.586   5.352
  164    HH2  TRP  21           HH2      TRP  21 -10.448   0.921   3.304
  165    H    THR  22           HN       THR  22 -10.081  -4.065  11.287
  166    HA   THR  22           HA       THR  22  -9.273  -2.399  13.434
  167    HB   THR  22           HB       THR  22  -8.806  -4.794  14.434
  168    HG1  THR  22           HG1      THR  22  -8.779  -6.213  12.898
  169   1HG2  THR  22          HG2       THR  22 -11.331  -3.497  13.552
  170   2HG2  THR  22          HG2       THR  22 -10.804  -3.943  15.175
  171   3HG2  THR  22          HG2       THR  22 -11.448  -5.173  14.088
  172    H    TRP  23           HN       TRP  23  -7.381  -4.553  11.338
  173    HA   TRP  23           HA       TRP  23  -4.896  -3.776  12.782
  174   1HB   TRP  23          HB2       TRP  23  -5.464  -5.932  10.726
  175   2HB   TRP  23          HB1       TRP  23  -3.960  -5.738  11.623
  176    HD1  TRP  23           HD1      TRP  23  -5.705  -4.949  14.370
  177    HE1  TRP  23           HE1      TRP  23  -6.644  -6.931  15.726
  178    HE3  TRP  23           HE3      TRP  23  -5.548  -8.596  10.808
  179    HZ2  TRP  23           HZ2      TRP  23  -7.249  -9.702  15.346
  180    HZ3  TRP  23           HZ3      TRP  23  -6.311 -10.899  11.328
  181    HH2  TRP  23           HH2      TRP  23  -7.159 -11.455  13.590
  182    H    VAL  24           HN       VAL  24  -6.664  -2.823  10.060
  183    HA   VAL  24           HA       VAL  24  -4.352  -2.394   8.298
  184    HB   VAL  24           HB       VAL  24  -7.181  -1.302   8.147
  185   1HG1  VAL  24          HG1       VAL  24  -6.706  -0.783   5.921
  186   2HG1  VAL  24          HG1       VAL  24  -5.401  -1.964   5.820
  187   3HG1  VAL  24          HG1       VAL  24  -5.152  -0.447   6.685
  188   1HG2  VAL  24          HG2       VAL  24  -6.726  -3.491   6.368
  189   2HG2  VAL  24          HG2       VAL  24  -7.864  -3.411   7.712
  190   3HG2  VAL  24          HG2       VAL  24  -6.227  -4.005   7.979
  191    H    ARG  25           HN       ARG  25  -3.181  -0.468   8.139
  192    HA   ARG  25           HA       ARG  25  -4.035   1.757   9.968
  193   1HB   ARG  25          HB2       ARG  25  -2.020   0.354  10.579
  194   2HB   ARG  25          HB1       ARG  25  -1.235   0.970   9.125
  195   1HG   ARG  25          HG2       ARG  25  -2.088   3.300  10.222
  196   2HG   ARG  25          HG1       ARG  25  -1.820   2.350  11.684
  197   1HD   ARG  25          HD2       ARG  25   0.265   2.449   9.495
  198   2HD   ARG  25          HD1       ARG  25   0.208   3.675  10.778
  199    HE   ARG  25           HE       ARG  25   0.466   0.738  11.313
  200   1HH1  ARG  25          HH2       ARG  25  -0.342   3.156  13.247
  201   2HH1  ARG  25          HH2       ARG  25   1.123   3.248  14.166
  202   1HH2  ARG  25          HH1       ARG  25   2.925   1.232  11.994
  203   2HH2  ARG  25          HH1       ARG  25   2.973   2.157  13.458
  204    H    SER  26           HN       SER  26  -2.132   1.110   6.977
  205    HA   SER  26           HA       SER  26  -3.350   3.414   5.645
  206   1HB   SER  26          HB2       SER  26  -1.438   4.837   5.660
  207   2HB   SER  26          HB1       SER  26  -1.600   4.275   7.318
  208    HG   SER  26           HG       SER  26   0.255   3.321   7.122
  209    H    TYR  27           HN       TYR  27  -1.247   3.882   3.798
  210    HA   TYR  27           HA       TYR  27  -0.564   1.226   2.661
  211   1HB   TYR  27          HB2       TYR  27  -1.853   1.578   0.682
  212   2HB   TYR  27          HB1       TYR  27  -2.917   2.039   2.007
  213    HD1  TYR  27           HD1      TYR  27  -1.478   3.079  -1.072
  214    HD2  TYR  27           HD2      TYR  27  -2.874   4.564   2.707
  215    HE1  TYR  27           HE1      TYR  27  -1.702   5.344  -2.048
  216    HE2  TYR  27           HE2      TYR  27  -3.099   6.831   1.733
  217    HH   TYR  27           HH       TYR  27  -2.591   7.409  -1.719
  218    H    GLU  28           HN       GLU  28   0.297   1.985   0.184
  219    HA   GLU  28           HA       GLU  28   1.748   4.438  -0.020
  220   1HB   GLU  28          HB2       GLU  28   4.036   3.469   0.468
  221   2HB   GLU  28          HB1       GLU  28   3.004   3.607   1.889
  222   1HG   GLU  28          HG2       GLU  28   2.319   1.201   1.510
  223   2HG   GLU  28          HG1       GLU  28   3.574   1.111   0.273
  224    H    PHE  29           HN       PHE  29   2.548   4.598  -2.121
  225    HA   PHE  29           HA       PHE  29   2.128   2.264  -3.892
  226   1HB   PHE  29          HB2       PHE  29   1.631   4.940  -4.088
  227   2HB   PHE  29          HB1       PHE  29   3.174   4.835  -4.933
  228    HD1  PHE  29           HD1      PHE  29   3.305   2.572  -6.488
  229    HD2  PHE  29           HD2      PHE  29  -0.252   4.743  -5.439
  230    HE1  PHE  29           HE1      PHE  29   2.152   1.649  -8.480
  231    HE2  PHE  29           HE2      PHE  29  -1.403   3.820  -7.430
  232    HZ   PHE  29           HZ       PHE  29  -0.201   2.273  -8.951
  233    H    THR  30           HN       THR  30   3.813   1.299  -5.102
  234    HA   THR  30           HA       THR  30   6.387   1.051  -3.993
  235    HB   THR  30           HB       THR  30   6.882   0.370  -6.493
  236    HG1  THR  30           HG1      THR  30   5.315   0.832  -7.782
  237   1HG2  THR  30          HG2       THR  30   4.745  -0.932  -4.783
  238   2HG2  THR  30          HG2       THR  30   6.479  -1.252  -4.726
  239   3HG2  THR  30          HG2       THR  30   5.544  -1.713  -6.149
  240    H    SER  31           HN       SER  31   8.472   1.868  -4.837
  241    HA   SER  31           HA       SER  31   8.596   4.702  -5.092
  242   1HB   SER  31          HB2       SER  31  10.420   3.255  -4.295
  243   2HB   SER  31          HB1       SER  31  10.547   2.511  -5.886
  244    HG   SER  31           HG       SER  31  12.072   4.224  -5.506
  245    H    ASN  32           HN       ASN  32   9.750   5.741  -7.084
  246    HA   ASN  32           HA       ASN  32   8.125   5.126  -9.470
  247   1HB   ASN  32          HB2       ASN  32   9.198   7.243 -10.275
  248   2HB   ASN  32          HB1       ASN  32   8.418   7.431  -8.705
  249   1HD2  ASN  32          HD2       ASN  32  11.647   6.772 -10.162
  250   2HD2  ASN  32          HD2       ASN  32  12.526   7.495  -8.902
  251    H    SER  33           HN       SER  33   9.886   3.010  -8.977
  252    HA   SER  33           HA       SER  33  11.389   2.906 -11.460
  253   1HB   SER  33          HB2       SER  33  13.585   3.107 -10.594
  254   2HB   SER  33          HB1       SER  33  12.698   4.384  -9.766
  255    HG   SER  33           HG       SER  33  13.754   3.278  -8.192
  256    H    CYS  34           HN       CYS  34   9.437   1.205 -10.413
  257    HA   CYS  34           HA       CYS  34  10.999  -1.184  -9.487
  258   1HB   CYS  34          HB2       CYS  34   8.326  -0.008  -8.886
  259   2HB   CYS  34          HB1       CYS  34   8.427  -1.769  -8.907
  260    H    SER  35           HN       SER  35  10.556  -3.196 -10.534
  261    HA   SER  35           HA       SER  35   9.877  -3.053 -13.340
  262   1HB   SER  35          HB2       SER  35   9.970  -5.509 -11.574
  263   2HB   SER  35          HB1       SER  35  10.387  -5.388 -13.281
  264    HG   SER  35           HG       SER  35  12.222  -4.321 -12.762
  265    H    GLN  36           HN       GLN  36   8.087  -3.881 -10.414
  266    HA   GLN  36           HA       GLN  36   5.640  -4.300 -12.103
  267   1HB   GLN  36          HB2       GLN  36   6.911  -5.822  -9.912
  268   2HB   GLN  36          HB1       GLN  36   5.167  -5.616  -9.742
  269   1HG   GLN  36          HG2       GLN  36   5.025  -6.361 -12.209
  270   2HG   GLN  36          HG1       GLN  36   6.685  -6.919 -12.002
  271   1HE2  GLN  36          HE2       GLN  36   5.170  -9.021 -12.495
  272   2HE2  GLN  36          HE2       GLN  36   4.691  -9.858 -11.098
  273    H    ARG  37           HN       ARG  37   5.012  -2.053 -11.857
  274    HA   ARG  37           HA       ARG  37   4.950  -0.604  -9.411
  275   1HB   ARG  37          HB2       ARG  37   3.287   0.780 -10.641
  276   2HB   ARG  37          HB1       ARG  37   4.671   0.365 -11.653
  277   1HG   ARG  37          HG2       ARG  37   3.281  -0.579 -13.146
  278   2HG   ARG  37          HG1       ARG  37   2.767  -1.737 -11.918
  279   1HD   ARG  37          HD2       ARG  37   0.899  -0.454 -11.303
  280   2HD   ARG  37          HD1       ARG  37   1.603   1.046 -11.939
  281    HE   ARG  37           HE       ARG  37   1.176   0.222 -14.208
  282   1HH1  ARG  37          HH1       ARG  37   0.607  -2.297 -12.012
  283   2HH1  ARG  37          HH1       ARG  37  -0.807  -2.893 -12.816
  284   1HH2  ARG  37          HH2       ARG  37  -0.943  -0.280 -15.090
  285   2HH2  ARG  37          HH2       ARG  37  -1.684  -1.751 -14.557
  286    H    ALA  38           HN       ALA  38   3.555  -0.691  -7.671
  287    HA   ALA  38           HA       ALA  38   0.846  -1.747  -7.886
  288   1HB   ALA  38          HB1       ALA  38   1.758  -3.885  -7.880
  289   2HB   ALA  38          HB2       ALA  38   1.604  -3.609  -6.145
  290   3HB   ALA  38          HB3       ALA  38   3.163  -3.389  -6.938
  291    H    VAL  39           HN       VAL  39  -0.356  -1.307  -5.972
  292    HA   VAL  39           HA       VAL  39   0.908   0.626  -4.134
  293    HB   VAL  39           HB       VAL  39  -1.908  -0.481  -4.401
  294   1HG1  VAL  39          HG1       VAL  39  -0.652   1.587  -2.632
  295   2HG1  VAL  39          HG1       VAL  39  -1.909   0.410  -2.255
  296   3HG1  VAL  39          HG1       VAL  39  -2.300   1.845  -3.201
  297   1HG2  VAL  39          HG2       VAL  39  -2.104   0.918  -6.156
  298   2HG2  VAL  39          HG2       VAL  39  -0.404   1.356  -5.995
  299   3HG2  VAL  39          HG2       VAL  39  -1.637   2.273  -5.130
  300    H    ILE  40           HN       ILE  40   0.544   0.339  -1.737
  301    HA   ILE  40           HA       ILE  40   0.416  -2.533  -0.917
  302    HB   ILE  40           HB       ILE  40   2.503  -0.421  -0.333
  303   1HG1  ILE  40          HG1       ILE  40   3.405  -3.100  -0.985
  304   2HG1  ILE  40          HG1       ILE  40   2.312  -2.485  -2.226
  305   1HG2  ILE  40          HG2       ILE  40   3.251  -2.819   0.923
  306   2HG2  ILE  40          HG2       ILE  40   1.566  -2.564   1.378
  307   3HG2  ILE  40          HG2       ILE  40   2.767  -1.318   1.714
  308   1HD1  ILE  40          HD1       ILE  40   3.936  -1.146  -3.018
  309   2HD1  ILE  40          HD1       ILE  40   5.046  -1.805  -1.816
  310   3HD1  ILE  40          HD1       ILE  40   4.089  -0.373  -1.440
  311    H    PHE  41           HN       PHE  41  -0.722  -2.845   0.970
  312    HA   PHE  41           HA       PHE  41  -1.723  -0.424   2.427
  313   1HB   PHE  41          HB2       PHE  41  -2.825  -3.255   2.214
  314   2HB   PHE  41          HB1       PHE  41  -3.622  -1.895   3.004
  315    HD1  PHE  41           HD1      PHE  41  -3.826  -3.790   0.181
  316    HD2  PHE  41           HD2      PHE  41  -3.431   0.333   1.302
  317    HE1  PHE  41           HE1      PHE  41  -4.820  -3.105  -1.986
  318    HE2  PHE  41           HE2      PHE  41  -4.421   1.022  -0.864
  319    HZ   PHE  41           HZ       PHE  41  -5.119  -0.697  -2.507
  320    H    THR  42           HN       THR  42  -0.783  -0.213   4.463
  321    HA   THR  42           HA       THR  42   0.578  -2.603   5.577
  322    HB   THR  42           HB       THR  42   1.864  -0.534   5.269
  323    HG1  THR  42           HG1      THR  42   2.837  -0.865   7.099
  324   1HG2  THR  42          HG2       THR  42   0.171   1.144   5.418
  325   2HG2  THR  42          HG2       THR  42   1.254   1.414   6.782
  326   3HG2  THR  42          HG2       THR  42  -0.296   0.617   7.033
  327    H    THR  43           HN       THR  43   0.317  -3.147   7.826
  328    HA   THR  43           HA       THR  43  -2.443  -2.614   8.798
  329    HB   THR  43           HB       THR  43  -1.611  -4.597  10.340
  330    HG1  THR  43           HG1      THR  43   0.471  -4.772   9.871
  331   1HG2  THR  43          HG2       THR  43  -2.745  -4.428   7.678
  332   2HG2  THR  43          HG2       THR  43  -3.134  -5.547   8.984
  333   3HG2  THR  43          HG2       THR  43  -1.817  -5.914   7.870
  334    H    LYS  44           HN       LYS  44  -2.145  -3.140  11.488
  335    HA   LYS  44           HA       LYS  44  -0.900  -0.660  12.459
  336   1HB   LYS  44          HB2       LYS  44  -3.033  -2.434  13.145
  337   2HB   LYS  44          HB1       LYS  44  -1.947  -2.325  14.532
  338   1HG   LYS  44          HG2       LYS  44  -2.550  -0.188  14.960
  339   2HG   LYS  44          HG1       LYS  44  -2.407   0.271  13.263
  340   1HD   LYS  44          HD2       LYS  44  -4.611  -0.520  12.766
  341   2HD   LYS  44          HD1       LYS  44  -4.745  -1.325  14.330
  342   1HE   LYS  44          HE2       LYS  44  -4.130   1.510  14.652
  343   2HE   LYS  44          HE1       LYS  44  -5.638   1.259  13.749
  344   1HZ   LYS  44          HZ1       LYS  44  -6.501  -0.102  15.426
  345   2HZ   LYS  44          HZ2       LYS  44  -5.799   1.194  16.272
  346   3HZ   LYS  44          HZ3       LYS  44  -4.994  -0.300  16.180
  347    H    ARG  45           HN       ARG  45  -0.027  -3.996  12.218
  348    HA   ARG  45           HA       ARG  45   1.790  -4.002  14.523
  349   1HB   ARG  45          HB2       ARG  45   0.464  -5.938  13.432
  350   2HB   ARG  45          HB1       ARG  45   1.731  -5.936  12.204
  351   1HG   ARG  45          HG2       ARG  45   3.370  -6.635  13.697
  352   2HG   ARG  45          HG1       ARG  45   2.526  -5.968  15.094
  353   1HD   ARG  45          HD2       ARG  45   0.848  -7.968  13.888
  354   2HD   ARG  45          HD1       ARG  45   2.458  -8.658  14.174
  355    HE   ARG  45           HE       ARG  45   2.112  -7.396  16.511
  356   1HH1  ARG  45          HH1       ARG  45   0.880 -10.198  15.324
  357   2HH1  ARG  45          HH1       ARG  45  -0.514 -10.270  16.350
  358   1HH2  ARG  45          HH2       ARG  45  -0.125  -7.039  17.549
  359   2HH2  ARG  45          HH2       ARG  45  -1.080  -8.483  17.614
  360    H    GLY  46           HN       GLY  46   1.962  -2.954  11.237
  361   1HA   GLY  46          HA2       GLY  46   3.925  -1.593  10.602
  362   2HA   GLY  46          HA1       GLY  46   4.927  -2.724  11.511
  363    H    LYS  47           HN       LYS  47   2.643  -4.565   9.934
  364    HA   LYS  47           HA       LYS  47   4.611  -5.453   7.943
  365   1HB   LYS  47          HB2       LYS  47   1.883  -6.307   8.912
  366   2HB   LYS  47          HB1       LYS  47   2.616  -7.065   7.497
  367   1HG   LYS  47          HG2       LYS  47   4.658  -6.993   9.423
  368   2HG   LYS  47          HG1       LYS  47   3.212  -7.482  10.306
  369   1HD   LYS  47          HD2       LYS  47   3.481  -8.799   7.695
  370   2HD   LYS  47          HD1       LYS  47   4.798  -9.172   8.808
  371   1HE   LYS  47          HE2       LYS  47   2.384  -9.261  10.323
  372   2HE   LYS  47          HE1       LYS  47   2.120 -10.205   8.843
  373   1HZ   LYS  47          HZ1       LYS  47   3.212 -11.525  10.580
  374   2HZ   LYS  47          HZ2       LYS  47   4.503 -10.422  10.608
  375   3HZ   LYS  47          HZ3       LYS  47   4.201 -11.345   9.214
  376    H    LYS  48           HN       LYS  48   4.012  -5.614   5.620
  377    HA   LYS  48           HA       LYS  48   1.956  -3.600   4.792
  378   1HB   LYS  48          HB2       LYS  48   4.835  -3.951   3.983
  379   2HB   LYS  48          HB1       LYS  48   3.693  -3.106   2.938
  380   1HG   LYS  48          HG2       LYS  48   4.165  -1.261   4.153
  381   2HG   LYS  48          HG1       LYS  48   3.204  -2.001   5.433
  382   1HD   LYS  48          HD2       LYS  48   5.195  -1.640   6.567
  383   2HD   LYS  48          HD1       LYS  48   5.468  -3.272   5.956
  384   1HE   LYS  48          HE2       LYS  48   6.374  -1.856   3.833
  385   2HE   LYS  48          HE1       LYS  48   6.750  -0.715   5.139
  386   1HZ   LYS  48          HZ1       LYS  48   8.568  -2.158   5.115
  387   2HZ   LYS  48          HZ2       LYS  48   7.604  -3.533   4.858
  388   3HZ   LYS  48          HZ3       LYS  48   7.601  -2.760   6.371
  389    H    VAL  49           HN       VAL  49   0.631  -4.285   3.153
  390    HA   VAL  49           HA       VAL  49   1.278  -6.922   1.872
  391    HB   VAL  49           HB       VAL  49  -1.344  -5.488   2.416
  392   1HG1  VAL  49          HG1       VAL  49  -1.025  -8.345   1.508
  393   2HG1  VAL  49          HG1       VAL  49  -1.143  -7.032   0.337
  394   3HG1  VAL  49          HG1       VAL  49  -2.466  -7.331   1.464
  395   1HG2  VAL  49          HG2       VAL  49  -1.627  -7.564   3.916
  396   2HG2  VAL  49          HG2       VAL  49  -0.508  -6.322   4.479
  397   3HG2  VAL  49          HG2       VAL  49   0.111  -7.791   3.725
  398    H    CYS  50           HN       CYS  50   1.631  -6.877  -0.318
  399    HA   CYS  50           HA       CYS  50   1.415  -4.359  -1.802
  400   1HB   CYS  50          HB2       CYS  50   2.387  -7.166  -2.251
  401   2HB   CYS  50          HB1       CYS  50   2.146  -6.118  -3.648
  402    H    THR  51           HN       THR  51   0.118  -4.133  -3.769
  403    HA   THR  51           HA       THR  51  -1.981  -6.129  -4.326
  404    HB   THR  51           HB       THR  51  -3.642  -4.063  -3.987
  405    HG1  THR  51           HG1      THR  51  -1.723  -3.616  -1.967
  406   1HG2  THR  51          HG2       THR  51  -2.987  -6.385  -2.567
  407   2HG2  THR  51          HG2       THR  51  -4.437  -5.402  -2.361
  408   3HG2  THR  51          HG2       THR  51  -3.023  -5.110  -1.349
  409    H    HIS  52           HN       HIS  52  -3.183  -5.557  -6.307
  410    HA   HIS  52           HA       HIS  52  -1.525  -4.046  -8.201
  411   1HB   HIS  52          HB2       HIS  52  -3.779  -5.972  -8.203
  412   2HB   HIS  52          HB1       HIS  52  -3.748  -4.844  -9.559
  413    HD1  HIS  52           HD1      HIS  52  -0.837  -4.564 -10.194
  414    HD2  HIS  52           HD2      HIS  52  -2.505  -8.237  -9.139
  415    HE1  HIS  52           HE1      HIS  52   0.719  -6.345 -11.101
  416    HA   PRO  53           HA       PRO  53  -3.940  -0.352  -7.775
  417   1HB   PRO  53          HB2       PRO  53  -3.090   0.952 -10.022
  418   2HB   PRO  53          HB1       PRO  53  -2.090   0.788  -8.565
  419   1HG   PRO  53          HG2       PRO  53  -1.958  -0.702 -11.127
  420   2HG   PRO  53          HG1       PRO  53  -0.655  -0.201 -10.041
  421   1HD   PRO  53          HD2       PRO  53  -1.683  -2.755 -10.185
  422   2HD   PRO  53          HD1       PRO  53  -0.814  -2.090  -8.787
  423    H    ARG  54           HN       ARG  54  -3.908  -2.177 -10.810
  424    HA   ARG  54           HA       ARG  54  -6.107  -0.936 -12.122
  425   1HB   ARG  54          HB2       ARG  54  -4.719  -3.588 -12.140
  426   2HB   ARG  54          HB1       ARG  54  -6.242  -3.446 -13.020
  427   1HG   ARG  54          HG2       ARG  54  -5.261  -1.358 -14.114
  428   2HG   ARG  54          HG1       ARG  54  -3.709  -1.845 -13.432
  429   1HD   ARG  54          HD2       ARG  54  -3.493  -3.032 -15.380
  430   2HD   ARG  54          HD1       ARG  54  -4.577  -4.194 -14.588
  431    HE   ARG  54           HE       ARG  54  -5.729  -1.915 -16.136
  432   1HH1  ARG  54          HH1       ARG  54  -4.828  -4.272 -17.800
  433   2HH1  ARG  54          HH1       ARG  54  -6.276  -5.220 -17.876
  434   1HH2  ARG  54          HH2       ARG  54  -7.811  -3.568 -15.242
  435   2HH2  ARG  54          HH2       ARG  54  -7.965  -4.821 -16.427
  436    H    LYS  55           HN       LYS  55  -6.007  -3.547  -9.698
  437    HA   LYS  55           HA       LYS  55  -8.765  -4.281  -9.802
  438   1HB   LYS  55          HB2       LYS  55  -6.405  -4.645  -8.108
  439   2HB   LYS  55          HB1       LYS  55  -7.902  -4.628  -7.177
  440   1HG   LYS  55          HG2       LYS  55  -8.265  -6.753  -7.823
  441   2HG   LYS  55          HG1       LYS  55  -8.444  -6.171  -9.478
  442   1HD   LYS  55          HD2       LYS  55  -5.654  -6.439  -8.514
  443   2HD   LYS  55          HD1       LYS  55  -6.538  -7.952  -8.727
  444   1HE   LYS  55          HE2       LYS  55  -6.609  -5.849 -10.891
  445   2HE   LYS  55          HE1       LYS  55  -5.255  -6.993 -10.788
  446   1HZ   LYS  55          HZ1       LYS  55  -8.068  -7.891 -10.624
  447   2HZ   LYS  55          HZ2       LYS  55  -6.684  -8.817 -10.953
  448   3HZ   LYS  55          HZ3       LYS  55  -7.280  -7.732 -12.116
  449    H    LYS  56           HN       LYS  56 -10.465  -2.936  -9.405
  450    HA   LYS  56           HA       LYS  56 -10.399  -0.338  -8.358
  451   1HB   LYS  56          HB2       LYS  56 -12.323  -2.414  -9.016
  452   2HB   LYS  56          HB1       LYS  56 -12.875  -1.457  -7.640
  453   1HG   LYS  56          HG2       LYS  56 -12.231   0.607  -9.038
  454   2HG   LYS  56          HG1       LYS  56 -12.154  -0.499 -10.411
  455   1HD   LYS  56          HD2       LYS  56 -14.417  -0.762 -10.493
  456   2HD   LYS  56          HD1       LYS  56 -14.581  -0.748  -8.737
  457   1HE   LYS  56          HE2       LYS  56 -14.256   1.719  -8.736
  458   2HE   LYS  56          HE1       LYS  56 -14.162   1.688 -10.508
  459   1HZ   LYS  56          HZ1       LYS  56 -16.448   2.071  -9.468
  460   2HZ   LYS  56          HZ2       LYS  56 -16.408   0.421  -9.064
  461   3HZ   LYS  56          HZ3       LYS  56 -16.332   0.903 -10.692
  462    H    TRP  57           HN       TRP  57 -11.096  -3.367  -6.571
  463    HA   TRP  57           HA       TRP  57 -11.670  -2.313  -4.048
  464   1HB   TRP  57          HB2       TRP  57 -11.811  -4.549  -3.752
  465   2HB   TRP  57          HB1       TRP  57 -10.978  -4.802  -5.276
  466    HD1  TRP  57           HD1      TRP  57  -8.418  -5.410  -5.202
  467    HE1  TRP  57           HE1      TRP  57  -6.856  -6.177  -3.300
  468    HE3  TRP  57           HE3      TRP  57 -11.320  -4.261  -1.160
  469    HZ2  TRP  57           HZ2      TRP  57  -6.840  -6.289  -0.442
  470    HZ3  TRP  57           HZ3      TRP  57 -10.508  -4.708   1.138
  471    HH2  TRP  57           HH2      TRP  57  -8.274  -5.720   1.501
  472    H    VAL  58           HN       VAL  58  -8.429  -2.906  -5.445
  473    HA   VAL  58           HA       VAL  58  -6.923  -2.160  -3.125
  474    HB   VAL  58           HB       VAL  58  -6.296  -1.921  -6.082
  475   1HG1  VAL  58          HG1       VAL  58  -3.953  -2.024  -5.379
  476   2HG1  VAL  58          HG1       VAL  58  -4.443  -2.156  -3.692
  477   3HG1  VAL  58          HG1       VAL  58  -4.749  -0.666  -4.584
  478   1HG2  VAL  58          HG2       VAL  58  -5.954  -4.178  -4.085
  479   2HG2  VAL  58          HG2       VAL  58  -5.183  -4.155  -5.671
  480   3HG2  VAL  58          HG2       VAL  58  -6.942  -4.192  -5.545
  481    H    GLN  59           HN       GLN  59  -7.820  -0.234  -6.020
  482    HA   GLN  59           HA       GLN  59  -6.716   2.238  -5.179
  483   1HB   GLN  59          HB2       GLN  59  -9.092   1.468  -6.898
  484   2HB   GLN  59          HB1       GLN  59  -8.516   3.129  -6.762
  485   1HG   GLN  59          HG2       GLN  59  -6.310   1.316  -7.272
  486   2HG   GLN  59          HG1       GLN  59  -7.551   1.158  -8.515
  487   1HE2  GLN  59          HE2       GLN  59  -7.863   2.926  -9.969
  488   2HE2  GLN  59          HE2       GLN  59  -6.903   4.326  -9.941
  489    H    LYS  60           HN       LYS  60  -9.768   0.639  -4.413
  490    HA   LYS  60           HA       LYS  60 -11.033   2.878  -3.147
  491   1HB   LYS  60          HB2       LYS  60 -11.665   0.287  -3.864
  492   2HB   LYS  60          HB1       LYS  60 -11.642   0.196  -2.102
  493   1HG   LYS  60          HG2       LYS  60 -13.036   2.417  -2.243
  494   2HG   LYS  60          HG1       LYS  60 -13.384   1.874  -3.885
  495   1HD   LYS  60          HD2       LYS  60 -13.756  -0.419  -2.367
  496   2HD   LYS  60          HD1       LYS  60 -14.407   0.858  -1.340
  497   1HE   LYS  60          HE2       LYS  60 -15.996   1.523  -2.970
  498   2HE   LYS  60          HE1       LYS  60 -15.137   0.677  -4.272
  499   1HZ   LYS  60          HZ1       LYS  60 -16.834  -0.789  -3.686
  500   2HZ   LYS  60          HZ2       LYS  60 -16.670  -0.480  -2.024
  501   3HZ   LYS  60          HZ3       LYS  60 -15.491  -1.389  -2.841
  502    H    TYR  61           HN       TYR  61  -8.700   0.463  -2.063
  503    HA   TYR  61           HA       TYR  61  -8.966   1.119   0.771
  504   1HB   TYR  61          HB2       TYR  61  -7.478  -0.695  -0.986
  505   2HB   TYR  61          HB1       TYR  61  -6.504  -0.101   0.358
  506    HD1  TYR  61           HD1      TYR  61  -6.447  -1.711   2.060
  507    HD2  TYR  61           HD2      TYR  61 -10.151  -0.914   0.034
  508    HE1  TYR  61           HE1      TYR  61  -7.624  -3.259   3.597
  509    HE2  TYR  61           HE2      TYR  61 -11.326  -2.461   1.571
  510    HH   TYR  61           HH       TYR  61 -11.011  -4.118   3.109
  511    H    ILE  62           HN       ILE  62  -7.088   2.313  -1.946
  512    HA   ILE  62           HA       ILE  62  -5.032   3.670  -0.443
  513    HB   ILE  62           HB       ILE  62  -6.281   4.308  -3.141
  514   1HG1  ILE  62          HG1       ILE  62  -3.920   2.545  -2.414
  515   2HG1  ILE  62          HG1       ILE  62  -5.486   1.973  -2.985
  516   1HG2  ILE  62          HG2       ILE  62  -3.451   4.819  -2.899
  517   2HG2  ILE  62          HG2       ILE  62  -4.318   5.665  -1.618
  518   3HG2  ILE  62          HG2       ILE  62  -4.744   5.947  -3.306
  519   1HD1  ILE  62          HD1       ILE  62  -3.361   3.471  -4.495
  520   2HD1  ILE  62          HD1       ILE  62  -5.046   3.577  -5.007
  521   3HD1  ILE  62          HD1       ILE  62  -4.235   2.012  -4.962
  522    H    SER  63           HN       SER  63  -8.064   4.864  -1.944
  523    HA   SER  63           HA       SER  63  -7.945   7.501  -0.827
  524   1HB   SER  63          HB2       SER  63  -9.380   6.791  -2.714
  525   2HB   SER  63          HB1       SER  63 -10.293   5.745  -1.631
  526    HG   SER  63           HG       SER  63 -11.348   7.428  -0.941
  527    H    LEU  64           HN       LEU  64  -9.307   4.443   0.352
  528    HA   LEU  64           HA       LEU  64 -10.607   5.525   2.692
  529   1HB   LEU  64          HB2       LEU  64  -9.602   2.812   1.804
  530   2HB   LEU  64          HB1       LEU  64 -10.392   3.036   3.365
  531    HG   LEU  64           HG       LEU  64 -11.660   4.001   0.802
  532   1HD1  LEU  64          HD1       LEU  64 -12.753   1.527   1.899
  533   2HD1  LEU  64          HD1       LEU  64 -11.086   1.327   1.359
  534   3HD1  LEU  64          HD1       LEU  64 -12.313   1.912   0.236
  535   1HD2  LEU  64          HD2       LEU  64 -13.595   4.223   2.096
  536   2HD2  LEU  64          HD2       LEU  64 -12.342   4.651   3.262
  537   3HD2  LEU  64          HD2       LEU  64 -13.055   3.037   3.286
  538    H    LEU  65           HN       LEU  65  -7.429   3.975   2.154
  539    HA   LEU  65           HA       LEU  65  -6.597   4.356   4.928
  540   1HB   LEU  65          HB2       LEU  65  -5.238   3.491   2.360
  541   2HB   LEU  65          HB1       LEU  65  -4.400   3.544   3.909
  542    HG   LEU  65           HG       LEU  65  -6.838   1.873   3.220
  543   1HD1  LEU  65          HD1       LEU  65  -4.996   0.154   4.174
  544   2HD1  LEU  65          HD1       LEU  65  -3.915   1.381   3.518
  545   3HD1  LEU  65          HD1       LEU  65  -5.083   0.586   2.467
  546   1HD2  LEU  65          HD2       LEU  65  -5.898   1.066   5.697
  547   2HD2  LEU  65          HD2       LEU  65  -7.324   2.065   5.429
  548   3HD2  LEU  65          HD2       LEU  65  -5.771   2.820   5.786
  549    H    LYS  66           HN       LYS  66  -7.307   6.850   4.290
  550    HA   LYS  66           HA       LYS  66  -6.535   9.075   4.056
  551   1HB   LYS  66          HB2       LYS  66  -4.337   7.419   5.237
  552   2HB   LYS  66          HB1       LYS  66  -3.978   9.092   4.809
  553   1HG   LYS  66          HG2       LYS  66  -6.377   8.317   6.480
  554   2HG   LYS  66          HG1       LYS  66  -4.814   8.727   7.188
  555   1HD   LYS  66          HD2       LYS  66  -4.893  10.916   5.977
  556   2HD   LYS  66          HD1       LYS  66  -6.517  10.509   5.422
  557   1HE   LYS  66          HE2       LYS  66  -7.118  11.642   7.341
  558   2HE   LYS  66          HE1       LYS  66  -6.806  10.064   8.094
  559   1HZ   LYS  66          HZ1       LYS  66  -5.472  11.595   9.263
  560   2HZ   LYS  66          HZ2       LYS  66  -4.949  12.361   7.839
  561   3HZ   LYS  66          HZ3       LYS  66  -4.410  10.793   8.210
  562    H    THR  67           HN       THR  67  -4.389  10.293   3.094
  563    HA   THR  67           HA       THR  67  -3.322   8.938   0.704
  564    HB   THR  67           HB       THR  67  -4.944  11.466   0.449
  565    HG1  THR  67           HG1      THR  67  -6.656  10.288   0.585
  566   1HG2  THR  67          HG2       THR  67  -5.071  10.084  -1.917
  567   2HG2  THR  67          HG2       THR  67  -3.456   9.671  -1.344
  568   3HG2  THR  67          HG2       THR  67  -3.908  11.361  -1.565
  569    HA   PRO  68           HA       PRO  68  -0.457  11.998   2.600
  570   1HB   PRO  68          HB2       PRO  68   1.805  10.560   2.033
  571   2HB   PRO  68          HB1       PRO  68   0.818  10.279   3.482
  572   1HG   PRO  68          HG2       PRO  68   0.842   8.792   0.896
  573   2HG   PRO  68          HG1       PRO  68   0.757   8.168   2.552
  574   1HD   PRO  68          HD2       PRO  68  -1.414   8.360   0.965
  575   2HD   PRO  68          HD1       PRO  68  -1.500   8.571   2.729
  576    H    LYS  69           HN       LYS  69  -0.926  13.470   0.828
  577    HA   LYS  69           HA       LYS  69   1.206  13.786  -1.091
  578   1HB   LYS  69          HB2       LYS  69  -1.028  12.043  -1.727
  579   2HB   LYS  69          HB1       LYS  69  -0.951  13.394  -2.860
  580   1HG   LYS  69          HG2       LYS  69   1.078  12.743  -3.718
  581   2HG   LYS  69          HG1       LYS  69   1.627  12.069  -2.183
  582   1HD   LYS  69          HD2       LYS  69   0.920  10.005  -2.747
  583   2HD   LYS  69          HD1       LYS  69  -0.673  10.613  -3.198
  584   1HE   LYS  69          HE2       LYS  69   0.904  11.544  -5.267
  585   2HE   LYS  69          HE1       LYS  69   1.616   9.956  -4.921
  586   1HZ   LYS  69          HZ1       LYS  69  -0.490   8.921  -5.082
  587   2HZ   LYS  69          HZ2       LYS  69  -0.357   9.919  -6.451
  588   3HZ   LYS  69          HZ3       LYS  69  -1.307  10.406  -5.131
  589    H    GLN  70           HN       GLN  70   0.830  15.709  -2.462
  590    HA   GLN  70           HA       GLN  70  -1.015  17.630  -1.155
  591   1HB   GLN  70          HB2       GLN  70   1.286  17.789  -3.115
  592   2HB   GLN  70          HB1       GLN  70   0.315  19.202  -2.696
  593   1HG   GLN  70          HG2       GLN  70   1.398  17.529  -0.466
  594   2HG   GLN  70          HG1       GLN  70   2.513  18.594  -1.323
  595   1HE2  GLN  70          HE2       GLN  70   0.758  18.610   1.411
  596   2HE2  GLN  70          HE2       GLN  70   0.291  20.240   1.482
  597    H    LEU  71           HN       LEU  71  -0.067  17.338  -4.583
  598    HA   LEU  71           HA       LEU  71  -2.676  18.209  -5.509
  599   1HB   LEU  71          HB2       LEU  71  -0.070  17.280  -6.644
  600   2HB   LEU  71          HB1       LEU  71  -1.475  17.272  -7.711
  601    HG   LEU  71           HG       LEU  71  -0.843  19.696  -6.039
  602   1HD1  LEU  71          HD1       LEU  71   0.157  20.387  -8.453
  603   2HD1  LEU  71          HD1       LEU  71   0.586  18.676  -8.440
  604   3HD1  LEU  71          HD1       LEU  71   1.160  19.738  -7.154
  605   1HD2  LEU  71          HD2       LEU  71  -2.540  20.608  -7.223
  606   2HD2  LEU  71          HD2       LEU  71  -2.902  18.978  -7.791
  607   3HD2  LEU  71          HD2       LEU  71  -1.867  20.037  -8.750
  Start of MODEL   12
    1   1H    THR   1          HT1       THR   1   4.467   4.939  17.128
    2   2H    THR   1          HT2       THR   1   5.112   5.350  18.645
    3   3H    THR   1          HT3       THR   1   3.585   4.614  18.540
    4    HA   THR   1           HA       THR   1   5.473   3.103  19.234
    5    HB   THR   1           HB       THR   1   3.750   2.592  16.786
    6    HG1  THR   1           HG1      THR   1   2.221   2.611  18.197
    7   1HG2  THR   1          HG2       THR   1   5.485   0.871  17.019
    8   2HG2  THR   1          HG2       THR   1   3.907   0.212  17.448
    9   3HG2  THR   1          HG2       THR   1   5.053   0.650  18.714
   10    H    ARG   2           HN       ARG   2   5.238   3.213  15.665
   11    HA   ARG   2           HA       ARG   2   8.240   3.176  15.566
   12   1HB   ARG   2          HB2       ARG   2   6.118   1.467  14.363
   13   2HB   ARG   2          HB1       ARG   2   7.504   1.834  13.336
   14   1HG   ARG   2          HG2       ARG   2   8.773   1.226  15.661
   15   2HG   ARG   2          HG1       ARG   2   7.360   0.179  15.788
   16   1HD   ARG   2          HD2       ARG   2   7.846  -0.777  13.565
   17   2HD   ARG   2          HD1       ARG   2   9.263   0.282  13.419
   18    HE   ARG   2           HE       ARG   2   8.988  -1.691  15.657
   19   1HH1  ARG   2          HH2       ARG   2  10.451  -1.594  12.727
   20   2HH1  ARG   2          HH2       ARG   2  12.083  -1.678  13.299
   21   1HH2  ARG   2          HH1       ARG   2  11.228  -1.137  16.615
   22   2HH2  ARG   2          HH1       ARG   2  12.524  -1.417  15.502
   23    H    GLY   3           HN       GLY   3   9.095   4.029  13.460
   24   1HA   GLY   3          HA2       GLY   3   7.251   6.079  12.294
   25   2HA   GLY   3          HA1       GLY   3   8.968   6.381  12.558
   26    H    SER   4           HN       SER   4   9.279   6.796  10.290
   27    HA   SER   4           HA       SER   4   9.125   4.338   8.571
   28   1HB   SER   4          HB2       SER   4   9.080   6.269   6.764
   29   2HB   SER   4          HB1       SER   4   7.611   5.849   7.639
   30    HG   SER   4           HG       SER   4   8.690   8.184   7.525
   31    H    ASP   5           HN       ASP   5  10.927   3.981   7.154
   32    HA   ASP   5           HA       ASP   5  13.181   5.780   6.954
   33   1HB   ASP   5          HB2       ASP   5  14.709   4.506   8.425
   34   2HB   ASP   5          HB1       ASP   5  13.332   5.125   9.337
   35    H    ILE   6           HN       ILE   6  12.045   2.409   6.874
   36    HA   ILE   6           HA       ILE   6  13.845   1.928   4.522
   37    HB   ILE   6           HB       ILE   6  12.596   0.042   6.549
   38   1HG1  ILE   6          HG1       ILE   6  15.534   0.584   6.121
   39   2HG1  ILE   6          HG1       ILE   6  14.573   1.599   7.197
   40   1HG2  ILE   6          HG2       ILE   6  14.507  -1.415   5.320
   41   2HG2  ILE   6          HG2       ILE   6  14.027  -0.378   3.977
   42   3HG2  ILE   6          HG2       ILE   6  12.829  -1.395   4.776
   43   1HD1  ILE   6          HD1       ILE   6  13.803  -0.605   8.293
   44   2HD1  ILE   6          HD1       ILE   6  15.459  -0.086   8.612
   45   3HD1  ILE   6          HD1       ILE   6  15.146  -1.356   7.431
   46    H    SER   7           HN       SER   7  11.482   3.268   3.951
   47    HA   SER   7           HA       SER   7   9.532   1.191   3.093
   48   1HB   SER   7          HB2       SER   7   7.980   3.006   3.021
   49   2HB   SER   7          HB1       SER   7   8.963   3.291   4.455
   50    HG   SER   7           HG       SER   7  10.272   4.666   3.119
   51    H    LYS   8           HN       LYS   8  12.110   1.568   1.688
   52    HA   LYS   8           HA       LYS   8  11.206   2.782  -0.879
   53   1HB   LYS   8          HB2       LYS   8  13.818   2.334   0.520
   54   2HB   LYS   8          HB1       LYS   8  13.817   2.451  -1.241
   55   1HG   LYS   8          HG2       LYS   8  13.095   4.659  -1.232
   56   2HG   LYS   8          HG1       LYS   8  12.305   4.501   0.337
   57   1HD   LYS   8          HD2       LYS   8  15.306   4.485  -0.099
   58   2HD   LYS   8          HD1       LYS   8  14.377   5.873   0.465
   59   1HE   LYS   8          HE2       LYS   8  13.509   4.057   2.256
   60   2HE   LYS   8          HE1       LYS   8  15.116   3.381   1.925
   61   1HZ   LYS   8          HZ1       LYS   8  15.902   5.790   2.107
   62   2HZ   LYS   8          HZ2       LYS   8  15.518   4.981   3.551
   63   3HZ   LYS   8          HZ3       LYS   8  14.421   6.091   2.879
   64    H    THR   9           HN       THR   9  10.194   0.201  -0.210
   65    HA   THR   9           HA       THR   9  11.783  -1.604  -2.004
   66    HB   THR   9           HB       THR   9  11.531  -2.316   0.347
   67    HG1  THR   9           HG1      THR   9   9.905  -3.772  -1.463
   68   1HG2  THR   9          HG2       THR   9   8.605  -1.921  -0.282
   69   2HG2  THR   9          HG2       THR   9   9.540  -1.227   1.042
   70   3HG2  THR   9          HG2       THR   9   9.144  -2.945   1.050
   71    H    CYS  10           HN       CYS  10  10.573  -2.837  -3.580
   72    HA   CYS  10           HA       CYS  10   8.011  -1.536  -4.371
   73   1HB   CYS  10          HB2       CYS  10  10.316  -2.843  -5.676
   74   2HB   CYS  10          HB1       CYS  10   8.756  -3.227  -6.406
   75    H    CYS  11           HN       CYS  11   6.929  -3.646  -5.891
   76    HA   CYS  11           HA       CYS  11   6.342  -5.686  -3.768
   77   1HB   CYS  11          HB2       CYS  11   4.604  -4.125  -5.673
   78   2HB   CYS  11          HB1       CYS  11   4.031  -5.625  -4.942
   79    H    PHE  12           HN       PHE  12   5.129  -7.615  -4.858
   80    HA   PHE  12           HA       PHE  12   6.063  -8.255  -7.586
   81   1HB   PHE  12          HB2       PHE  12   6.941  -9.613  -5.027
   82   2HB   PHE  12          HB1       PHE  12   7.062 -10.409  -6.596
   83    HD1  PHE  12           HD1      PHE  12   9.002  -8.782  -4.328
   84    HD2  PHE  12           HD2      PHE  12   7.923  -8.485  -8.476
   85    HE1  PHE  12           HE1      PHE  12  11.111  -7.563  -4.789
   86    HE2  PHE  12           HE2      PHE  12  10.033  -7.265  -8.936
   87    HZ   PHE  12           HZ       PHE  12  11.627  -6.805  -7.093
   88    H    GLN  13           HN       GLN  13   4.496  -9.452  -4.616
   89    HA   GLN  13           HA       GLN  13   2.569 -10.984  -6.305
   90   1HB   GLN  13          HB2       GLN  13   4.108 -11.538  -3.950
   91   2HB   GLN  13          HB1       GLN  13   2.397 -11.612  -3.524
   92   1HG   GLN  13          HG2       GLN  13   2.342 -13.669  -4.440
   93   2HG   GLN  13          HG1       GLN  13   2.584 -12.906  -6.011
   94   1HE2  GLN  13          HE2       GLN  13   3.673 -15.525  -5.203
   95   2HE2  GLN  13          HE2       GLN  13   5.363 -15.388  -5.271
   96    H    TYR  14           HN       TYR  14   0.313 -11.094  -5.122
   97    HA   TYR  14           HA       TYR  14  -0.323  -8.547  -3.728
   98   1HB   TYR  14          HB2       TYR  14  -1.752  -9.576  -6.199
   99   2HB   TYR  14          HB1       TYR  14  -2.089  -8.068  -5.348
  100    HD1  TYR  14           HD1      TYR  14  -0.390  -9.470  -8.083
  101    HD2  TYR  14           HD2      TYR  14   0.078  -6.518  -4.997
  102    HE1  TYR  14           HE1      TYR  14   1.332  -8.319  -9.445
  103    HE2  TYR  14           HE2      TYR  14   1.801  -5.367  -6.361
  104    HH   TYR  14           HH       TYR  14   2.359  -5.217  -8.870
  105    H    SER  15           HN       SER  15  -2.417  -8.647  -2.623
  106    HA   SER  15           HA       SER  15  -3.114 -11.398  -1.802
  107   1HB   SER  15          HB2       SER  15  -2.695  -9.617  -0.149
  108   2HB   SER  15          HB1       SER  15  -3.986  -8.650  -0.857
  109    HG   SER  15           HG       SER  15  -5.217  -9.702   0.481
  110    H    HIS  16           HN       HIS  16  -5.494 -11.921  -1.600
  111    HA   HIS  16           HA       HIS  16  -7.114 -10.615  -3.760
  112   1HB   HIS  16          HB2       HIS  16  -5.951 -13.068  -3.922
  113   2HB   HIS  16          HB1       HIS  16  -7.492 -13.503  -3.182
  114    HD1  HIS  16           HD1      HIS  16  -8.442 -14.581  -5.336
  115    HD2  HIS  16           HD2      HIS  16  -7.352 -10.586  -5.819
  116    HE1  HIS  16           HE1      HIS  16  -9.404 -13.839  -7.559
  117    H    LYS  17           HN       LYS  17  -7.362  -9.812  -1.101
  118    HA   LYS  17           HA       LYS  17 -10.151 -10.466  -0.557
  119   1HB   LYS  17          HB2       LYS  17  -9.665 -11.503   1.657
  120   2HB   LYS  17          HB1       LYS  17  -9.009 -12.455   0.325
  121   1HG   LYS  17          HG2       LYS  17  -7.120 -12.385   1.629
  122   2HG   LYS  17          HG1       LYS  17  -6.892 -10.855   0.781
  123   1HD   LYS  17          HD2       LYS  17  -6.732 -10.023   2.905
  124   2HD   LYS  17          HD1       LYS  17  -8.493 -10.032   2.807
  125   1HE   LYS  17          HE2       LYS  17  -8.598 -12.205   3.911
  126   2HE   LYS  17          HE1       LYS  17  -6.826 -12.325   3.905
  127   1HZ   LYS  17          HZ1       LYS  17  -6.634 -10.458   5.301
  128   2HZ   LYS  17          HZ2       LYS  17  -7.855 -11.407   6.004
  129   3HZ   LYS  17          HZ3       LYS  17  -8.262 -10.025   5.102
  130    HA   PRO  18           HA       PRO  18  -9.757  -6.504   1.325
  131   1HB   PRO  18          HB2       PRO  18 -11.967  -6.497   2.938
  132   2HB   PRO  18          HB1       PRO  18 -12.058  -6.332   1.173
  133   1HG   PRO  18          HG2       PRO  18 -12.578  -8.703   2.883
  134   2HG   PRO  18          HG1       PRO  18 -13.382  -8.181   1.395
  135   1HD   PRO  18          HD2       PRO  18 -11.510 -10.188   1.523
  136   2HD   PRO  18          HD1       PRO  18 -11.876  -9.248   0.060
  137    H    LEU  19           HN       LEU  19  -8.280  -6.034   2.892
  138    HA   LEU  19           HA       LEU  19  -7.723  -7.788   5.132
  139   1HB   LEU  19          HB2       LEU  19  -6.390  -5.931   3.685
  140   2HB   LEU  19          HB1       LEU  19  -6.827  -4.950   5.084
  141    HG   LEU  19           HG       LEU  19  -5.793  -7.637   5.740
  142   1HD1  LEU  19          HD1       LEU  19  -3.743  -5.611   4.921
  143   2HD1  LEU  19          HD1       LEU  19  -4.461  -6.642   3.683
  144   3HD1  LEU  19          HD1       LEU  19  -3.596  -7.364   5.039
  145   1HD2  LEU  19          HD2       LEU  19  -6.322  -5.558   7.240
  146   2HD2  LEU  19          HD2       LEU  19  -4.753  -4.974   6.687
  147   3HD2  LEU  19          HD2       LEU  19  -4.866  -6.494   7.573
  148    HA   PRO  20           HA       PRO  20 -10.651  -6.116   7.997
  149   1HB   PRO  20          HB2       PRO  20  -9.373  -6.694  10.350
  150   2HB   PRO  20          HB1       PRO  20 -10.188  -7.924   9.363
  151   1HG   PRO  20          HG2       PRO  20  -7.289  -7.251   9.530
  152   2HG   PRO  20          HG1       PRO  20  -8.075  -8.836   9.440
  153   1HD   PRO  20          HD2       PRO  20  -6.919  -7.657   7.300
  154   2HD   PRO  20          HD1       PRO  20  -8.327  -8.731   7.159
  155    H    TRP  21           HN       TRP  21 -10.744  -3.891   8.001
  156    HA   TRP  21           HA       TRP  21  -8.671  -2.031   8.180
  157   1HB   TRP  21          HB2       TRP  21 -11.547  -1.968   9.124
  158   2HB   TRP  21          HB1       TRP  21 -10.532  -0.525   9.039
  159    HD1  TRP  21           HD1      TRP  21 -12.243  -3.130   6.850
  160    HE1  TRP  21           HE1      TRP  21 -12.240  -2.301   4.408
  161    HE3  TRP  21           HE3      TRP  21  -9.285   1.004   7.327
  162    HZ2  TRP  21           HZ2      TRP  21 -11.126  -0.165   2.862
  163    HZ3  TRP  21           HZ3      TRP  21  -8.769   2.417   5.357
  164    HH2  TRP  21           HH2      TRP  21  -9.685   1.837   3.128
  165    H    THR  22           HN       THR  22 -10.071  -3.926  10.774
  166    HA   THR  22           HA       THR  22  -9.397  -2.363  13.034
  167    HB   THR  22           HB       THR  22  -9.108  -4.754  14.037
  168    HG1  THR  22           HG1      THR  22 -10.123  -6.267  12.486
  169   1HG2  THR  22          HG2       THR  22 -11.474  -3.427  12.854
  170   2HG2  THR  22          HG2       THR  22 -11.209  -3.992  14.503
  171   3HG2  THR  22          HG2       THR  22 -11.684  -5.134  13.245
  172    H    TRP  23           HN       TRP  23  -7.377  -4.445  10.998
  173    HA   TRP  23           HA       TRP  23  -5.001  -3.720  12.652
  174   1HB   TRP  23          HB2       TRP  23  -5.457  -5.904  10.599
  175   2HB   TRP  23          HB1       TRP  23  -3.989  -5.691  11.547
  176    HD1  TRP  23           HD1      TRP  23  -6.007  -4.846  14.164
  177    HE1  TRP  23           HE1      TRP  23  -6.923  -6.839  15.521
  178    HE3  TRP  23           HE3      TRP  23  -5.296  -8.602  10.787
  179    HZ2  TRP  23           HZ2      TRP  23  -7.302  -9.663  15.209
  180    HZ3  TRP  23           HZ3      TRP  23  -5.938 -10.933  11.339
  181    HH2  TRP  23           HH2      TRP  23  -6.939 -11.467  13.543
  182    H    VAL  24           HN       VAL  24  -6.499  -2.346  10.165
  183    HA   VAL  24           HA       VAL  24  -4.158  -2.167   8.353
  184    HB   VAL  24           HB       VAL  24  -6.976  -1.067   8.166
  185   1HG1  VAL  24          HG1       VAL  24  -6.454  -0.317   6.027
  186   2HG1  VAL  24          HG1       VAL  24  -5.134  -1.471   5.833
  187   3HG1  VAL  24          HG1       VAL  24  -4.914  -0.040   6.841
  188   1HG2  VAL  24          HG2       VAL  24  -6.437  -3.656   8.148
  189   2HG2  VAL  24          HG2       VAL  24  -5.862  -3.318   6.516
  190   3HG2  VAL  24          HG2       VAL  24  -7.538  -2.981   6.947
  191    H    ARG  25           HN       ARG  25  -2.889  -0.333   8.241
  192    HA   ARG  25           HA       ARG  25  -3.615   1.925  10.073
  193   1HB   ARG  25          HB2       ARG  25  -1.577   0.551  10.540
  194   2HB   ARG  25          HB1       ARG  25  -0.932   1.035   8.972
  195   1HG   ARG  25          HG2       ARG  25  -1.218   3.447   9.734
  196   2HG   ARG  25          HG1       ARG  25  -1.538   2.810  11.347
  197   1HD   ARG  25          HD2       ARG  25   0.656   1.771  11.444
  198   2HD   ARG  25          HD1       ARG  25   0.975   2.197   9.751
  199    HE   ARG  25           HE       ARG  25   1.019   4.057  12.026
  200   1HH1  ARG  25          HH1       ARG  25   3.039   4.147   9.852
  201   2HH1  ARG  25          HH1       ARG  25   2.523   5.508   8.912
  202   1HH2  ARG  25          HH2       ARG  25  -0.663   5.580  10.285
  203   2HH2  ARG  25          HH2       ARG  25   0.424   6.318   9.156
  204    H    SER  26           HN       SER  26  -1.882   1.317   6.979
  205    HA   SER  26           HA       SER  26  -3.283   3.507   5.650
  206   1HB   SER  26          HB2       SER  26  -1.336   4.982   5.485
  207   2HB   SER  26          HB1       SER  26  -1.672   4.656   7.182
  208    HG   SER  26           HG       SER  26   0.491   3.990   5.646
  209    H    TYR  27           HN       TYR  27  -1.115   4.035   3.777
  210    HA   TYR  27           HA       TYR  27  -0.299   1.399   2.747
  211   1HB   TYR  27          HB2       TYR  27  -1.653   1.495   0.775
  212   2HB   TYR  27          HB1       TYR  27  -2.730   1.897   2.107
  213    HD1  TYR  27           HD1      TYR  27  -0.953   3.165  -0.840
  214    HD2  TYR  27           HD2      TYR  27  -3.512   4.211   2.447
  215    HE1  TYR  27           HE1      TYR  27  -1.465   5.330  -1.930
  216    HE2  TYR  27           HE2      TYR  27  -4.024   6.379   1.356
  217    HH   TYR  27           HH       TYR  27  -2.250   7.542  -1.346
  218    H    GLU  28           HN       GLU  28   0.498   2.030   0.222
  219    HA   GLU  28           HA       GLU  28   1.698   4.621  -0.130
  220   1HB   GLU  28          HB2       GLU  28   4.058   3.891   0.382
  221   2HB   GLU  28          HB1       GLU  28   3.017   3.967   1.803
  222   1HG   GLU  28          HG2       GLU  28   2.720   1.588   1.825
  223   2HG   GLU  28          HG1       GLU  28   3.462   1.419   0.233
  224    H    PHE  29           HN       PHE  29   2.434   4.770  -2.249
  225    HA   PHE  29           HA       PHE  29   2.106   2.433  -3.992
  226   1HB   PHE  29          HB2       PHE  29   2.121   5.299  -4.136
  227   2HB   PHE  29          HB1       PHE  29   3.285   4.677  -5.305
  228    HD1  PHE  29           HD1      PHE  29  -0.147   5.359  -4.705
  229    HD2  PHE  29           HD2      PHE  29   2.467   2.638  -6.760
  230    HE1  PHE  29           HE1      PHE  29  -2.004   4.718  -6.218
  231    HE2  PHE  29           HE2      PHE  29   0.608   1.996  -8.272
  232    HZ   PHE  29           HZ       PHE  29  -1.627   3.036  -8.002
  233    H    THR  30           HN       THR  30   3.857   1.729  -5.475
  234    HA   THR  30           HA       THR  30   6.441   1.532  -4.085
  235    HB   THR  30           HB       THR  30   6.865   0.064  -6.169
  236    HG1  THR  30           HG1      THR  30   5.434   0.442  -7.649
  237   1HG2  THR  30          HG2       THR  30   6.145  -0.780  -3.932
  238   2HG2  THR  30          HG2       THR  30   5.517  -1.748  -5.266
  239   3HG2  THR  30          HG2       THR  30   4.467  -0.595  -4.440
  240    H    SER  31           HN       SER  31   8.465   1.803  -5.550
  241    HA   SER  31           HA       SER  31   8.498   4.526  -6.591
  242   1HB   SER  31          HB2       SER  31  10.910   3.785  -7.090
  243   2HB   SER  31          HB1       SER  31  10.402   3.724  -5.405
  244    HG   SER  31           HG       SER  31  10.986   1.708  -5.546
  245    H    ASN  32           HN       ASN  32   9.553   4.909  -8.821
  246    HA   ASN  32           HA       ASN  32   8.062   3.342 -10.838
  247   1HB   ASN  32          HB2       ASN  32   9.474   5.960 -10.607
  248   2HB   ASN  32          HB1       ASN  32   9.357   5.253 -12.219
  249   1HD2  ASN  32          HD2       ASN  32   7.146   4.824 -13.067
  250   2HD2  ASN  32          HD2       ASN  32   5.817   5.672 -12.438
  251    H    SER  33           HN       SER  33  10.940   2.811  -9.347
  252    HA   SER  33           HA       SER  33  12.434   2.105 -11.818
  253   1HB   SER  33          HB2       SER  33  13.452   3.494  -9.987
  254   2HB   SER  33          HB1       SER  33  13.279   2.116  -8.905
  255    HG   SER  33           HG       SER  33  15.162   1.591  -9.693
  256    H    CYS  34           HN       CYS  34  10.202   0.466 -11.257
  257    HA   CYS  34           HA       CYS  34  11.560  -2.090 -10.480
  258   1HB   CYS  34          HB2       CYS  34   8.859  -1.013  -9.626
  259   2HB   CYS  34          HB1       CYS  34   9.427  -2.650  -9.290
  260    H    SER  35           HN       SER  35   9.808  -3.948 -11.082
  261    HA   SER  35           HA       SER  35   9.348  -3.628 -13.974
  262   1HB   SER  35          HB2       SER  35   9.523  -5.781 -11.943
  263   2HB   SER  35          HB1       SER  35   8.465  -6.113 -13.311
  264    HG   SER  35           HG       SER  35  11.131  -5.158 -13.526
  265    H    GLN  36           HN       GLN  36   7.343  -4.495 -11.123
  266    HA   GLN  36           HA       GLN  36   4.936  -3.691 -12.726
  267   1HB   GLN  36          HB2       GLN  36   5.641  -5.975 -11.007
  268   2HB   GLN  36          HB1       GLN  36   4.058  -5.284 -10.651
  269   1HG   GLN  36          HG2       GLN  36   3.171  -6.001 -12.614
  270   2HG   GLN  36          HG1       GLN  36   4.617  -5.572 -13.528
  271   1HE2  GLN  36          HE2       GLN  36   5.122  -7.523 -14.595
  272   2HE2  GLN  36          HE2       GLN  36   5.367  -9.003 -13.802
  273    H    ARG  37           HN       ARG  37   4.769  -1.513 -12.020
  274    HA   ARG  37           HA       ARG  37   5.171  -0.546  -9.374
  275   1HB   ARG  37          HB2       ARG  37   4.676   0.545 -11.760
  276   2HB   ARG  37          HB1       ARG  37   3.020   0.553 -11.151
  277   1HG   ARG  37          HG2       ARG  37   4.331   1.521  -8.979
  278   2HG   ARG  37          HG1       ARG  37   5.365   2.137 -10.269
  279   1HD   ARG  37          HD2       ARG  37   2.347   2.481 -10.248
  280   2HD   ARG  37          HD1       ARG  37   3.486   3.710  -9.663
  281    HE   ARG  37           HE       ARG  37   4.023   2.649 -12.364
  282   1HH1  ARG  37          HH1       ARG  37   4.164   5.362 -10.495
  283   2HH1  ARG  37          HH1       ARG  37   3.500   6.452 -11.665
  284   1HH2  ARG  37          HH2       ARG  37   2.507   3.936 -13.835
  285   2HH2  ARG  37          HH2       ARG  37   2.559   5.644 -13.555
  286    H    ALA  38           HN       ALA  38   3.854  -0.670  -7.534
  287    HA   ALA  38           HA       ALA  38   1.014  -1.436  -7.854
  288   1HB   ALA  38          HB1       ALA  38   2.785  -3.021  -6.014
  289   2HB   ALA  38          HB2       ALA  38   2.697  -3.431  -7.726
  290   3HB   ALA  38          HB3       ALA  38   1.242  -3.485  -6.732
  291    H    VAL  39           HN       VAL  39  -0.017  -1.587  -5.572
  292    HA   VAL  39           HA       VAL  39   1.044   0.659  -3.895
  293    HB   VAL  39           HB       VAL  39  -1.732  -0.550  -4.165
  294   1HG1  VAL  39          HG1       VAL  39  -2.210   1.831  -3.110
  295   2HG1  VAL  39          HG1       VAL  39  -0.558   1.661  -2.516
  296   3HG1  VAL  39          HG1       VAL  39  -1.781   0.468  -2.078
  297   1HG2  VAL  39          HG2       VAL  39  -0.408   0.981  -6.025
  298   2HG2  VAL  39          HG2       VAL  39  -1.227   2.212  -5.064
  299   3HG2  VAL  39          HG2       VAL  39  -2.162   0.933  -5.836
  300    H    ILE  40           HN       ILE  40   0.819   0.349  -1.516
  301    HA   ILE  40           HA       ILE  40   0.698  -2.537  -0.719
  302    HB   ILE  40           HB       ILE  40   2.619  -0.339   0.104
  303   1HG1  ILE  40          HG1       ILE  40   3.494  -2.968  -0.981
  304   2HG1  ILE  40          HG1       ILE  40   2.742  -1.852  -2.121
  305   1HG2  ILE  40          HG2       ILE  40   2.537  -3.223   1.025
  306   2HG2  ILE  40          HG2       ILE  40   1.946  -1.864   1.981
  307   3HG2  ILE  40          HG2       ILE  40   3.656  -1.969   1.563
  308   1HD1  ILE  40          HD1       ILE  40   5.001  -1.059  -0.270
  309   2HD1  ILE  40          HD1       ILE  40   4.350  -0.134  -1.624
  310   3HD1  ILE  40          HD1       ILE  40   5.254  -1.619  -1.923
  311    H    PHE  41           HN       PHE  41  -0.622  -2.906   1.035
  312    HA   PHE  41           HA       PHE  41  -1.810  -0.554   2.436
  313   1HB   PHE  41          HB2       PHE  41  -2.537  -3.485   2.126
  314   2HB   PHE  41          HB1       PHE  41  -3.408  -2.402   3.210
  315    HD1  PHE  41           HD1      PHE  41  -3.970  -3.919   0.322
  316    HD2  PHE  41           HD2      PHE  41  -3.488   0.114   1.718
  317    HE1  PHE  41           HE1      PHE  41  -5.324  -3.097  -1.585
  318    HE2  PHE  41           HE2      PHE  41  -4.841   0.936  -0.190
  319    HZ   PHE  41           HZ       PHE  41  -5.759  -0.670  -1.842
  320    H    THR  42           HN       THR  42  -0.777  -0.072   4.373
  321    HA   THR  42           HA       THR  42   0.838  -2.152   5.673
  322    HB   THR  42           HB       THR  42   0.672   0.419   7.004
  323    HG1  THR  42           HG1      THR  42   0.802   1.724   5.379
  324   1HG2  THR  42          HG2       THR  42   2.680  -1.397   5.793
  325   2HG2  THR  42          HG2       THR  42   2.658  -0.658   7.394
  326   3HG2  THR  42          HG2       THR  42   3.150   0.290   5.990
  327    H    THR  43           HN       THR  43   0.407  -3.013   7.706
  328    HA   THR  43           HA       THR  43  -2.349  -2.560   8.730
  329    HB   THR  43           HB       THR  43  -1.504  -4.723  10.044
  330    HG1  THR  43           HG1      THR  43   0.216  -5.609   9.202
  331   1HG2  THR  43          HG2       THR  43  -3.283  -4.416   8.189
  332   2HG2  THR  43          HG2       THR  43  -2.581  -6.020   8.399
  333   3HG2  THR  43          HG2       THR  43  -2.024  -4.979   7.089
  334    H    LYS  44           HN       LYS  44  -2.317  -3.144  11.282
  335    HA   LYS  44           HA       LYS  44  -0.784  -0.974  12.542
  336   1HB   LYS  44          HB2       LYS  44  -2.947  -2.924  13.327
  337   2HB   LYS  44          HB1       LYS  44  -2.164  -1.912  14.542
  338   1HG   LYS  44          HG2       LYS  44  -2.689  -0.036  12.668
  339   2HG   LYS  44          HG1       LYS  44  -4.024  -1.147  12.356
  340   1HD   LYS  44          HD2       LYS  44  -5.105  -0.349  14.156
  341   2HD   LYS  44          HD1       LYS  44  -3.770  -0.875  15.183
  342   1HE   LYS  44          HE2       LYS  44  -2.590   1.313  14.361
  343   2HE   LYS  44          HE1       LYS  44  -4.234   1.830  13.939
  344   1HZ   LYS  44          HZ1       LYS  44  -3.587   2.360  16.268
  345   2HZ   LYS  44          HZ2       LYS  44  -3.481   0.693  16.577
  346   3HZ   LYS  44          HZ3       LYS  44  -4.971   1.387  16.148
  347    H    ARG  45           HN       ARG  45  -0.418  -4.380  12.089
  348    HA   ARG  45           HA       ARG  45   1.124  -4.883  14.522
  349   1HB   ARG  45          HB2       ARG  45  -0.189  -6.332  12.509
  350   2HB   ARG  45          HB1       ARG  45   1.517  -6.734  12.312
  351   1HG   ARG  45          HG2       ARG  45   1.699  -7.477  14.580
  352   2HG   ARG  45          HG1       ARG  45   0.123  -6.801  14.996
  353   1HD   ARG  45          HD2       ARG  45   0.018  -9.277  14.667
  354   2HD   ARG  45          HD1       ARG  45  -0.974  -8.417  13.472
  355    HE   ARG  45           HE       ARG  45   1.833  -8.967  12.710
  356   1HH1  ARG  45          HH2       ARG  45  -0.020 -11.437  12.959
  357   2HH1  ARG  45          HH2       ARG  45  -0.528 -11.608  11.312
  358   1HH2  ARG  45          HH1       ARG  45   0.535  -8.442  10.377
  359   2HH2  ARG  45          HH1       ARG  45  -0.216  -9.911   9.851
  360    H    GLY  46           HN       GLY  46   1.847  -3.169  11.723
  361   1HA   GLY  46          HA2       GLY  46   3.983  -2.186  11.273
  362   2HA   GLY  46          HA1       GLY  46   4.741  -3.436  12.259
  363    H    LYS  47           HN       LYS  47   2.389  -4.493   9.956
  364    HA   LYS  47           HA       LYS  47   4.599  -5.552   8.249
  365   1HB   LYS  47          HB2       LYS  47   2.520  -6.790   9.663
  366   2HB   LYS  47          HB1       LYS  47   1.999  -6.829   7.978
  367   1HG   LYS  47          HG2       LYS  47   4.766  -7.682   8.855
  368   2HG   LYS  47          HG1       LYS  47   3.415  -8.809   8.724
  369   1HD   LYS  47          HD2       LYS  47   3.149  -8.300   6.364
  370   2HD   LYS  47          HD1       LYS  47   4.373  -7.034   6.461
  371   1HE   LYS  47          HE2       LYS  47   6.130  -8.548   6.559
  372   2HE   LYS  47          HE1       LYS  47   5.137  -9.805   7.325
  373   1HZ   LYS  47          HZ1       LYS  47   4.532  -8.829   4.604
  374   2HZ   LYS  47          HZ2       LYS  47   4.062 -10.288   5.338
  375   3HZ   LYS  47          HZ3       LYS  47   5.673 -10.060   4.846
  376    H    LYS  48           HN       LYS  48   4.536  -5.062   6.060
  377    HA   LYS  48           HA       LYS  48   2.261  -3.351   5.135
  378   1HB   LYS  48          HB2       LYS  48   4.970  -3.711   3.831
  379   2HB   LYS  48          HB1       LYS  48   3.845  -2.371   3.637
  380   1HG   LYS  48          HG2       LYS  48   4.284  -2.323   6.347
  381   2HG   LYS  48          HG1       LYS  48   5.856  -2.846   5.741
  382   1HD   LYS  48          HD2       LYS  48   4.500  -0.575   4.346
  383   2HD   LYS  48          HD1       LYS  48   5.247  -0.260   5.913
  384   1HE   LYS  48          HE2       LYS  48   7.062  -1.857   4.365
  385   2HE   LYS  48          HE1       LYS  48   6.556  -0.463   3.391
  386   1HZ   LYS  48          HZ1       LYS  48   8.388   0.151   4.836
  387   2HZ   LYS  48          HZ2       LYS  48   7.524  -0.372   6.201
  388   3HZ   LYS  48          HZ3       LYS  48   6.979   0.966   5.309
  389    H    VAL  49           HN       VAL  49   0.893  -4.207   3.617
  390    HA   VAL  49           HA       VAL  49   1.701  -6.761   2.279
  391    HB   VAL  49           HB       VAL  49  -1.000  -5.476   2.815
  392   1HG1  VAL  49          HG1       VAL  49  -0.330  -7.366   0.879
  393   2HG1  VAL  49          HG1       VAL  49  -1.944  -7.073   1.524
  394   3HG1  VAL  49          HG1       VAL  49  -0.932  -8.336   2.223
  395   1HG2  VAL  49          HG2       VAL  49  -1.045  -7.702   4.274
  396   2HG2  VAL  49          HG2       VAL  49  -0.330  -6.221   4.909
  397   3HG2  VAL  49          HG2       VAL  49   0.704  -7.484   4.243
  398    H    CYS  50           HN       CYS  50   1.851  -6.799   0.042
  399    HA   CYS  50           HA       CYS  50   1.671  -4.266  -1.425
  400   1HB   CYS  50          HB2       CYS  50   2.492  -7.111  -1.954
  401   2HB   CYS  50          HB1       CYS  50   2.279  -6.002  -3.308
  402    H    THR  51           HN       THR  51   0.372  -4.060  -3.409
  403    HA   THR  51           HA       THR  51  -1.865  -5.914  -3.863
  404    HB   THR  51           HB       THR  51  -3.396  -3.761  -3.482
  405    HG1  THR  51           HG1      THR  51  -2.494  -2.277  -2.307
  406   1HG2  THR  51          HG2       THR  51  -4.194  -4.976  -1.754
  407   2HG2  THR  51          HG2       THR  51  -2.672  -4.867  -0.871
  408   3HG2  THR  51          HG2       THR  51  -2.888  -6.107  -2.106
  409    H    HIS  52           HN       HIS  52  -3.116  -5.232  -5.806
  410    HA   HIS  52           HA       HIS  52  -1.415  -3.688  -7.674
  411   1HB   HIS  52          HB2       HIS  52  -2.730  -6.055  -7.860
  412   2HB   HIS  52          HB1       HIS  52  -3.947  -4.974  -8.538
  413    HD1  HIS  52           HD1      HIS  52  -3.626  -5.659 -10.993
  414    HD2  HIS  52           HD2      HIS  52  -0.093  -4.391  -9.179
  415    HE1  HIS  52           HE1      HIS  52  -1.920  -5.400 -12.848
  416    HA   PRO  53           HA       PRO  53  -4.173  -0.229  -7.349
  417   1HB   PRO  53          HB2       PRO  53  -3.306   1.179  -9.526
  418   2HB   PRO  53          HB1       PRO  53  -2.385   1.082  -8.012
  419   1HG   PRO  53          HG2       PRO  53  -1.963  -0.348 -10.575
  420   2HG   PRO  53          HG1       PRO  53  -0.780   0.246  -9.401
  421   1HD   PRO  53          HD2       PRO  53  -1.574  -2.385  -9.643
  422   2HD   PRO  53          HD1       PRO  53  -0.847  -1.673  -8.188
  423    H    ARG  54           HN       ARG  54  -3.796  -2.027 -10.373
  424    HA   ARG  54           HA       ARG  54  -5.993  -0.966 -11.836
  425   1HB   ARG  54          HB2       ARG  54  -4.084  -2.579 -12.489
  426   2HB   ARG  54          HB1       ARG  54  -5.104  -3.856 -11.824
  427   1HG   ARG  54          HG2       ARG  54  -6.193  -3.931 -13.791
  428   2HG   ARG  54          HG1       ARG  54  -6.793  -2.305 -13.466
  429   1HD   ARG  54          HD2       ARG  54  -5.676  -2.129 -15.571
  430   2HD   ARG  54          HD1       ARG  54  -4.507  -1.492 -14.398
  431    HE   ARG  54           HE       ARG  54  -3.767  -4.052 -14.344
  432   1HH1  ARG  54          HH2       ARG  54  -3.378  -1.706 -16.627
  433   2HH1  ARG  54          HH2       ARG  54  -3.071  -2.765 -17.962
  434   1HH2  ARG  54          HH1       ARG  54  -3.986  -5.634 -16.232
  435   2HH2  ARG  54          HH1       ARG  54  -3.417  -4.995 -17.739
  436    H    LYS  55           HN       LYS  55  -5.875  -3.226  -9.150
  437    HA   LYS  55           HA       LYS  55  -8.543  -4.312  -9.508
  438   1HB   LYS  55          HB2       LYS  55  -6.432  -4.233  -7.367
  439   2HB   LYS  55          HB1       LYS  55  -8.032  -4.876  -6.992
  440   1HG   LYS  55          HG2       LYS  55  -7.761  -6.314  -9.109
  441   2HG   LYS  55          HG1       LYS  55  -6.055  -5.872  -9.045
  442   1HD   LYS  55          HD2       LYS  55  -7.573  -7.146  -6.752
  443   2HD   LYS  55          HD1       LYS  55  -6.549  -8.032  -7.884
  444   1HE   LYS  55          HE2       LYS  55  -4.686  -6.359  -7.224
  445   2HE   LYS  55          HE1       LYS  55  -5.725  -5.965  -5.839
  446   1HZ   LYS  55          HZ1       LYS  55  -4.703  -8.645  -6.612
  447   2HZ   LYS  55          HZ2       LYS  55  -5.901  -8.398  -5.432
  448   3HZ   LYS  55          HZ3       LYS  55  -4.335  -7.778  -5.201
  449    H    LYS  56           HN       LYS  56 -10.416  -3.252  -9.094
  450    HA   LYS  56           HA       LYS  56 -10.670  -0.597  -8.209
  451   1HB   LYS  56          HB2       LYS  56 -12.274  -2.665  -9.118
  452   2HB   LYS  56          HB1       LYS  56 -12.902  -2.360  -7.499
  453   1HG   LYS  56          HG2       LYS  56 -13.794  -0.375  -8.110
  454   2HG   LYS  56          HG1       LYS  56 -12.325   0.108  -8.959
  455   1HD   LYS  56          HD2       LYS  56 -12.964  -1.145 -10.923
  456   2HD   LYS  56          HD1       LYS  56 -14.335  -1.863 -10.077
  457   1HE   LYS  56          HE2       LYS  56 -14.739   0.872  -9.734
  458   2HE   LYS  56          HE1       LYS  56 -14.152   0.737 -11.404
  459   1HZ   LYS  56          HZ1       LYS  56 -16.580   0.357 -11.184
  460   2HZ   LYS  56          HZ2       LYS  56 -16.249  -1.009 -10.228
  461   3HZ   LYS  56          HZ3       LYS  56 -15.750  -0.962 -11.852
  462    H    TRP  57           HN       TRP  57 -11.212  -3.566  -6.246
  463    HA   TRP  57           HA       TRP  57 -11.864  -2.350  -3.811
  464   1HB   TRP  57          HB2       TRP  57 -11.689  -4.506  -3.044
  465   2HB   TRP  57          HB1       TRP  57 -11.482  -4.874  -4.751
  466    HD1  TRP  57           HD1      TRP  57  -9.189  -5.818  -5.519
  467    HE1  TRP  57           HE1      TRP  57  -7.012  -6.454  -4.292
  468    HE3  TRP  57           HE3      TRP  57 -10.135  -3.782  -0.933
  469    HZ2  TRP  57           HZ2      TRP  57  -5.830  -6.138  -1.706
  470    HZ3  TRP  57           HZ3      TRP  57  -8.470  -3.966   0.892
  471    HH2  TRP  57           HH2      TRP  57  -6.320  -5.140   0.512
  472    H    VAL  58           HN       VAL  58  -8.648  -2.783  -5.242
  473    HA   VAL  58           HA       VAL  58  -7.117  -1.979  -2.942
  474    HB   VAL  58           HB       VAL  58  -6.609  -1.849  -5.927
  475   1HG1  VAL  58          HG1       VAL  58  -5.117  -0.688  -3.847
  476   2HG1  VAL  58          HG1       VAL  58  -4.571  -0.984  -5.498
  477   3HG1  VAL  58          HG1       VAL  58  -4.271  -2.185  -4.241
  478   1HG2  VAL  58          HG2       VAL  58  -6.302  -3.942  -3.798
  479   2HG2  VAL  58          HG2       VAL  58  -5.159  -3.920  -5.140
  480   3HG2  VAL  58          HG2       VAL  58  -6.883  -4.115  -5.454
  481    H    GLN  59           HN       GLN  59  -8.152  -0.138  -5.848
  482    HA   GLN  59           HA       GLN  59  -7.132   2.393  -5.024
  483   1HB   GLN  59          HB2       GLN  59  -9.529   1.607  -6.721
  484   2HB   GLN  59          HB1       GLN  59  -8.821   3.223  -6.682
  485   1HG   GLN  59          HG2       GLN  59  -6.601   1.701  -7.140
  486   2HG   GLN  59          HG1       GLN  59  -7.831   0.765  -7.991
  487   1HE2  GLN  59          HE2       GLN  59  -8.902   1.765  -9.828
  488   2HE2  GLN  59          HE2       GLN  59  -8.314   3.193 -10.534
  489    H    LYS  60           HN       LYS  60 -10.022   0.598  -4.186
  490    HA   LYS  60           HA       LYS  60 -11.425   2.802  -2.928
  491   1HB   LYS  60          HB2       LYS  60 -11.605  -0.217  -2.922
  492   2HB   LYS  60          HB1       LYS  60 -12.687   0.768  -1.935
  493   1HG   LYS  60          HG2       LYS  60 -12.334   1.093  -4.929
  494   2HG   LYS  60          HG1       LYS  60 -13.657   0.203  -4.172
  495   1HD   LYS  60          HD2       LYS  60 -14.787   2.118  -3.845
  496   2HD   LYS  60          HD1       LYS  60 -13.441   2.770  -2.910
  497   1HE   LYS  60          HE2       LYS  60 -12.689   4.034  -4.659
  498   2HE   LYS  60          HE1       LYS  60 -13.007   2.748  -5.841
  499   1HZ   LYS  60          HZ1       LYS  60 -15.387   3.185  -5.593
  500   2HZ   LYS  60          HZ2       LYS  60 -14.563   4.560  -6.155
  501   3HZ   LYS  60          HZ3       LYS  60 -15.051   4.464  -4.531
  502    H    TYR  61           HN       TYR  61  -9.209   0.242  -1.855
  503    HA   TYR  61           HA       TYR  61  -9.424   0.907   0.979
  504   1HB   TYR  61          HB2       TYR  61  -8.009  -0.950  -0.816
  505   2HB   TYR  61          HB1       TYR  61  -7.049  -0.454   0.577
  506    HD1  TYR  61           HD1      TYR  61 -10.516  -1.598  -0.281
  507    HD2  TYR  61           HD2      TYR  61  -7.332  -1.583   2.602
  508    HE1  TYR  61           HE1      TYR  61 -11.813  -3.144   1.160
  509    HE2  TYR  61           HE2      TYR  61  -8.629  -3.129   4.043
  510    HH   TYR  61           HH       TYR  61 -10.711  -4.988   3.333
  511    H    ILE  62           HN       ILE  62  -7.429   1.899  -1.733
  512    HA   ILE  62           HA       ILE  62  -5.370   3.223  -0.170
  513    HB   ILE  62           HB       ILE  62  -6.314   3.422  -3.049
  514   1HG1  ILE  62          HG1       ILE  62  -3.819   2.079  -2.011
  515   2HG1  ILE  62          HG1       ILE  62  -5.362   1.225  -2.042
  516   1HG2  ILE  62          HG2       ILE  62  -4.756   5.007  -3.435
  517   2HG2  ILE  62          HG2       ILE  62  -3.535   4.123  -2.519
  518   3HG2  ILE  62          HG2       ILE  62  -4.651   5.203  -1.686
  519   1HD1  ILE  62          HD1       ILE  62  -3.837   0.977  -4.110
  520   2HD1  ILE  62          HD1       ILE  62  -4.302   2.636  -4.489
  521   3HD1  ILE  62          HD1       ILE  62  -5.530   1.373  -4.397
  522    H    SER  63           HN       SER  63  -8.389   4.244  -1.753
  523    HA   SER  63           HA       SER  63  -8.017   7.070  -1.154
  524   1HB   SER  63          HB2       SER  63  -9.996   5.257  -2.400
  525   2HB   SER  63          HB1       SER  63 -10.678   6.707  -1.672
  526    HG   SER  63           HG       SER  63  -8.578   6.560  -3.582
  527    H    LEU  64           HN       LEU  64  -9.381   4.303   0.503
  528    HA   LEU  64           HA       LEU  64 -10.866   5.947   2.447
  529   1HB   LEU  64          HB2       LEU  64 -10.486   3.086   1.731
  530   2HB   LEU  64          HB1       LEU  64 -10.880   3.414   3.420
  531    HG   LEU  64           HG       LEU  64 -12.476   4.886   1.391
  532   1HD1  LEU  64          HD1       LEU  64 -12.987   3.009   0.227
  533   2HD1  LEU  64          HD1       LEU  64 -13.903   2.532   1.657
  534   3HD1  LEU  64          HD1       LEU  64 -12.250   1.959   1.437
  535   1HD2  LEU  64          HD2       LEU  64 -12.971   3.485   4.029
  536   2HD2  LEU  64          HD2       LEU  64 -14.279   4.156   3.055
  537   3HD2  LEU  64          HD2       LEU  64 -13.025   5.216   3.696
  538    H    LEU  65           HN       LEU  65  -8.017   3.753   2.520
  539    HA   LEU  65           HA       LEU  65  -7.316   4.037   5.231
  540   1HB   LEU  65          HB2       LEU  65  -5.989   3.395   2.667
  541   2HB   LEU  65          HB1       LEU  65  -4.900   3.931   3.944
  542    HG   LEU  65           HG       LEU  65  -6.919   1.678   4.180
  543   1HD1  LEU  65          HD1       LEU  65  -5.246   0.227   3.666
  544   2HD1  LEU  65          HD1       LEU  65  -4.055   1.142   4.589
  545   3HD1  LEU  65          HD1       LEU  65  -4.455   1.627   2.943
  546   1HD2  LEU  65          HD2       LEU  65  -4.873   1.794   6.218
  547   2HD2  LEU  65          HD2       LEU  65  -6.626   1.808   6.410
  548   3HD2  LEU  65          HD2       LEU  65  -5.753   3.320   6.161
  549    H    LYS  66           HN       LYS  66  -6.521   6.162   2.494
  550    HA   LYS  66           HA       LYS  66  -6.372   8.523   4.150
  551   1HB   LYS  66          HB2       LYS  66  -4.085   6.773   4.024
  552   2HB   LYS  66          HB1       LYS  66  -3.678   8.314   3.268
  553   1HG   LYS  66          HG2       LYS  66  -5.087   8.197   5.935
  554   2HG   LYS  66          HG1       LYS  66  -3.328   8.123   5.819
  555   1HD   LYS  66          HD2       LYS  66  -3.439  10.245   4.431
  556   2HD   LYS  66          HD1       LYS  66  -5.142  10.356   4.878
  557   1HE   LYS  66          HE2       LYS  66  -4.035   9.961   7.333
  558   2HE   LYS  66          HE1       LYS  66  -2.731  10.856   6.530
  559   1HZ   LYS  66          HZ1       LYS  66  -4.628  12.200   7.582
  560   2HZ   LYS  66          HZ2       LYS  66  -5.550  11.693   6.247
  561   3HZ   LYS  66          HZ3       LYS  66  -4.139  12.612   6.011
  562    H    THR  67           HN       THR  67  -4.531  10.020   2.626
  563    HA   THR  67           HA       THR  67  -5.441   9.707  -0.191
  564    HB   THR  67           HB       THR  67  -5.407  12.379   1.197
  565    HG1  THR  67           HG1      THR  67  -6.898  11.562   2.439
  566   1HG2  THR  67          HG2       THR  67  -5.640  12.032  -1.337
  567   2HG2  THR  67          HG2       THR  67  -6.866  13.031  -0.557
  568   3HG2  THR  67          HG2       THR  67  -7.231  11.359  -0.982
  569    HA   PRO  68           HA       PRO  68  -1.121  10.618  -0.717
  570   1HB   PRO  68          HB2       PRO  68  -1.089  10.761  -3.446
  571   2HB   PRO  68          HB1       PRO  68  -1.184   9.228  -2.558
  572   1HG   PRO  68          HG2       PRO  68  -3.318  10.737  -3.956
  573   2HG   PRO  68          HG1       PRO  68  -3.099   8.993  -3.773
  574   1HD   PRO  68          HD2       PRO  68  -4.874  10.527  -2.315
  575   2HD   PRO  68          HD1       PRO  68  -4.259   8.935  -1.824
  576    H    LYS  69           HN       LYS  69  -3.199  12.434  -3.026
  577    HA   LYS  69           HA       LYS  69  -1.465  14.732  -3.100
  578   1HB   LYS  69          HB2       LYS  69  -3.351  15.708  -4.341
  579   2HB   LYS  69          HB1       LYS  69  -3.086  14.040  -4.849
  580   1HG   LYS  69          HG2       LYS  69  -4.915  13.259  -3.469
  581   2HG   LYS  69          HG1       LYS  69  -5.108  14.855  -2.744
  582   1HD   LYS  69          HD2       LYS  69  -5.652  15.775  -4.999
  583   2HD   LYS  69          HD1       LYS  69  -5.567  14.139  -5.654
  584   1HE   LYS  69          HE2       LYS  69  -7.611  13.575  -4.810
  585   2HE   LYS  69          HE1       LYS  69  -7.298  14.400  -3.269
  586   1HZ   LYS  69          HZ1       LYS  69  -7.717  15.879  -5.801
  587   2HZ   LYS  69          HZ2       LYS  69  -7.763  16.482  -4.214
  588   3HZ   LYS  69          HZ3       LYS  69  -9.007  15.471  -4.777
  589    H    GLN  70           HN       GLN  70  -2.099  16.924  -2.325
  590    HA   GLN  70           HA       GLN  70  -4.122  17.312  -0.304
  591   1HB   GLN  70          HB2       GLN  70  -2.501  17.467   1.622
  592   2HB   GLN  70          HB1       GLN  70  -2.676  15.834   0.978
  593   1HG   GLN  70          HG2       GLN  70  -0.536  15.772   0.209
  594   2HG   GLN  70          HG1       GLN  70  -0.579  17.451  -0.328
  595   1HE2  GLN  70          HE2       GLN  70  -0.776  19.047   1.739
  596   2HE2  GLN  70          HE2       GLN  70   0.308  18.693   2.996
  597    H    LEU  71           HN       LEU  71  -4.314  19.532   0.154
  598    HA   LEU  71           HA       LEU  71  -2.718  21.361  -1.489
  599   1HB   LEU  71          HB2       LEU  71  -5.125  21.438   0.288
  600   2HB   LEU  71          HB1       LEU  71  -4.310  22.962  -0.060
  601    HG   LEU  71           HG       LEU  71  -4.462  22.434  -2.500
  602   1HD1  LEU  71          HD1       LEU  71  -6.279  20.621  -2.978
  603   2HD1  LEU  71          HD1       LEU  71  -5.868  20.021  -1.371
  604   3HD1  LEU  71          HD1       LEU  71  -4.632  20.093  -2.629
  605   1HD2  LEU  71          HD2       LEU  71  -6.174  23.827  -1.323
  606   2HD2  LEU  71          HD2       LEU  71  -7.129  22.369  -1.053
  607   3HD2  LEU  71          HD2       LEU  71  -6.845  22.944  -2.695
  Start of MODEL   13
    1   1H    THR   1          HT1       THR   1   8.015  16.332  -1.312
    2   2H    THR   1          HT2       THR   1   8.491  15.181  -2.467
    3   3H    THR   1          HT3       THR   1   6.857  15.625  -2.330
    4    HA   THR   1           HA       THR   1   7.575  16.805  -4.201
    5    HB   THR   1           HB       THR   1   7.957  18.619  -1.800
    6    HG1  THR   1           HG1      THR   1   5.829  18.530  -1.513
    7   1HG2  THR   1          HG2       THR   1   7.695  20.328  -3.249
    8   2HG2  THR   1          HG2       THR   1   6.318  19.546  -4.028
    9   3HG2  THR   1          HG2       THR   1   7.961  19.150  -4.534
   10    H    ARG   2           HN       ARG   2   9.983  16.648  -1.646
   11    HA   ARG   2           HA       ARG   2  12.054  17.557  -3.621
   12   1HB   ARG   2          HB2       ARG   2  11.326  19.002  -1.530
   13   2HB   ARG   2          HB1       ARG   2  12.345  17.866  -0.645
   14   1HG   ARG   2          HG2       ARG   2  13.901  18.504  -2.844
   15   2HG   ARG   2          HG1       ARG   2  13.118  20.036  -2.457
   16   1HD   ARG   2          HD2       ARG   2  13.792  19.486   0.012
   17   2HD   ARG   2          HD1       ARG   2  14.954  18.375  -0.740
   18    HE   ARG   2           HE       ARG   2  15.508  20.517  -2.195
   19   1HH1  ARG   2          HH1       ARG   2  16.904  20.031   0.504
   20   2HH1  ARG   2          HH1       ARG   2  16.784  21.607   1.213
   21   1HH2  ARG   2          HH2       ARG   2  14.370  22.718  -1.015
   22   2HH2  ARG   2          HH2       ARG   2  15.349  23.128   0.354
   23    H    GLY   3           HN       GLY   3  11.312  15.474  -0.832
   24   1HA   GLY   3          HA2       GLY   3  12.906  13.307  -1.838
   25   2HA   GLY   3          HA1       GLY   3  13.785  14.153  -0.563
   26    H    SER   4           HN       SER   4  10.280  13.587  -0.819
   27    HA   SER   4           HA       SER   4  10.404  12.274   1.865
   28   1HB   SER   4          HB2       SER   4   8.647  14.140   0.460
   29   2HB   SER   4          HB1       SER   4   7.753  12.807   1.185
   30    HG   SER   4           HG       SER   4   8.303  13.483   3.121
   31    H    ASP   5           HN       ASP   5  11.211  10.445   0.115
   32    HA   ASP   5           HA       ASP   5   8.816   8.729  -0.327
   33   1HB   ASP   5          HB2       ASP   5  11.034   9.433  -2.268
   34   2HB   ASP   5          HB1       ASP   5   9.908   8.102  -2.534
   35    H    ILE   6           HN       ILE   6   9.505   7.471   1.521
   36    HA   ILE   6           HA       ILE   6  12.116   6.036   1.171
   37    HB   ILE   6           HB       ILE   6  10.413   6.580   3.626
   38   1HG1  ILE   6          HG1       ILE   6  13.086   7.744   2.778
   39   2HG1  ILE   6          HG1       ILE   6  11.541   8.581   2.635
   40   1HG2  ILE   6          HG2       ILE   6  11.569   4.670   4.238
   41   2HG2  ILE   6          HG2       ILE   6  12.773   5.892   4.644
   42   3HG2  ILE   6          HG2       ILE   6  12.903   4.996   3.131
   43   1HD1  ILE   6          HD1       ILE   6  13.097   8.896   4.782
   44   2HD1  ILE   6          HD1       ILE   6  12.255   7.436   5.300
   45   3HD1  ILE   6          HD1       ILE   6  11.339   8.892   4.914
   46    H    SER   7           HN       SER   7   9.684   5.226  -0.207
   47    HA   SER   7           HA       SER   7   8.746   2.851   1.307
   48   1HB   SER   7          HB2       SER   7   6.929   2.887  -0.230
   49   2HB   SER   7          HB1       SER   7   7.277   4.585   0.082
   50    HG   SER   7           HG       SER   7   7.154   4.324  -2.117
   51    H    LYS   8           HN       LYS   8  11.440   2.675   0.466
   52    HA   LYS   8           HA       LYS   8  11.824   1.483  -2.106
   53   1HB   LYS   8          HB2       LYS   8  13.256   1.381   0.554
   54   2HB   LYS   8          HB1       LYS   8  13.889   0.553  -0.869
   55   1HG   LYS   8          HG2       LYS   8  13.077   3.340  -1.368
   56   2HG   LYS   8          HG1       LYS   8  14.416   3.172  -0.231
   57   1HD   LYS   8          HD2       LYS   8  14.688   1.394  -2.535
   58   2HD   LYS   8          HD1       LYS   8  14.624   3.094  -3.002
   59   1HE   LYS   8          HE2       LYS   8  16.296   3.147  -0.793
   60   2HE   LYS   8          HE1       LYS   8  16.757   1.637  -1.605
   61   1HZ   LYS   8          HZ1       LYS   8  17.856   3.716  -2.476
   62   2HZ   LYS   8          HZ2       LYS   8  16.333   4.179  -3.071
   63   3HZ   LYS   8          HZ3       LYS   8  17.075   2.759  -3.636
   64    H    THR   9           HN       THR   9   9.959   0.013  -2.253
   65    HA   THR   9           HA       THR   9  10.644  -2.689  -1.327
   66    HB   THR   9           HB       THR   9   8.071  -1.352  -0.453
   67    HG1  THR   9           HG1      THR   9   9.066  -1.267   1.581
   68   1HG2  THR   9          HG2       THR   9   9.404  -3.911   0.456
   69   2HG2  THR   9          HG2       THR   9   8.084  -3.837  -0.713
   70   3HG2  THR   9          HG2       THR   9   7.820  -3.312   0.951
   71    H    CYS  10           HN       CYS  10  10.599  -3.138  -3.633
   72    HA   CYS  10           HA       CYS  10   8.520  -2.467  -5.437
   73   1HB   CYS  10          HB2       CYS  10  10.285  -4.933  -5.271
   74   2HB   CYS  10          HB1       CYS  10   9.435  -4.386  -6.716
   75    H    CYS  11           HN       CYS  11   7.145  -4.427  -6.449
   76    HA   CYS  11           HA       CYS  11   5.891  -5.979  -4.215
   77   1HB   CYS  11          HB2       CYS  11   4.658  -4.133  -6.265
   78   2HB   CYS  11          HB1       CYS  11   3.700  -5.363  -5.441
   79    H    PHE  12           HN       PHE  12   5.486  -8.095  -4.778
   80    HA   PHE  12           HA       PHE  12   5.434  -8.810  -7.674
   81   1HB   PHE  12          HB2       PHE  12   6.869 -10.779  -7.039
   82   2HB   PHE  12          HB1       PHE  12   7.675  -9.225  -6.827
   83    HD1  PHE  12           HD1      PHE  12   8.031  -8.279  -4.584
   84    HD2  PHE  12           HD2      PHE  12   6.204 -12.128  -5.126
   85    HE1  PHE  12           HE1      PHE  12   8.395  -8.788  -2.186
   86    HE2  PHE  12           HE2      PHE  12   6.568 -12.638  -2.726
   87    HZ   PHE  12           HZ       PHE  12   7.664 -10.968  -1.256
   88    H    GLN  13           HN       GLN  13   4.771  -9.870  -4.333
   89    HA   GLN  13           HA       GLN  13   2.802 -11.851  -5.327
   90   1HB   GLN  13          HB2       GLN  13   4.513 -12.398  -3.584
   91   2HB   GLN  13          HB1       GLN  13   3.774 -11.192  -2.530
   92   1HG   GLN  13          HG2       GLN  13   2.123 -12.608  -1.932
   93   2HG   GLN  13          HG1       GLN  13   1.782 -13.015  -3.614
   94   1HE2  GLN  13          HE2       GLN  13   2.622 -14.994  -4.430
   95   2HE2  GLN  13          HE2       GLN  13   3.566 -16.061  -3.505
   96    H    TYR  14           HN       TYR  14   0.858 -10.836  -5.809
   97    HA   TYR  14           HA       TYR  14  -0.096  -8.578  -4.171
   98   1HB   TYR  14          HB2       TYR  14  -1.257 -10.054  -6.555
   99   2HB   TYR  14          HB1       TYR  14  -1.864  -8.532  -5.903
  100    HD1  TYR  14           HD1      TYR  14  -0.304  -9.565  -8.642
  101    HD2  TYR  14           HD2      TYR  14   0.569  -7.044  -5.275
  102    HE1  TYR  14           HE1      TYR  14   1.355  -8.321 -10.003
  103    HE2  TYR  14           HE2      TYR  14   2.227  -5.801  -6.636
  104    HH   TYR  14           HH       TYR  14   3.171  -6.889  -9.828
  105    H    SER  15           HN       SER  15  -2.088  -8.654  -2.982
  106    HA   SER  15           HA       SER  15  -2.911 -11.400  -2.165
  107   1HB   SER  15          HB2       SER  15  -3.804 -10.061  -0.169
  108   2HB   SER  15          HB1       SER  15  -2.053 -10.093  -0.357
  109    HG   SER  15           HG       SER  15  -3.773  -8.065  -1.360
  110    H    HIS  16           HN       HIS  16  -5.345 -11.337  -1.365
  111    HA   HIS  16           HA       HIS  16  -7.085  -9.553  -2.950
  112   1HB   HIS  16          HB2       HIS  16  -8.133 -11.533  -4.087
  113   2HB   HIS  16          HB1       HIS  16  -6.455 -11.275  -4.559
  114    HD1  HIS  16           HD1      HIS  16  -4.660 -12.763  -3.095
  115    HD2  HIS  16           HD2      HIS  16  -8.613 -14.084  -3.125
  116    HE1  HIS  16           HE1      HIS  16  -4.613 -15.178  -2.336
  117    H    LYS  17           HN       LYS  17  -7.663  -9.079  -0.649
  118    HA   LYS  17           HA       LYS  17 -10.026 -10.516   0.189
  119   1HB   LYS  17          HB2       LYS  17  -7.368 -11.357   1.124
  120   2HB   LYS  17          HB1       LYS  17  -8.498 -11.034   2.440
  121   1HG   LYS  17          HG2       LYS  17 -10.102 -12.428   0.733
  122   2HG   LYS  17          HG1       LYS  17  -8.540 -13.179   0.404
  123   1HD   LYS  17          HD2       LYS  17  -9.138 -14.462   2.213
  124   2HD   LYS  17          HD1       LYS  17  -8.414 -13.114   3.090
  125   1HE   LYS  17          HE2       LYS  17 -10.407 -12.585   4.027
  126   2HE   LYS  17          HE1       LYS  17 -11.195 -12.548   2.436
  127   1HZ   LYS  17          HZ1       LYS  17 -10.721 -14.875   4.200
  128   2HZ   LYS  17          HZ2       LYS  17 -10.990 -15.073   2.534
  129   3HZ   LYS  17          HZ3       LYS  17 -12.181 -14.355   3.510
  130    HA   PRO  18           HA       PRO  18 -10.357  -6.623   2.253
  131   1HB   PRO  18          HB2       PRO  18 -12.470  -7.163   3.905
  132   2HB   PRO  18          HB1       PRO  18 -12.652  -6.904   2.158
  133   1HG   PRO  18          HG2       PRO  18 -12.626  -9.441   3.701
  134   2HG   PRO  18          HG1       PRO  18 -13.581  -8.991   2.281
  135   1HD   PRO  18          HD2       PRO  18 -11.353 -10.590   2.194
  136   2HD   PRO  18          HD1       PRO  18 -11.946  -9.627   0.823
  137    H    LEU  19           HN       LEU  19  -8.568  -6.362   3.605
  138    HA   LEU  19           HA       LEU  19  -7.969  -8.055   5.867
  139   1HB   LEU  19          HB2       LEU  19  -6.724  -6.127   4.330
  140   2HB   LEU  19          HB1       LEU  19  -6.951  -5.291   5.866
  141    HG   LEU  19           HG       LEU  19  -6.044  -8.022   6.281
  142   1HD1  LEU  19          HD1       LEU  19  -4.863  -7.923   4.230
  143   2HD1  LEU  19          HD1       LEU  19  -3.675  -7.431   5.437
  144   3HD1  LEU  19          HD1       LEU  19  -4.475  -6.216   4.439
  145   1HD2  LEU  19          HD2       LEU  19  -5.149  -6.962   8.061
  146   2HD2  LEU  19          HD2       LEU  19  -5.823  -5.456   7.440
  147   3HD2  LEU  19          HD2       LEU  19  -4.180  -5.929   7.010
  148    HA   PRO  20           HA       PRO  20 -10.640  -6.249   8.878
  149   1HB   PRO  20          HB2       PRO  20  -9.185  -6.707  11.155
  150   2HB   PRO  20          HB1       PRO  20 -10.064  -7.989  10.296
  151   1HG   PRO  20          HG2       PRO  20  -7.164  -7.304  10.222
  152   2HG   PRO  20          HG1       PRO  20  -7.947  -8.892  10.246
  153   1HD   PRO  20          HD2       PRO  20  -6.943  -7.774   7.986
  154   2HD   PRO  20          HD1       PRO  20  -8.332  -8.883   7.980
  155    H    TRP  21           HN       TRP  21 -10.737  -4.023   8.766
  156    HA   TRP  21           HA       TRP  21  -8.678  -2.159   8.664
  157   1HB   TRP  21          HB2       TRP  21 -11.429  -2.028   9.930
  158   2HB   TRP  21          HB1       TRP  21 -10.442  -0.602   9.602
  159    HD1  TRP  21           HD1      TRP  21 -12.526  -3.266   7.906
  160    HE1  TRP  21           HE1      TRP  21 -12.782  -2.683   5.405
  161    HE3  TRP  21           HE3      TRP  21  -9.248   0.634   7.572
  162    HZ2  TRP  21           HZ2      TRP  21 -11.726  -0.811   3.517
  163    HZ3  TRP  21           HZ3      TRP  21  -8.895   1.798   5.414
  164    HH2  TRP  21           HH2      TRP  21 -10.129   1.082   3.388
  165    H    THR  22           HN       THR  22  -9.851  -3.881  11.488
  166    HA   THR  22           HA       THR  22  -8.867  -2.223  13.570
  167    HB   THR  22           HB       THR  22  -8.561  -4.622  14.628
  168    HG1  THR  22           HG1      THR  22  -8.494  -5.827  12.798
  169   1HG2  THR  22          HG2       THR  22 -11.194  -3.551  13.580
  170   2HG2  THR  22          HG2       THR  22 -10.454  -3.189  15.140
  171   3HG2  THR  22          HG2       THR  22 -11.055  -4.813  14.805
  172    H    TRP  23           HN       TRP  23  -7.228  -4.438  11.382
  173    HA   TRP  23           HA       TRP  23  -4.628  -3.916  12.744
  174   1HB   TRP  23          HB2       TRP  23  -5.910  -6.129  11.276
  175   2HB   TRP  23          HB1       TRP  23  -4.231  -5.850  10.817
  176    HD1  TRP  23           HD1      TRP  23  -5.206  -5.016  14.377
  177    HE1  TRP  23           HE1      TRP  23  -4.152  -6.739  15.978
  178    HE3  TRP  23           HE3      TRP  23  -3.466  -8.421  10.991
  179    HZ2  TRP  23           HZ2      TRP  23  -2.757  -9.232  15.843
  180    HZ3  TRP  23           HZ3      TRP  23  -2.281 -10.458  11.754
  181    HH2  TRP  23           HH2      TRP  23  -1.924 -10.869  14.173
  182    H    VAL  24           HN       VAL  24  -6.448  -2.690  10.217
  183    HA   VAL  24           HA       VAL  24  -4.205  -2.360   8.327
  184    HB   VAL  24           HB       VAL  24  -7.018  -1.222   8.301
  185   1HG1  VAL  24          HG1       VAL  24  -5.458  -1.833   5.837
  186   2HG1  VAL  24          HG1       VAL  24  -4.939  -0.436   6.780
  187   3HG1  VAL  24          HG1       VAL  24  -6.586  -0.515   6.156
  188   1HG2  VAL  24          HG2       VAL  24  -6.146  -3.587   6.670
  189   2HG2  VAL  24          HG2       VAL  24  -7.762  -3.150   7.222
  190   3HG2  VAL  24          HG2       VAL  24  -6.603  -3.843   8.354
  191    H    ARG  25           HN       ARG  25  -3.102  -0.385   8.037
  192    HA   ARG  25           HA       ARG  25  -3.828   1.800   9.964
  193   1HB   ARG  25          HB2       ARG  25  -1.793   0.581  10.579
  194   2HB   ARG  25          HB1       ARG  25  -1.131   0.836   8.964
  195   1HG   ARG  25          HG2       ARG  25  -0.669   3.060   9.350
  196   2HG   ARG  25          HG1       ARG  25  -2.017   3.253  10.472
  197   1HD   ARG  25          HD2       ARG  25  -0.767   2.603  12.287
  198   2HD   ARG  25          HD1       ARG  25   0.157   1.412  11.349
  199    HE   ARG  25           HE       ARG  25   1.147   3.608  10.237
  200   1HH1  ARG  25          HH1       ARG  25   1.398   2.383  13.321
  201   2HH1  ARG  25          HH1       ARG  25   2.026   3.824  14.048
  202   1HH2  ARG  25          HH2       ARG  25   1.464   5.798  11.255
  203   2HH2  ARG  25          HH2       ARG  25   2.061   5.757  12.880
  204    H    SER  26           HN       SER  26  -2.304   1.098   6.798
  205    HA   SER  26           HA       SER  26  -3.602   3.335   5.507
  206   1HB   SER  26          HB2       SER  26  -1.658   4.812   5.343
  207   2HB   SER  26          HB1       SER  26  -1.982   4.479   7.041
  208    HG   SER  26           HG       SER  26   0.002   3.798   7.083
  209    H    TYR  27           HN       TYR  27  -1.432   3.875   3.650
  210    HA   TYR  27           HA       TYR  27  -0.673   1.231   2.557
  211   1HB   TYR  27          HB2       TYR  27  -1.920   1.540   0.522
  212   2HB   TYR  27          HB1       TYR  27  -3.038   1.858   1.844
  213    HD1  TYR  27           HD1      TYR  27  -3.365   4.314   2.576
  214    HD2  TYR  27           HD2      TYR  27  -1.516   3.167  -1.126
  215    HE1  TYR  27           HE1      TYR  27  -3.783   6.582   1.664
  216    HE2  TYR  27           HE2      TYR  27  -1.933   5.432  -2.039
  217    HH   TYR  27           HH       TYR  27  -2.385   7.641  -1.334
  218    H    GLU  28           HN       GLU  28   0.196   1.981   0.077
  219    HA   GLU  28           HA       GLU  28   1.569   4.500  -0.082
  220   1HB   GLU  28          HB2       GLU  28   3.860   3.618   0.429
  221   2HB   GLU  28          HB1       GLU  28   2.796   3.594   1.835
  222   1HG   GLU  28          HG2       GLU  28   2.232   1.159   1.038
  223   2HG   GLU  28          HG1       GLU  28   3.750   1.294   0.150
  224    H    PHE  29           HN       PHE  29   2.364   4.726  -2.182
  225    HA   PHE  29           HA       PHE  29   1.856   2.550  -4.069
  226   1HB   PHE  29          HB2       PHE  29   2.459   5.429  -4.045
  227   2HB   PHE  29          HB1       PHE  29   3.181   4.573  -5.407
  228    HD1  PHE  29           HD1      PHE  29   1.854   3.824  -7.228
  229    HD2  PHE  29           HD2      PHE  29  -0.031   5.156  -3.605
  230    HE1  PHE  29           HE1      PHE  29  -0.356   3.746  -8.349
  231    HE2  PHE  29           HE2      PHE  29  -2.241   5.076  -4.726
  232    HZ   PHE  29           HZ       PHE  29  -2.404   4.372  -7.098
  233    H    THR  30           HN       THR  30   3.477   1.495  -5.346
  234    HA   THR  30           HA       THR  30   5.877   0.720  -4.058
  235    HB   THR  30           HB       THR  30   6.424   0.199  -6.624
  236    HG1  THR  30           HG1      THR  30   4.942   1.129  -7.788
  237   1HG2  THR  30          HG2       THR  30   4.401  -1.001  -4.763
  238   2HG2  THR  30          HG2       THR  30   5.958  -1.645  -5.283
  239   3HG2  THR  30          HG2       THR  30   4.583  -1.667  -6.386
  240    H    SER  31           HN       SER  31   8.130   1.194  -4.823
  241    HA   SER  31           HA       SER  31   8.588   4.071  -5.015
  242   1HB   SER  31          HB2       SER  31  10.890   3.410  -4.732
  243   2HB   SER  31          HB1       SER  31   9.924   2.335  -3.725
  244    HG   SER  31           HG       SER  31  11.627   1.538  -5.404
  245    H    ASN  32           HN       ASN  32  10.022   4.976  -6.759
  246    HA   ASN  32           HA       ASN  32   9.128   4.034  -9.411
  247   1HB   ASN  32          HB2       ASN  32  10.545   6.425  -8.251
  248   2HB   ASN  32          HB1       ASN  32  10.533   6.168  -9.997
  249   1HD2  ASN  32          HD2       ASN  32   8.859   7.327 -10.950
  250   2HD2  ASN  32          HD2       ASN  32   7.321   7.564 -10.270
  251    H    SER  33           HN       SER  33  10.732   2.061  -8.435
  252    HA   SER  33           HA       SER  33  13.025   2.125 -10.264
  253   1HB   SER  33          HB2       SER  33  13.206   2.560  -7.327
  254   2HB   SER  33          HB1       SER  33  14.405   1.479  -8.029
  255    HG   SER  33           HG       SER  33  13.784   4.085  -8.974
  256    H    CYS  34           HN       CYS  34  10.630   0.463  -9.871
  257    HA   CYS  34           HA       CYS  34  11.922  -2.143  -9.121
  258   1HB   CYS  34          HB2       CYS  34   9.070  -1.128  -8.913
  259   2HB   CYS  34          HB1       CYS  34   9.543  -2.796  -8.581
  260    H    SER  35           HN       SER  35  10.331  -3.957 -10.225
  261    HA   SER  35           HA       SER  35  10.663  -3.554 -13.120
  262   1HB   SER  35          HB2       SER  35  11.112  -5.643 -11.617
  263   2HB   SER  35          HB1       SER  35   9.375  -5.909 -11.745
  264    HG   SER  35           HG       SER  35  11.091  -6.721 -13.434
  265    H    GLN  36           HN       GLN  36   8.004  -3.884 -10.789
  266    HA   GLN  36           HA       GLN  36   6.120  -2.978 -12.936
  267   1HB   GLN  36          HB2       GLN  36   6.278  -5.506 -11.554
  268   2HB   GLN  36          HB1       GLN  36   4.762  -4.707 -11.139
  269   1HG   GLN  36          HG2       GLN  36   4.270  -5.928 -13.114
  270   2HG   GLN  36          HG1       GLN  36   4.501  -4.268 -13.663
  271   1HE2  GLN  36          HE2       GLN  36   6.743  -7.010 -12.911
  272   2HE2  GLN  36          HE2       GLN  36   7.618  -6.876 -14.360
  273    H    ARG  37           HN       ARG  37   4.566  -1.497 -12.200
  274    HA   ARG  37           HA       ARG  37   5.035  -0.291  -9.565
  275   1HB   ARG  37          HB2       ARG  37   3.550   0.292 -12.084
  276   2HB   ARG  37          HB1       ARG  37   2.970   1.074 -10.614
  277   1HG   ARG  37          HG2       ARG  37   5.502   1.649 -10.243
  278   2HG   ARG  37          HG1       ARG  37   5.632   1.356 -11.978
  279   1HD   ARG  37          HD2       ARG  37   3.638   2.967 -12.240
  280   2HD   ARG  37          HD1       ARG  37   3.962   3.444 -10.561
  281    HE   ARG  37           HE       ARG  37   6.129   4.268 -11.246
  282   1HH1  ARG  37          HH1       ARG  37   4.493   5.484 -13.420
  283   2HH1  ARG  37          HH1       ARG  37   5.352   5.001 -14.846
  284   1HH2  ARG  37          HH2       ARG  37   7.151   2.509 -13.240
  285   2HH2  ARG  37          HH2       ARG  37   6.857   3.318 -14.743
  286    H    ALA  38           HN       ALA  38   3.647  -0.442  -7.806
  287    HA   ALA  38           HA       ALA  38   0.950  -1.571  -8.073
  288   1HB   ALA  38          HB1       ALA  38   1.696  -3.698  -7.830
  289   2HB   ALA  38          HB2       ALA  38   2.087  -3.262  -6.167
  290   3HB   ALA  38          HB3       ALA  38   3.322  -3.150  -7.421
  291    H    VAL  39           HN       VAL  39  -0.266  -1.330  -6.088
  292    HA   VAL  39           HA       VAL  39   0.840   0.740  -4.275
  293    HB   VAL  39           HB       VAL  39  -1.901  -0.550  -4.476
  294   1HG1  VAL  39          HG1       VAL  39  -0.708   1.580  -2.800
  295   2HG1  VAL  39          HG1       VAL  39  -2.102   0.546  -2.483
  296   3HG1  VAL  39          HG1       VAL  39  -2.274   1.968  -3.512
  297   1HG2  VAL  39          HG2       VAL  39  -0.535   1.598  -6.011
  298   2HG2  VAL  39          HG2       VAL  39  -2.193   1.935  -5.516
  299   3HG2  VAL  39          HG2       VAL  39  -1.839   0.518  -6.506
  300    H    ILE  40           HN       ILE  40   0.567   0.427  -1.886
  301    HA   ILE  40           HA       ILE  40   0.572  -2.452  -1.078
  302    HB   ILE  40           HB       ILE  40   2.522  -0.228  -0.420
  303   1HG1  ILE  40          HG1       ILE  40   3.788  -2.630  -1.204
  304   2HG1  ILE  40          HG1       ILE  40   2.445  -2.399  -2.325
  305   1HG2  ILE  40          HG2       ILE  40   2.823  -1.238   1.572
  306   2HG2  ILE  40          HG2       ILE  40   3.450  -2.626   0.684
  307   3HG2  ILE  40          HG2       ILE  40   1.744  -2.562   1.130
  308   1HD1  ILE  40          HD1       ILE  40   3.299  -0.412  -3.153
  309   2HD1  ILE  40          HD1       ILE  40   4.803  -1.245  -2.758
  310   3HD1  ILE  40          HD1       ILE  40   4.151  -0.033  -1.656
  311    H    PHE  41           HN       PHE  41  -0.684  -2.829   0.696
  312    HA   PHE  41           HA       PHE  41  -1.789  -0.502   2.211
  313   1HB   PHE  41          HB2       PHE  41  -2.630  -3.409   1.893
  314   2HB   PHE  41          HB1       PHE  41  -3.486  -2.235   2.890
  315    HD1  PHE  41           HD1      PHE  41  -3.836   0.133   1.521
  316    HD2  PHE  41           HD2      PHE  41  -3.582  -3.800  -0.183
  317    HE1  PHE  41           HE1      PHE  41  -5.090   0.916  -0.470
  318    HE2  PHE  41           HE2      PHE  41  -4.837  -3.019  -2.174
  319    HZ   PHE  41           HZ       PHE  41  -5.592  -0.662  -2.318
  320    H    THR  42           HN       THR  42  -0.946  -0.224   4.289
  321    HA   THR  42           HA       THR  42   0.633  -2.497   5.392
  322    HB   THR  42           HB       THR  42   1.810  -0.383   5.030
  323    HG1  THR  42           HG1      THR  42   2.406  -0.013   7.264
  324   1HG2  THR  42          HG2       THR  42   0.046   1.212   5.099
  325   2HG2  THR  42          HG2       THR  42   1.081   1.584   6.477
  326   3HG2  THR  42          HG2       THR  42  -0.432   0.713   6.720
  327    H    THR  43           HN       THR  43   0.436  -2.995   7.660
  328    HA   THR  43           HA       THR  43  -2.334  -2.584   8.669
  329    HB   THR  43           HB       THR  43  -1.628  -4.548  10.125
  330    HG1  THR  43           HG1      THR  43   0.393  -5.041  10.096
  331   1HG2  THR  43          HG2       THR  43  -2.811  -4.688   7.866
  332   2HG2  THR  43          HG2       THR  43  -1.937  -6.134   8.371
  333   3HG2  THR  43          HG2       THR  43  -1.231  -5.051   7.172
  334    H    LYS  44           HN       LYS  44  -2.085  -2.985  11.321
  335    HA   LYS  44           HA       LYS  44  -0.911  -0.481  12.276
  336   1HB   LYS  44          HB2       LYS  44  -2.704  -2.651  13.217
  337   2HB   LYS  44          HB1       LYS  44  -1.816  -1.786  14.473
  338   1HG   LYS  44          HG2       LYS  44  -3.382  -0.374  12.301
  339   2HG   LYS  44          HG1       LYS  44  -4.076  -0.789  13.869
  340   1HD   LYS  44          HD2       LYS  44  -2.226   0.483  14.972
  341   2HD   LYS  44          HD1       LYS  44  -1.667   0.984  13.376
  342   1HE   LYS  44          HE2       LYS  44  -3.051   2.782  13.786
  343   2HE   LYS  44          HE1       LYS  44  -4.303   1.666  13.202
  344   1HZ   LYS  44          HZ1       LYS  44  -3.422   1.895  16.031
  345   2HZ   LYS  44          HZ2       LYS  44  -4.670   0.905  15.441
  346   3HZ   LYS  44          HZ3       LYS  44  -4.834   2.596  15.406
  347    H    ARG  45           HN       ARG  45  -0.016  -3.848  12.189
  348    HA   ARG  45           HA       ARG  45   1.959  -3.665  14.350
  349   1HB   ARG  45          HB2       ARG  45   0.758  -5.649  12.550
  350   2HB   ARG  45          HB1       ARG  45   2.472  -5.937  12.848
  351   1HG   ARG  45          HG2       ARG  45   1.682  -5.373  15.365
  352   2HG   ARG  45          HG1       ARG  45   0.178  -6.048  14.736
  353   1HD   ARG  45          HD2       ARG  45   1.724  -7.960  13.809
  354   2HD   ARG  45          HD1       ARG  45   2.858  -7.383  15.047
  355    HE   ARG  45           HE       ARG  45   0.294  -8.700  15.561
  356   1HH1  ARG  45          HH2       ARG  45   3.198  -8.186  16.943
  357   2HH1  ARG  45          HH2       ARG  45   2.623  -7.698  18.502
  358   1HH2  ARG  45          HH1       ARG  45  -0.672  -7.359  17.475
  359   2HH2  ARG  45          HH1       ARG  45   0.432  -7.231  18.804
  360    H    GLY  46           HN       GLY  46   1.896  -2.865  10.995
  361   1HA   GLY  46          HA2       GLY  46   3.812  -1.570  10.121
  362   2HA   GLY  46          HA1       GLY  46   4.874  -2.646  11.028
  363    H    LYS  47           HN       LYS  47   2.493  -4.595   9.787
  364    HA   LYS  47           HA       LYS  47   4.273  -5.728   7.780
  365   1HB   LYS  47          HB2       LYS  47   2.143  -6.536   9.381
  366   2HB   LYS  47          HB1       LYS  47   1.460  -6.553   7.755
  367   1HG   LYS  47          HG2       LYS  47   3.104  -8.075   6.964
  368   2HG   LYS  47          HG1       LYS  47   4.135  -7.815   8.372
  369   1HD   LYS  47          HD2       LYS  47   1.973  -8.680   9.667
  370   2HD   LYS  47          HD1       LYS  47   1.652  -9.461   8.117
  371   1HE   LYS  47          HE2       LYS  47   4.376  -9.939   8.565
  372   2HE   LYS  47          HE1       LYS  47   3.613 -10.181  10.149
  373   1HZ   LYS  47          HZ1       LYS  47   2.879 -11.436   7.566
  374   2HZ   LYS  47          HZ2       LYS  47   1.837 -11.440   8.908
  375   3HZ   LYS  47          HZ3       LYS  47   3.350 -12.209   9.000
  376    H    LYS  48           HN       LYS  48   4.313  -5.172   5.625
  377    HA   LYS  48           HA       LYS  48   2.119  -3.410   4.604
  378   1HB   LYS  48          HB2       LYS  48   4.945  -3.849   3.596
  379   2HB   LYS  48          HB1       LYS  48   3.824  -2.601   3.054
  380   1HG   LYS  48          HG2       LYS  48   3.835  -2.191   5.769
  381   2HG   LYS  48          HG1       LYS  48   5.500  -2.693   5.475
  382   1HD   LYS  48          HD2       LYS  48   5.253  -0.994   3.426
  383   2HD   LYS  48          HD1       LYS  48   4.051  -0.273   4.498
  384   1HE   LYS  48          HE2       LYS  48   6.917  -0.897   5.306
  385   2HE   LYS  48          HE1       LYS  48   6.312   0.714   4.869
  386   1HZ   LYS  48          HZ1       LYS  48   4.587   0.450   6.581
  387   2HZ   LYS  48          HZ2       LYS  48   6.153   0.426   7.243
  388   3HZ   LYS  48          HZ3       LYS  48   5.285  -1.023   7.051
  389    H    VAL  49           HN       VAL  49   0.829  -4.201   2.988
  390    HA   VAL  49           HA       VAL  49   1.675  -6.753   1.650
  391    HB   VAL  49           HB       VAL  49  -1.071  -5.577   2.193
  392   1HG1  VAL  49          HG1       VAL  49  -0.734  -8.445   1.560
  393   2HG1  VAL  49          HG1       VAL  49  -0.407  -7.346   0.221
  394   3HG1  VAL  49          HG1       VAL  49  -1.976  -7.313   1.026
  395   1HG2  VAL  49          HG2       VAL  49   0.766  -7.295   3.736
  396   2HG2  VAL  49          HG2       VAL  49  -0.870  -7.936   3.588
  397   3HG2  VAL  49          HG2       VAL  49  -0.609  -6.339   4.289
  398    H    CYS  50           HN       CYS  50   1.989  -6.636  -0.543
  399    HA   CYS  50           HA       CYS  50   1.569  -4.111  -1.962
  400   1HB   CYS  50          HB2       CYS  50   2.706  -6.838  -2.531
  401   2HB   CYS  50          HB1       CYS  50   2.425  -5.714  -3.861
  402    H    THR  51           HN       THR  51   0.187  -3.855  -3.815
  403    HA   THR  51           HA       THR  51  -1.797  -5.980  -4.409
  404    HB   THR  51           HB       THR  51  -3.465  -3.851  -4.119
  405    HG1  THR  51           HG1      THR  51  -2.114  -2.431  -3.214
  406   1HG2  THR  51          HG2       THR  51  -3.983  -5.960  -3.151
  407   2HG2  THR  51          HG2       THR  51  -3.932  -4.824  -1.803
  408   3HG2  THR  51          HG2       THR  51  -2.571  -5.907  -2.096
  409    H    HIS  52           HN       HIS  52  -3.359  -5.009  -6.199
  410    HA   HIS  52           HA       HIS  52  -1.616  -3.669  -8.196
  411   1HB   HIS  52          HB2       HIS  52  -3.277  -5.887  -8.233
  412   2HB   HIS  52          HB1       HIS  52  -4.254  -4.650  -9.024
  413    HD1  HIS  52           HD1      HIS  52  -1.215  -6.747  -9.474
  414    HD2  HIS  52           HD2      HIS  52  -3.068  -3.570 -11.435
  415    HE1  HIS  52           HE1      HIS  52  -0.129  -6.583 -11.756
  416    HA   PRO  53           HA       PRO  53  -4.013   0.030  -7.661
  417   1HB   PRO  53          HB2       PRO  53  -3.198   1.359  -9.907
  418   2HB   PRO  53          HB1       PRO  53  -2.176   1.181  -8.467
  419   1HG   PRO  53          HG2       PRO  53  -2.104  -0.317 -11.035
  420   2HG   PRO  53          HG1       PRO  53  -0.771   0.222 -10.002
  421   1HD   PRO  53          HD2       PRO  53  -1.709  -2.347 -10.068
  422   2HD   PRO  53          HD1       PRO  53  -0.891  -1.622  -8.667
  423    H    ARG  54           HN       ARG  54  -4.105  -1.880 -10.620
  424    HA   ARG  54           HA       ARG  54  -6.307  -0.551 -11.904
  425   1HB   ARG  54          HB2       ARG  54  -4.927  -3.211 -12.027
  426   2HB   ARG  54          HB1       ARG  54  -6.446  -3.008 -12.900
  427   1HG   ARG  54          HG2       ARG  54  -4.833  -0.696 -13.381
  428   2HG   ARG  54          HG1       ARG  54  -3.845  -2.128 -13.677
  429   1HD   ARG  54          HD2       ARG  54  -6.599  -2.292 -14.755
  430   2HD   ARG  54          HD1       ARG  54  -5.555  -1.085 -15.533
  431    HE   ARG  54           HE       ARG  54  -3.960  -3.372 -15.228
  432   1HH1  ARG  54          HH1       ARG  54  -6.672  -4.689 -15.752
  433   2HH1  ARG  54          HH1       ARG  54  -6.619  -4.876 -17.472
  434   1HH2  ARG  54          HH2       ARG  54  -3.983  -2.664 -17.899
  435   2HH2  ARG  54          HH2       ARG  54  -5.097  -3.731 -18.689
  436    H    LYS  55           HN       LYS  55  -6.195  -3.469  -9.822
  437    HA   LYS  55           HA       LYS  55  -8.894  -4.185  -9.804
  438   1HB   LYS  55          HB2       LYS  55  -6.587  -4.324  -7.941
  439   2HB   LYS  55          HB1       LYS  55  -8.177  -4.693  -7.266
  440   1HG   LYS  55          HG2       LYS  55  -8.547  -6.455  -8.816
  441   2HG   LYS  55          HG1       LYS  55  -7.223  -5.925  -9.854
  442   1HD   LYS  55          HD2       LYS  55  -6.166  -6.372  -7.245
  443   2HD   LYS  55          HD1       LYS  55  -7.132  -7.778  -7.691
  444   1HE   LYS  55          HE2       LYS  55  -5.320  -6.669  -9.792
  445   2HE   LYS  55          HE1       LYS  55  -4.568  -7.561  -8.454
  446   1HZ   LYS  55          HZ1       LYS  55  -5.441  -8.906 -10.436
  447   2HZ   LYS  55          HZ2       LYS  55  -6.986  -8.590  -9.805
  448   3HZ   LYS  55          HZ3       LYS  55  -5.844  -9.441  -8.878
  449    H    LYS  56           HN       LYS  56 -10.702  -3.041  -9.267
  450    HA   LYS  56           HA       LYS  56 -10.722  -0.414  -8.197
  451   1HB   LYS  56          HB2       LYS  56 -12.486  -2.034  -9.401
  452   2HB   LYS  56          HB1       LYS  56 -13.022  -2.265  -7.736
  453   1HG   LYS  56          HG2       LYS  56 -12.846   0.379  -7.660
  454   2HG   LYS  56          HG1       LYS  56 -13.047   0.221  -9.406
  455   1HD   LYS  56          HD2       LYS  56 -14.895  -1.017  -7.343
  456   2HD   LYS  56          HD1       LYS  56 -15.223   0.486  -8.209
  457   1HE   LYS  56          HE2       LYS  56 -15.050  -0.769 -10.373
  458   2HE   LYS  56          HE1       LYS  56 -14.879  -2.270  -9.441
  459   1HZ   LYS  56          HZ1       LYS  56 -17.112  -0.342  -9.102
  460   2HZ   LYS  56          HZ2       LYS  56 -16.958  -1.864  -8.365
  461   3HZ   LYS  56          HZ3       LYS  56 -17.214  -1.751 -10.041
  462    H    TRP  57           HN       TRP  57 -10.926  -3.566  -6.563
  463    HA   TRP  57           HA       TRP  57 -11.742  -2.664  -3.999
  464   1HB   TRP  57          HB2       TRP  57 -11.502  -4.887  -3.570
  465   2HB   TRP  57          HB1       TRP  57 -11.064  -5.036  -5.265
  466    HD1  TRP  57           HD1      TRP  57  -8.697  -5.873  -5.795
  467    HE1  TRP  57           HE1      TRP  57  -6.599  -6.408  -4.394
  468    HE3  TRP  57           HE3      TRP  57 -10.173  -4.044  -1.262
  469    HZ2  TRP  57           HZ2      TRP  57  -5.672  -6.100  -1.704
  470    HZ3  TRP  57           HZ3      TRP  57  -8.666  -4.176   0.699
  471    HH2  TRP  57           HH2      TRP  57  -6.419  -5.201   0.485
  472    H    VAL  58           HN       VAL  58  -8.509  -2.775  -5.482
  473    HA   VAL  58           HA       VAL  58  -7.042  -2.003  -3.121
  474    HB   VAL  58           HB       VAL  58  -6.434  -1.564  -6.060
  475   1HG1  VAL  58          HG1       VAL  58  -5.013  -0.450  -4.199
  476   2HG1  VAL  58          HG1       VAL  58  -4.165  -1.387  -5.430
  477   3HG1  VAL  58          HG1       VAL  58  -4.463  -2.087  -3.839
  478   1HG2  VAL  58          HG2       VAL  58  -6.298  -3.975  -4.273
  479   2HG2  VAL  58          HG2       VAL  58  -5.101  -3.787  -5.555
  480   3HG2  VAL  58          HG2       VAL  58  -6.817  -3.867  -5.955
  481    H    GLN  59           HN       GLN  59  -8.169  -0.120  -5.961
  482    HA   GLN  59           HA       GLN  59  -7.331   2.443  -5.045
  483   1HB   GLN  59          HB2       GLN  59  -9.706   1.587  -6.740
  484   2HB   GLN  59          HB1       GLN  59  -9.040   3.220  -6.683
  485   1HG   GLN  59          HG2       GLN  59  -7.167   0.968  -7.281
  486   2HG   GLN  59          HG1       GLN  59  -8.273   1.484  -8.556
  487   1HE2  GLN  59          HE2       GLN  59  -8.394   4.207  -8.328
  488   2HE2  GLN  59          HE2       GLN  59  -6.853   4.906  -8.464
  489    H    LYS  60           HN       LYS  60 -10.037   0.395  -4.199
  490    HA   LYS  60           HA       LYS  60 -11.656   2.426  -2.933
  491   1HB   LYS  60          HB2       LYS  60 -12.321   0.123  -3.809
  492   2HB   LYS  60          HB1       LYS  60 -11.549  -0.550  -2.374
  493   1HG   LYS  60          HG2       LYS  60 -13.179   0.234  -0.958
  494   2HG   LYS  60          HG1       LYS  60 -13.487   1.668  -1.938
  495   1HD   LYS  60          HD2       LYS  60 -14.548   0.163  -3.663
  496   2HD   LYS  60          HD1       LYS  60 -14.403  -1.163  -2.508
  497   1HE   LYS  60          HE2       LYS  60 -16.164  -0.415  -1.268
  498   2HE   LYS  60          HE1       LYS  60 -15.631   1.274  -1.378
  499   1HZ   LYS  60          HZ1       LYS  60 -16.787  -0.232  -3.659
  500   2HZ   LYS  60          HZ2       LYS  60 -16.457   1.433  -3.584
  501   3HZ   LYS  60          HZ3       LYS  60 -17.708   0.768  -2.646
  502    H    TYR  61           HN       TYR  61  -9.061   0.256  -1.869
  503    HA   TYR  61           HA       TYR  61  -9.366   1.028   0.954
  504   1HB   TYR  61          HB2       TYR  61  -7.845  -0.895  -0.703
  505   2HB   TYR  61          HB1       TYR  61  -7.000  -0.324   0.736
  506    HD1  TYR  61           HD1      TYR  61  -7.601  -1.097   2.902
  507    HD2  TYR  61           HD2      TYR  61 -10.194  -1.848  -0.441
  508    HE1  TYR  61           HE1      TYR  61  -8.988  -2.595   4.311
  509    HE2  TYR  61           HE2      TYR  61 -11.578  -3.346   0.968
  510    HH   TYR  61           HH       TYR  61 -10.612  -4.666   3.746
  511    H    ILE  62           HN       ILE  62  -7.207   1.736  -1.766
  512    HA   ILE  62           HA       ILE  62  -5.212   3.203  -0.355
  513    HB   ILE  62           HB       ILE  62  -6.374   3.493  -3.148
  514   1HG1  ILE  62          HG1       ILE  62  -3.823   2.115  -2.278
  515   2HG1  ILE  62          HG1       ILE  62  -5.362   1.262  -2.402
  516   1HG2  ILE  62          HG2       ILE  62  -3.589   4.219  -2.878
  517   2HG2  ILE  62          HG2       ILE  62  -4.575   5.193  -1.787
  518   3HG2  ILE  62          HG2       ILE  62  -4.925   5.178  -3.516
  519   1HD1  ILE  62          HD1       ILE  62  -3.813   1.218  -4.469
  520   2HD1  ILE  62          HD1       ILE  62  -4.291   2.901  -4.697
  521   3HD1  ILE  62          HD1       ILE  62  -5.509   1.625  -4.734
  522    H    SER  63           HN       SER  63  -8.373   4.165  -1.666
  523    HA   SER  63           HA       SER  63  -8.057   6.982  -0.975
  524   1HB   SER  63          HB2       SER  63 -10.094   5.144  -2.117
  525   2HB   SER  63          HB1       SER  63 -10.728   6.576  -1.310
  526    HG   SER  63           HG       SER  63  -8.632   6.664  -3.217
  527    H    LEU  64           HN       LEU  64  -9.759   4.178   0.435
  528    HA   LEU  64           HA       LEU  64 -10.930   5.602   2.643
  529   1HB   LEU  64          HB2       LEU  64 -10.225   2.724   2.041
  530   2HB   LEU  64          HB1       LEU  64 -11.016   3.185   3.549
  531    HG   LEU  64           HG       LEU  64 -12.106   4.020   0.857
  532   1HD1  LEU  64          HD1       LEU  64 -13.420   2.081   0.727
  533   2HD1  LEU  64          HD1       LEU  64 -13.169   1.682   2.427
  534   3HD1  LEU  64          HD1       LEU  64 -11.863   1.450   1.264
  535   1HD2  LEU  64          HD2       LEU  64 -14.111   4.467   2.084
  536   2HD2  LEU  64          HD2       LEU  64 -12.798   5.144   3.049
  537   3HD2  LEU  64          HD2       LEU  64 -13.519   3.598   3.501
  538    H    LEU  65           HN       LEU  65  -7.813   3.948   2.195
  539    HA   LEU  65           HA       LEU  65  -7.011   4.292   4.991
  540   1HB   LEU  65          HB2       LEU  65  -5.816   3.282   2.425
  541   2HB   LEU  65          HB1       LEU  65  -4.742   3.638   3.773
  542    HG   LEU  65           HG       LEU  65  -7.096   1.723   3.810
  543   1HD1  LEU  65          HD1       LEU  65  -4.812   0.383   4.607
  544   2HD1  LEU  65          HD1       LEU  65  -4.203   1.456   3.347
  545   3HD1  LEU  65          HD1       LEU  65  -5.506   0.324   2.986
  546   1HD2  LEU  65          HD2       LEU  65  -5.670   1.293   6.110
  547   2HD2  LEU  65          HD2       LEU  65  -7.125   2.284   6.021
  548   3HD2  LEU  65          HD2       LEU  65  -5.536   3.042   5.945
  549    H    LYS  66           HN       LYS  66  -7.739   6.807   4.229
  550    HA   LYS  66           HA       LYS  66  -5.842   8.439   2.898
  551   1HB   LYS  66          HB2       LYS  66  -8.190   8.990   3.649
  552   2HB   LYS  66          HB1       LYS  66  -7.566   9.150   5.291
  553   1HG   LYS  66          HG2       LYS  66  -5.801  10.729   4.008
  554   2HG   LYS  66          HG1       LYS  66  -7.190  10.935   2.941
  555   1HD   LYS  66          HD2       LYS  66  -7.367  12.641   4.619
  556   2HD   LYS  66          HD1       LYS  66  -8.571  11.416   5.022
  557   1HE   LYS  66          HE2       LYS  66  -7.364  10.638   6.863
  558   2HE   LYS  66          HE1       LYS  66  -5.813  11.200   6.206
  559   1HZ   LYS  66          HZ1       LYS  66  -6.376  12.782   7.820
  560   2HZ   LYS  66          HZ2       LYS  66  -8.009  12.819   7.354
  561   3HZ   LYS  66          HZ3       LYS  66  -6.822  13.507   6.353
  562    H    THR  67           HN       THR  67  -3.887   9.295   3.535
  563    HA   THR  67           HA       THR  67  -3.111   9.636   6.301
  564    HB   THR  67           HB       THR  67  -2.367   7.153   4.780
  565    HG1  THR  67           HG1      THR  67  -2.871   6.241   6.693
  566   1HG2  THR  67          HG2       THR  67  -0.502   8.788   6.397
  567   2HG2  THR  67          HG2       THR  67  -0.153   7.544   5.197
  568   3HG2  THR  67          HG2       THR  67  -0.582   7.084   6.845
  569    HA   PRO  68           HA       PRO  68   0.621  10.756   3.542
  570   1HB   PRO  68          HB2       PRO  68   0.584  10.034   0.902
  571   2HB   PRO  68          HB1       PRO  68   1.250   8.994   2.177
  572   1HG   PRO  68          HG2       PRO  68  -1.409   8.875   0.838
  573   2HG   PRO  68          HG1       PRO  68  -0.321   7.557   1.306
  574   1HD   PRO  68          HD2       PRO  68  -2.512   8.231   2.749
  575   2HD   PRO  68          HD1       PRO  68  -1.042   7.552   3.479
  576    H    LYS  69           HN       LYS  69  -0.855  12.684   3.925
  577    HA   LYS  69           HA       LYS  69  -2.069  13.708   1.398
  578   1HB   LYS  69          HB2       LYS  69  -3.368  15.155   2.967
  579   2HB   LYS  69          HB1       LYS  69  -3.597  13.438   3.293
  580   1HG   LYS  69          HG2       LYS  69  -2.096  13.500   5.162
  581   2HG   LYS  69          HG1       LYS  69  -1.537  15.119   4.739
  582   1HD   LYS  69          HD2       LYS  69  -4.338  15.322   4.954
  583   2HD   LYS  69          HD1       LYS  69  -3.825  14.347   6.332
  584   1HE   LYS  69          HE2       LYS  69  -1.907  16.363   6.238
  585   2HE   LYS  69          HE1       LYS  69  -3.422  17.204   5.851
  586   1HZ   LYS  69          HZ1       LYS  69  -3.156  17.029   8.241
  587   2HZ   LYS  69          HZ2       LYS  69  -2.989  15.342   8.128
  588   3HZ   LYS  69          HZ3       LYS  69  -4.467  16.080   7.733
  589    H    GLN  70           HN       GLN  70   0.592  14.004   1.298
  590    HA   GLN  70           HA       GLN  70   0.975  16.917   1.621
  591   1HB   GLN  70          HB2       GLN  70   1.922  14.939   3.490
  592   2HB   GLN  70          HB1       GLN  70   3.306  15.696   2.700
  593   1HG   GLN  70          HG2       GLN  70   3.016  17.327   4.259
  594   2HG   GLN  70          HG1       GLN  70   1.726  17.873   3.188
  595   1HE2  GLN  70          HE2       GLN  70   0.704  18.698   5.274
  596   2HE2  GLN  70          HE2       GLN  70  -0.192  17.608   6.217
  597    H    LEU  71           HN       LEU  71   0.945  16.418  -0.803
  598    HA   LEU  71           HA       LEU  71   3.723  15.780  -1.706
  599   1HB   LEU  71          HB2       LEU  71   1.303  14.240  -2.058
  600   2HB   LEU  71          HB1       LEU  71   1.902  14.777  -3.629
  601    HG   LEU  71           HG       LEU  71   3.575  13.377  -1.523
  602   1HD1  LEU  71          HD1       LEU  71   3.090  11.387  -2.516
  603   2HD1  LEU  71          HD1       LEU  71   3.076  12.092  -4.133
  604   3HD1  LEU  71          HD1       LEU  71   1.653  12.227  -3.101
  605   1HD2  LEU  71          HD2       LEU  71   4.513  15.069  -3.375
  606   2HD2  LEU  71          HD2       LEU  71   4.357  13.640  -4.395
  607   3HD2  LEU  71          HD2       LEU  71   5.376  13.589  -2.956
  Start of MODEL   14
    1   1H    THR   1          HT1       THR   1   5.440  -9.528  14.544
    2   2H    THR   1          HT2       THR   1   6.239  -8.946  13.162
    3   3H    THR   1          HT3       THR   1   5.587  -7.857  14.292
    4    HA   THR   1           HA       THR   1   7.171  -8.850  15.980
    5    HB   THR   1           HB       THR   1   8.271  -9.938  13.367
    6    HG1  THR   1           HG1      THR   1   7.637 -11.891  14.141
    7   1HG2  THR   1          HG2       THR   1  10.013 -10.933  14.714
    8   2HG2  THR   1          HG2       THR   1   9.252 -10.366  16.200
    9   3HG2  THR   1          HG2       THR   1   9.967  -9.208  15.078
   10    H    ARG   2           HN       ARG   2   9.113  -7.584  16.326
   11    HA   ARG   2           HA       ARG   2   9.161  -5.029  15.010
   12   1HB   ARG   2          HB2       ARG   2  11.042  -6.527  16.852
   13   2HB   ARG   2          HB1       ARG   2  11.326  -4.857  16.360
   14   1HG   ARG   2          HG2       ARG   2   9.356  -4.088  17.428
   15   2HG   ARG   2          HG1       ARG   2   8.700  -5.718  17.572
   16   1HD   ARG   2          HD2       ARG   2  11.048  -5.997  18.947
   17   2HD   ARG   2          HD1       ARG   2  10.627  -4.315  19.323
   18    HE   ARG   2           HE       ARG   2   8.402  -6.237  19.508
   19   1HH1  ARG   2          HH2       ARG   2  10.677  -6.773  21.523
   20   2HH1  ARG   2          HH2       ARG   2  10.095  -5.892  22.896
   21   1HH2  ARG   2          HH1       ARG   2   7.741  -4.105  21.084
   22   2HH2  ARG   2          HH1       ARG   2   8.433  -4.382  22.647
   23    H    GLY   3           HN       GLY   3   9.420  -5.585  12.716
   24   1HA   GLY   3          HA2       GLY   3  11.829  -6.998  11.851
   25   2HA   GLY   3          HA1       GLY   3  10.654  -6.213  10.794
   26    H    SER   4           HN       SER   4  11.304  -4.344   9.846
   27    HA   SER   4           HA       SER   4  13.007  -2.405  11.213
   28   1HB   SER   4          HB2       SER   4  14.934  -2.724   9.691
   29   2HB   SER   4          HB1       SER   4  14.605  -4.193  10.606
   30    HG   SER   4           HG       SER   4  13.414  -4.930   8.772
   31    H    ASP   5           HN       ASP   5  13.625  -0.610   9.582
   32    HA   ASP   5           HA       ASP   5  11.298   0.289   8.180
   33   1HB   ASP   5          HB2       ASP   5  12.913   2.023   7.350
   34   2HB   ASP   5          HB1       ASP   5  13.019   1.765   9.092
   35    H    ILE   6           HN       ILE   6  10.613  -1.183   6.571
   36    HA   ILE   6           HA       ILE   6  12.493  -1.535   4.256
   37    HB   ILE   6           HB       ILE   6  10.531  -3.479   5.510
   38   1HG1  ILE   6          HG1       ILE   6  12.654  -3.220   6.743
   39   2HG1  ILE   6          HG1       ILE   6  12.571  -4.802   5.968
   40   1HG2  ILE   6          HG2       ILE   6  10.415  -4.335   3.416
   41   2HG2  ILE   6          HG2       ILE   6  12.068  -4.882   3.695
   42   3HG2  ILE   6          HG2       ILE   6  11.772  -3.362   2.851
   43   1HD1  ILE   6          HD1       ILE   6  13.791  -3.613   3.982
   44   2HD1  ILE   6          HD1       ILE   6  14.727  -4.085   5.399
   45   3HD1  ILE   6          HD1       ILE   6  14.222  -2.409   5.196
   46    H    SER   7           HN       SER   7  10.900   0.608   4.047
   47    HA   SER   7           HA       SER   7   8.335  -0.201   2.794
   48   1HB   SER   7          HB2       SER   7   7.700   2.036   3.192
   49   2HB   SER   7          HB1       SER   7   8.738   1.657   4.564
   50    HG   SER   7           HG       SER   7  10.153   3.044   3.850
   51    H    LYS   8           HN       LYS   8  11.533   0.852   1.933
   52    HA   LYS   8           HA       LYS   8  10.750   1.858  -0.716
   53   1HB   LYS   8          HB2       LYS   8  12.847   2.229   1.050
   54   2HB   LYS   8          HB1       LYS   8  13.571   1.215  -0.199
   55   1HG   LYS   8          HG2       LYS   8  12.504   2.842  -1.889
   56   2HG   LYS   8          HG1       LYS   8  12.266   3.919  -0.513
   57   1HD   LYS   8          HD2       LYS   8  14.422   4.556  -0.581
   58   2HD   LYS   8          HD1       LYS   8  14.954   2.877  -0.469
   59   1HE   LYS   8          HE2       LYS   8  15.767   3.953  -2.565
   60   2HE   LYS   8          HE1       LYS   8  14.646   2.624  -2.922
   61   1HZ   LYS   8          HZ1       LYS   8  14.225   4.901  -4.018
   62   2HZ   LYS   8          HZ2       LYS   8  13.637   5.364  -2.493
   63   3HZ   LYS   8          HZ3       LYS   8  12.910   4.079  -3.333
   64    H    THR   9           HN       THR   9   9.775  -0.720  -0.529
   65    HA   THR   9           HA       THR   9  11.727  -2.342  -2.131
   66    HB   THR   9           HB       THR   9  11.176  -3.187   0.146
   67    HG1  THR   9           HG1      THR   9  10.340  -5.252  -0.624
   68   1HG2  THR   9          HG2       THR   9   8.520  -2.439  -0.704
   69   2HG2  THR   9          HG2       THR   9   9.083  -2.885   0.905
   70   3HG2  THR   9          HG2       THR   9   8.548  -4.134  -0.219
   71    H    CYS  10           HN       CYS  10  10.693  -3.730  -3.799
   72    HA   CYS  10           HA       CYS  10   8.548  -2.312  -5.211
   73   1HB   CYS  10          HB2       CYS  10  10.052  -4.891  -5.764
   74   2HB   CYS  10          HB1       CYS  10   9.057  -4.018  -6.928
   75    H    CYS  11           HN       CYS  11   6.969  -4.163  -6.329
   76    HA   CYS  11           HA       CYS  11   5.824  -5.765  -4.066
   77   1HB   CYS  11          HB2       CYS  11   4.586  -3.802  -5.987
   78   2HB   CYS  11          HB1       CYS  11   3.600  -5.061  -5.241
   79    H    PHE  12           HN       PHE  12   6.292  -7.841  -4.772
   80    HA   PHE  12           HA       PHE  12   5.613  -8.537  -7.596
   81   1HB   PHE  12          HB2       PHE  12   7.230 -10.406  -7.204
   82   2HB   PHE  12          HB1       PHE  12   7.965  -8.819  -6.980
   83    HD1  PHE  12           HD1      PHE  12   6.611 -11.795  -5.237
   84    HD2  PHE  12           HD2      PHE  12   8.699  -8.064  -4.809
   85    HE1  PHE  12           HE1      PHE  12   7.230 -12.407  -2.915
   86    HE2  PHE  12           HE2      PHE  12   9.317  -8.677  -2.488
   87    HZ   PHE  12           HZ       PHE  12   8.584 -10.848  -1.540
   88    H    GLN  13           HN       GLN  13   3.757  -8.410  -5.230
   89    HA   GLN  13           HA       GLN  13   2.553 -11.073  -5.583
   90   1HB   GLN  13          HB2       GLN  13   4.371 -10.927  -3.656
   91   2HB   GLN  13          HB1       GLN  13   3.050 -10.167  -2.765
   92   1HG   GLN  13          HG2       GLN  13   1.665 -12.225  -3.671
   93   2HG   GLN  13          HG1       GLN  13   3.259 -12.967  -3.819
   94   1HE2  GLN  13          HE2       GLN  13   1.021 -11.481  -1.462
   95   2HE2  GLN  13          HE2       GLN  13   1.736 -12.188  -0.095
   96    H    TYR  14           HN       TYR  14   0.305 -10.983  -5.210
   97    HA   TYR  14           HA       TYR  14  -0.782  -8.445  -4.080
   98   1HB   TYR  14          HB2       TYR  14  -1.596  -9.873  -6.631
   99   2HB   TYR  14          HB1       TYR  14  -2.395  -8.444  -5.975
  100    HD1  TYR  14           HD1      TYR  14  -0.407  -9.242  -8.548
  101    HD2  TYR  14           HD2      TYR  14  -0.252  -6.749  -5.055
  102    HE1  TYR  14           HE1      TYR  14   1.267  -7.789  -9.660
  103    HE2  TYR  14           HE2      TYR  14   1.422  -5.296  -6.166
  104    HH   TYR  14           HH       TYR  14   1.942  -4.827  -8.864
  105    H    SER  15           HN       SER  15  -2.098  -8.998  -2.393
  106    HA   SER  15           HA       SER  15  -3.095 -11.711  -2.024
  107   1HB   SER  15          HB2       SER  15  -4.298 -10.407  -0.097
  108   2HB   SER  15          HB1       SER  15  -2.541 -10.528  -0.069
  109    HG   SER  15           HG       SER  15  -3.674  -8.358   0.162
  110    H    HIS  16           HN       HIS  16  -5.629 -11.634  -1.223
  111    HA   HIS  16           HA       HIS  16  -7.286 -10.100  -3.151
  112   1HB   HIS  16          HB2       HIS  16  -6.462 -12.880  -3.412
  113   2HB   HIS  16          HB1       HIS  16  -8.219 -12.743  -3.337
  114    HD1  HIS  16           HD1      HIS  16  -6.671 -13.469  -5.984
  115    HD2  HIS  16           HD2      HIS  16  -7.994  -9.650  -4.965
  116    HE1  HIS  16           HE1      HIS  16  -6.888 -12.183  -8.155
  117    H    LYS  17           HN       LYS  17  -6.991 -10.226  -0.183
  118    HA   LYS  17           HA       LYS  17  -9.806 -10.978   0.467
  119   1HB   LYS  17          HB2       LYS  17  -7.256 -11.503   2.024
  120   2HB   LYS  17          HB1       LYS  17  -8.876 -11.790   2.660
  121   1HG   LYS  17          HG2       LYS  17  -9.325 -13.349   0.785
  122   2HG   LYS  17          HG1       LYS  17  -7.687 -13.084   0.187
  123   1HD   LYS  17          HD2       LYS  17  -7.196 -14.907   1.469
  124   2HD   LYS  17          HD1       LYS  17  -7.169 -13.729   2.782
  125   1HE   LYS  17          HE2       LYS  17  -9.070 -14.571   3.716
  126   2HE   LYS  17          HE1       LYS  17  -9.874 -14.720   2.141
  127   1HZ   LYS  17          HZ1       LYS  17  -7.923 -16.565   3.383
  128   2HZ   LYS  17          HZ2       LYS  17  -8.215 -16.577   1.709
  129   3HZ   LYS  17          HZ3       LYS  17  -9.476 -16.915   2.797
  130    HA   PRO  18           HA       PRO  18  -9.873  -6.894   2.140
  131   1HB   PRO  18          HB2       PRO  18 -12.013  -7.116   3.826
  132   2HB   PRO  18          HB1       PRO  18 -12.177  -7.022   2.062
  133   1HG   PRO  18          HG2       PRO  18 -12.330  -9.384   3.853
  134   2HG   PRO  18          HG1       PRO  18 -13.248  -9.015   2.386
  135   1HD   PRO  18          HD2       PRO  18 -11.136 -10.766   2.482
  136   2HD   PRO  18          HD1       PRO  18 -11.660  -9.911   1.015
  137    H    LEU  19           HN       LEU  19  -8.209  -6.406   3.522
  138    HA   LEU  19           HA       LEU  19  -7.540  -7.919   5.890
  139   1HB   LEU  19          HB2       LEU  19  -6.117  -6.399   4.361
  140   2HB   LEU  19          HB1       LEU  19  -6.815  -5.048   5.255
  141    HG   LEU  19           HG       LEU  19  -6.019  -6.173   7.381
  142   1HD1  LEU  19          HD1       LEU  19  -4.214  -7.862   7.102
  143   2HD1  LEU  19          HD1       LEU  19  -4.523  -7.878   5.366
  144   3HD1  LEU  19          HD1       LEU  19  -5.761  -8.444   6.487
  145   1HD2  LEU  19          HD2       LEU  19  -4.015  -5.038   7.255
  146   2HD2  LEU  19          HD2       LEU  19  -4.769  -4.406   5.792
  147   3HD2  LEU  19          HD2       LEU  19  -3.604  -5.726   5.684
  148    HA   PRO  20           HA       PRO  20 -10.506  -6.125   8.649
  149   1HB   PRO  20          HB2       PRO  20  -9.196  -6.563  11.025
  150   2HB   PRO  20          HB1       PRO  20 -10.045  -7.840  10.130
  151   1HG   PRO  20          HG2       PRO  20  -7.133  -7.186  10.180
  152   2HG   PRO  20          HG1       PRO  20  -7.933  -8.767  10.238
  153   1HD   PRO  20          HD2       PRO  20  -6.835  -7.812   7.975
  154   2HD   PRO  20          HD1       PRO  20  -8.306  -8.811   7.958
  155    H    TRP  21           HN       TRP  21 -10.608  -3.924   8.501
  156    HA   TRP  21           HA       TRP  21  -8.618  -2.006   8.447
  157   1HB   TRP  21          HB2       TRP  21 -11.396  -1.959   9.652
  158   2HB   TRP  21          HB1       TRP  21 -10.450  -0.500   9.344
  159    HD1  TRP  21           HD1      TRP  21 -12.380  -3.257   7.589
  160    HE1  TRP  21           HE1      TRP  21 -12.604  -2.675   5.088
  161    HE3  TRP  21           HE3      TRP  21  -9.281   0.795   7.345
  162    HZ2  TRP  21           HZ2      TRP  21 -11.599  -0.751   3.230
  163    HZ3  TRP  21           HZ3      TRP  21  -8.934   1.982   5.198
  164    HH2  TRP  21           HH2      TRP  21 -10.088   1.216   3.142
  165    H    THR  22           HN       THR  22  -9.790  -3.716  11.290
  166    HA   THR  22           HA       THR  22  -8.823  -1.979  13.331
  167    HB   THR  22           HB       THR  22  -8.643  -4.250  14.563
  168    HG1  THR  22           HG1      THR  22 -10.038  -5.286  12.374
  169   1HG2  THR  22          HG2       THR  22 -10.627  -3.021  14.893
  170   2HG2  THR  22          HG2       THR  22 -11.200  -4.582  14.303
  171   3HG2  THR  22          HG2       THR  22 -11.122  -3.199  13.210
  172    H    TRP  23           HN       TRP  23  -7.204  -4.422  11.343
  173    HA   TRP  23           HA       TRP  23  -4.614  -3.866  12.700
  174   1HB   TRP  23          HB2       TRP  23  -5.832  -6.044  11.055
  175   2HB   TRP  23          HB1       TRP  23  -4.083  -5.849  10.973
  176    HD1  TRP  23           HD1      TRP  23  -5.938  -5.055  14.204
  177    HE1  TRP  23           HE1      TRP  23  -5.273  -6.782  15.997
  178    HE3  TRP  23           HE3      TRP  23  -3.263  -8.326  11.331
  179    HZ2  TRP  23           HZ2      TRP  23  -3.803  -9.228  16.188
  180    HZ3  TRP  23           HZ3      TRP  23  -2.245 -10.345  12.345
  181    HH2  TRP  23           HH2      TRP  23  -2.511 -10.800  14.768
  182    H    VAL  24           HN       VAL  24  -6.295  -2.454  10.262
  183    HA   VAL  24           HA       VAL  24  -4.046  -2.297   8.339
  184    HB   VAL  24           HB       VAL  24  -6.858  -1.166   8.291
  185   1HG1  VAL  24          HG1       VAL  24  -6.444  -0.481   6.103
  186   2HG1  VAL  24          HG1       VAL  24  -5.148  -1.655   5.874
  187   3HG1  VAL  24          HG1       VAL  24  -4.862  -0.201   6.830
  188   1HG2  VAL  24          HG2       VAL  24  -7.371  -3.371   8.002
  189   2HG2  VAL  24          HG2       VAL  24  -5.695  -3.808   7.692
  190   3HG2  VAL  24          HG2       VAL  24  -6.689  -3.153   6.391
  191    H    ARG  25           HN       ARG  25  -2.898  -0.360   7.995
  192    HA   ARG  25           HA       ARG  25  -3.488   1.844   9.941
  193   1HB   ARG  25          HB2       ARG  25  -1.426   0.446  10.271
  194   2HB   ARG  25          HB1       ARG  25  -0.849   1.011   8.704
  195   1HG   ARG  25          HG2       ARG  25  -0.963   3.347   9.509
  196   2HG   ARG  25          HG1       ARG  25  -1.517   2.771  11.082
  197   1HD   ARG  25          HD2       ARG  25   0.573   2.030  11.693
  198   2HD   ARG  25          HD1       ARG  25   0.992   1.541  10.039
  199    HE   ARG  25           HE       ARG  25   1.537   3.849   9.531
  200   1HH1  ARG  25          HH2       ARG  25  -0.428   5.292  11.194
  201   2HH1  ARG  25          HH2       ARG  25   0.542   5.919  12.485
  202   1HH2  ARG  25          HH1       ARG  25   3.204   3.783  11.877
  203   2HH2  ARG  25          HH1       ARG  25   2.598   5.065  12.873
  204    H    SER  26           HN       SER  26  -1.792   1.346   6.796
  205    HA   SER  26           HA       SER  26  -3.304   3.565   5.591
  206   1HB   SER  26          HB2       SER  26  -1.103   4.838   5.229
  207   2HB   SER  26          HB1       SER  26  -1.750   4.849   6.867
  208    HG   SER  26           HG       SER  26   0.107   2.919   5.943
  209    H    TYR  27           HN       TYR  27  -1.623   4.177   3.477
  210    HA   TYR  27           HA       TYR  27  -0.805   1.575   2.281
  211   1HB   TYR  27          HB2       TYR  27  -2.593   1.547   0.888
  212   2HB   TYR  27          HB1       TYR  27  -3.275   2.839   1.863
  213    HD1  TYR  27           HD1      TYR  27  -2.115   1.906  -1.383
  214    HD2  TYR  27           HD2      TYR  27  -2.582   5.271   1.244
  215    HE1  TYR  27           HE1      TYR  27  -1.979   3.442  -3.326
  216    HE2  TYR  27           HE2      TYR  27  -2.447   6.807  -0.699
  217    HH   TYR  27           HH       TYR  27  -1.395   6.677  -3.074
  218    H    GLU  28           HN       GLU  28  -0.025   2.281  -0.160
  219    HA   GLU  28           HA       GLU  28   1.211   4.853  -0.496
  220   1HB   GLU  28          HB2       GLU  28   3.539   4.180   0.016
  221   2HB   GLU  28          HB1       GLU  28   2.517   4.032   1.445
  222   1HG   GLU  28          HG2       GLU  28   2.289   1.638   1.098
  223   2HG   GLU  28          HG1       GLU  28   3.164   1.741  -0.431
  224    H    PHE  29           HN       PHE  29   2.500   4.899  -2.497
  225    HA   PHE  29           HA       PHE  29   1.854   2.603  -4.284
  226   1HB   PHE  29          HB2       PHE  29   1.864   5.445  -4.469
  227   2HB   PHE  29          HB1       PHE  29   3.089   4.848  -5.590
  228    HD1  PHE  29           HD1      PHE  29   2.270   2.554  -6.843
  229    HD2  PHE  29           HD2      PHE  29  -0.271   5.683  -5.360
  230    HE1  PHE  29           HE1      PHE  29   0.490   1.858  -8.424
  231    HE2  PHE  29           HE2      PHE  29  -2.050   4.988  -6.940
  232    HZ   PHE  29           HZ       PHE  29  -1.670   3.075  -8.472
  233    H    THR  30           HN       THR  30   3.481   1.461  -5.374
  234    HA   THR  30           HA       THR  30   5.997   1.047  -4.204
  235    HB   THR  30           HB       THR  30   6.501   0.244  -6.651
  236    HG1  THR  30           HG1      THR  30   5.023   1.402  -7.768
  237   1HG2  THR  30          HG2       THR  30   5.836  -1.263  -4.848
  238   2HG2  THR  30          HG2       THR  30   4.962  -1.684  -6.321
  239   3HG2  THR  30          HG2       THR  30   4.149  -0.784  -5.041
  240    H    SER  31           HN       SER  31   8.150   1.485  -5.487
  241    HA   SER  31           HA       SER  31   8.393   4.403  -5.801
  242   1HB   SER  31          HB2       SER  31  10.031   2.106  -5.110
  243   2HB   SER  31          HB1       SER  31  10.841   3.119  -6.302
  244    HG   SER  31           HG       SER  31  10.457   4.899  -4.919
  245    H    ASN  32           HN       ASN  32  10.022   5.034  -7.683
  246    HA   ASN  32           HA       ASN  32   8.785   4.091 -10.200
  247   1HB   ASN  32          HB2       ASN  32  10.004   6.034 -11.122
  248   2HB   ASN  32          HB1       ASN  32   9.098   6.495  -9.679
  249   1HD2  ASN  32          HD2       ASN  32  12.369   5.834 -10.910
  250   2HD2  ASN  32          HD2       ASN  32  13.188   6.541  -9.602
  251    H    SER  33           HN       SER  33  11.733   3.665  -8.396
  252    HA   SER  33           HA       SER  33  13.259   2.696 -10.726
  253   1HB   SER  33          HB2       SER  33  13.854   3.938  -8.342
  254   2HB   SER  33          HB1       SER  33  14.290   2.267  -8.001
  255    HG   SER  33           HG       SER  33  15.736   2.304  -9.630
  256    H    CYS  34           HN       CYS  34  10.762   1.283  -9.501
  257    HA   CYS  34           HA       CYS  34  11.967  -1.295  -8.652
  258   1HB   CYS  34          HB2       CYS  34   9.377   0.133  -8.473
  259   2HB   CYS  34          HB1       CYS  34   9.256  -1.619  -8.643
  260    H    SER  35           HN       SER  35  10.509  -3.233  -9.636
  261    HA   SER  35           HA       SER  35  11.059  -3.242 -12.512
  262   1HB   SER  35          HB2       SER  35  10.584  -5.564 -12.296
  263   2HB   SER  35          HB1       SER  35  11.309  -5.116 -10.754
  264    HG   SER  35           HG       SER  35   9.352  -5.174  -9.809
  265    H    GLN  36           HN       GLN  36   8.141  -3.301 -10.447
  266    HA   GLN  36           HA       GLN  36   6.561  -2.343 -12.789
  267   1HB   GLN  36          HB2       GLN  36   6.503  -4.867 -12.550
  268   2HB   GLN  36          HB1       GLN  36   5.715  -4.629 -10.988
  269   1HG   GLN  36          HG2       GLN  36   3.766  -4.578 -12.131
  270   2HG   GLN  36          HG1       GLN  36   4.267  -2.986 -12.699
  271   1HE2  GLN  36          HE2       GLN  36   3.493  -6.159 -13.731
  272   2HE2  GLN  36          HE2       GLN  36   4.066  -6.030 -15.324
  273    H    ARG  37           HN       ARG  37   4.902  -0.937 -12.188
  274    HA   ARG  37           HA       ARG  37   4.964   0.193  -9.514
  275   1HB   ARG  37          HB2       ARG  37   3.241   0.545 -11.980
  276   2HB   ARG  37          HB1       ARG  37   3.023   1.516 -10.524
  277   1HG   ARG  37          HG2       ARG  37   4.638   2.887 -11.287
  278   2HG   ARG  37          HG1       ARG  37   5.787   1.570 -11.042
  279   1HD   ARG  37          HD2       ARG  37   6.126   1.661 -13.292
  280   2HD   ARG  37          HD1       ARG  37   4.526   0.908 -13.446
  281    HE   ARG  37           HE       ARG  37   3.743   3.439 -13.192
  282   1HH1  ARG  37          HH1       ARG  37   4.671   2.033 -15.875
  283   2HH1  ARG  37          HH1       ARG  37   5.513   3.361 -16.600
  284   1HH2  ARG  37          HH2       ARG  37   5.611   5.236 -13.686
  285   2HH2  ARG  37          HH2       ARG  37   6.045   5.174 -15.362
  286    H    ALA  38           HN       ALA  38   3.241   0.127  -7.958
  287    HA   ALA  38           HA       ALA  38   0.841  -1.464  -8.362
  288   1HB   ALA  38          HB1       ALA  38   2.717  -2.676  -6.374
  289   2HB   ALA  38          HB2       ALA  38   3.038  -2.971  -8.084
  290   3HB   ALA  38          HB3       ALA  38   1.496  -3.457  -7.380
  291    H    VAL  39           HN       VAL  39  -0.432  -1.588  -6.307
  292    HA   VAL  39           HA       VAL  39   0.135   0.766  -4.582
  293    HB   VAL  39           HB       VAL  39  -2.258  -1.068  -4.945
  294   1HG1  VAL  39          HG1       VAL  39  -2.149  -0.108  -2.665
  295   2HG1  VAL  39          HG1       VAL  39  -3.478   0.588  -3.592
  296   3HG1  VAL  39          HG1       VAL  39  -1.989   1.504  -3.359
  297   1HG2  VAL  39          HG2       VAL  39  -3.210   0.713  -6.222
  298   2HG2  VAL  39          HG2       VAL  39  -1.563   0.529  -6.826
  299   3HG2  VAL  39          HG2       VAL  39  -1.954   1.842  -5.715
  300    H    ILE  40           HN       ILE  40  -0.093   0.496  -2.197
  301    HA   ILE  40           HA       ILE  40   0.380  -2.296  -1.244
  302    HB   ILE  40           HB       ILE  40   2.026   0.210  -0.828
  303   1HG1  ILE  40          HG1       ILE  40   3.013  -2.544  -1.530
  304   2HG1  ILE  40          HG1       ILE  40   2.338  -1.499  -2.779
  305   1HG2  ILE  40          HG2       ILE  40   2.111  -2.394   0.716
  306   2HG2  ILE  40          HG2       ILE  40   1.785  -0.788   1.368
  307   3HG2  ILE  40          HG2       ILE  40   3.391  -1.181   0.753
  308   1HD1  ILE  40          HD1       ILE  40   4.157  -0.152  -2.792
  309   2HD1  ILE  40          HD1       ILE  40   4.964  -1.458  -1.924
  310   3HD1  ILE  40          HD1       ILE  40   4.245  -0.119  -1.031
  311    H    PHE  41           HN       PHE  41  -0.237  -2.627   0.959
  312    HA   PHE  41           HA       PHE  41  -1.722  -0.384   2.283
  313   1HB   PHE  41          HB2       PHE  41  -2.542  -3.287   1.909
  314   2HB   PHE  41          HB1       PHE  41  -3.434  -2.114   2.879
  315    HD1  PHE  41           HD1      PHE  41  -3.288  -3.622  -0.261
  316    HD2  PHE  41           HD2      PHE  41  -3.847   0.225   1.562
  317    HE1  PHE  41           HE1      PHE  41  -4.443  -2.822  -2.304
  318    HE2  PHE  41           HE2      PHE  41  -5.000   1.027  -0.483
  319    HZ   PHE  41           HZ       PHE  41  -5.297  -0.498  -2.416
  320    H    THR  42           HN       THR  42  -0.701  -0.067   4.250
  321    HA   THR  42           HA       THR  42   0.836  -2.317   5.411
  322    HB   THR  42           HB       THR  42   0.768   0.415   6.609
  323    HG1  THR  42           HG1      THR  42   2.170   1.126   4.939
  324   1HG2  THR  42          HG2       THR  42   2.684  -1.832   6.197
  325   2HG2  THR  42          HG2       THR  42   2.400  -0.847   7.632
  326   3HG2  THR  42          HG2       THR  42   3.349  -0.202   6.292
  327    H    THR  43           HN       THR  43   0.469  -3.146   7.463
  328    HA   THR  43           HA       THR  43  -2.244  -2.787   8.549
  329    HB   THR  43           HB       THR  43  -1.605  -4.746   9.882
  330    HG1  THR  43           HG1      THR  43   0.422  -5.244  10.183
  331   1HG2  THR  43          HG2       THR  43  -1.997  -4.751   7.239
  332   2HG2  THR  43          HG2       THR  43  -1.589  -6.226   8.116
  333   3HG2  THR  43          HG2       THR  43  -0.335  -5.341   7.249
  334    H    LYS  44           HN       LYS  44  -2.011  -3.109  11.203
  335    HA   LYS  44           HA       LYS  44  -0.840  -0.553  12.104
  336   1HB   LYS  44          HB2       LYS  44  -2.541  -2.701  13.405
  337   2HB   LYS  44          HB1       LYS  44  -2.091  -1.188  14.191
  338   1HG   LYS  44          HG2       LYS  44  -3.275  -0.934  11.481
  339   2HG   LYS  44          HG1       LYS  44  -4.368  -1.485  12.752
  340   1HD   LYS  44          HD2       LYS  44  -2.859   0.623  13.880
  341   2HD   LYS  44          HD1       LYS  44  -3.350   1.174  12.277
  342   1HE   LYS  44          HE2       LYS  44  -5.616   1.086  12.793
  343   2HE   LYS  44          HE1       LYS  44  -5.394  -0.188  14.009
  344   1HZ   LYS  44          HZ1       LYS  44  -4.007   1.531  15.239
  345   2HZ   LYS  44          HZ2       LYS  44  -5.690   1.755  15.252
  346   3HZ   LYS  44          HZ3       LYS  44  -4.715   2.686  14.218
  347    H    ARG  45           HN       ARG  45  -0.136  -3.970  12.255
  348    HA   ARG  45           HA       ARG  45   1.655  -3.774  14.571
  349   1HB   ARG  45          HB2       ARG  45   0.276  -5.776  13.835
  350   2HB   ARG  45          HB1       ARG  45   1.396  -5.959  12.485
  351   1HG   ARG  45          HG2       ARG  45   2.911  -6.971  13.806
  352   2HG   ARG  45          HG1       ARG  45   2.862  -5.634  14.957
  353   1HD   ARG  45          HD2       ARG  45   0.449  -6.899  15.434
  354   2HD   ARG  45          HD1       ARG  45   1.547  -8.256  15.109
  355    HE   ARG  45           HE       ARG  45   3.022  -6.563  16.747
  356   1HH1  ARG  45          HH2       ARG  45  -0.068  -6.280  17.537
  357   2HH1  ARG  45          HH2       ARG  45  -0.054  -7.251  18.971
  358   1HH2  ARG  45          HH1       ARG  45   3.070  -8.616  18.334
  359   2HH2  ARG  45          HH1       ARG  45   1.722  -8.573  19.423
  360    H    GLY  46           HN       GLY  46   1.923  -3.488  11.092
  361   1HA   GLY  46          HA2       GLY  46   3.975  -2.168  10.394
  362   2HA   GLY  46          HA1       GLY  46   4.895  -3.297  11.387
  363    H    LYS  47           HN       LYS  47   2.191  -4.357   9.404
  364    HA   LYS  47           HA       LYS  47   4.125  -5.905   7.743
  365   1HB   LYS  47          HB2       LYS  47   1.576  -6.411   9.070
  366   2HB   LYS  47          HB1       LYS  47   1.531  -6.884   7.370
  367   1HG   LYS  47          HG2       LYS  47   3.740  -8.086   7.774
  368   2HG   LYS  47          HG1       LYS  47   3.476  -7.811   9.496
  369   1HD   LYS  47          HD2       LYS  47   2.179  -9.647   9.547
  370   2HD   LYS  47          HD1       LYS  47   1.043  -8.832   8.471
  371   1HE   LYS  47          HE2       LYS  47   3.486 -10.361   7.507
  372   2HE   LYS  47          HE1       LYS  47   1.836 -11.017   7.532
  373   1HZ   LYS  47          HZ1       LYS  47   1.171  -8.955   6.291
  374   2HZ   LYS  47          HZ2       LYS  47   2.127 -10.046   5.408
  375   3HZ   LYS  47          HZ3       LYS  47   2.819  -8.637   6.058
  376    H    LYS  48           HN       LYS  48   4.462  -4.903   5.789
  377    HA   LYS  48           HA       LYS  48   2.302  -3.242   4.607
  378   1HB   LYS  48          HB2       LYS  48   4.757  -2.572   4.928
  379   2HB   LYS  48          HB1       LYS  48   5.118  -3.691   3.613
  380   1HG   LYS  48          HG2       LYS  48   4.378  -2.234   2.060
  381   2HG   LYS  48          HG1       LYS  48   2.881  -1.952   2.949
  382   1HD   LYS  48          HD2       LYS  48   4.084   0.144   2.832
  383   2HD   LYS  48          HD1       LYS  48   4.167  -0.439   4.494
  384   1HE   LYS  48          HE2       LYS  48   6.388  -1.630   3.387
  385   2HE   LYS  48          HE1       LYS  48   6.343  -0.071   2.539
  386   1HZ   LYS  48          HZ1       LYS  48   6.153   1.075   4.610
  387   2HZ   LYS  48          HZ2       LYS  48   7.482   0.025   4.729
  388   3HZ   LYS  48          HZ3       LYS  48   6.009  -0.377   5.475
  389    H    VAL  49           HN       VAL  49   0.864  -4.547   3.489
  390    HA   VAL  49           HA       VAL  49   1.921  -6.776   1.823
  391    HB   VAL  49           HB       VAL  49  -0.880  -5.857   2.557
  392   1HG1  VAL  49          HG1       VAL  49  -1.342  -8.311   1.795
  393   2HG1  VAL  49          HG1       VAL  49   0.179  -8.152   0.919
  394   3HG1  VAL  49          HG1       VAL  49  -1.163  -7.065   0.561
  395   1HG2  VAL  49          HG2       VAL  49  -0.273  -6.792   4.541
  396   2HG2  VAL  49          HG2       VAL  49   1.145  -7.571   3.840
  397   3HG2  VAL  49          HG2       VAL  49  -0.441  -8.327   3.691
  398    H    CYS  50           HN       CYS  50   2.043  -6.597  -0.392
  399    HA   CYS  50           HA       CYS  50   1.509  -4.010  -1.654
  400   1HB   CYS  50          HB2       CYS  50   2.584  -6.706  -2.477
  401   2HB   CYS  50          HB1       CYS  50   2.304  -5.441  -3.674
  402    H    THR  51           HN       THR  51   0.269  -3.963  -3.765
  403    HA   THR  51           HA       THR  51  -1.844  -5.969  -4.161
  404    HB   THR  51           HB       THR  51  -3.516  -3.915  -3.875
  405    HG1  THR  51           HG1      THR  51  -2.355  -2.281  -3.217
  406   1HG2  THR  51          HG2       THR  51  -3.168  -6.153  -2.523
  407   2HG2  THR  51          HG2       THR  51  -4.153  -4.856  -1.850
  408   3HG2  THR  51          HG2       THR  51  -2.488  -5.071  -1.308
  409    H    HIS  52           HN       HIS  52  -3.468  -4.850  -5.905
  410    HA   HIS  52           HA       HIS  52  -1.691  -3.556  -7.924
  411   1HB   HIS  52          HB2       HIS  52  -3.032  -5.923  -8.033
  412   2HB   HIS  52          HB1       HIS  52  -4.235  -4.840  -8.735
  413    HD1  HIS  52           HD1      HIS  52  -4.008  -5.120 -11.214
  414    HD2  HIS  52           HD2      HIS  52  -0.294  -4.784  -9.349
  415    HE1  HIS  52           HE1      HIS  52  -2.280  -5.041 -13.065
  416    HA   PRO  53           HA       PRO  53  -4.422  -0.079  -7.578
  417   1HB   PRO  53          HB2       PRO  53  -3.622   1.281  -9.810
  418   2HB   PRO  53          HB1       PRO  53  -2.659   1.219  -8.320
  419   1HG   PRO  53          HG2       PRO  53  -2.321  -0.291 -10.855
  420   2HG   PRO  53          HG1       PRO  53  -1.097   0.362  -9.756
  421   1HD   PRO  53          HD2       PRO  53  -1.834  -2.280  -9.855
  422   2HD   PRO  53          HD1       PRO  53  -1.121  -1.492  -8.430
  423    H    ARG  54           HN       ARG  54  -4.326  -2.245 -10.291
  424    HA   ARG  54           HA       ARG  54  -6.482  -1.086 -11.836
  425   1HB   ARG  54          HB2       ARG  54  -4.630  -2.746 -12.499
  426   2HB   ARG  54          HB1       ARG  54  -5.622  -3.985 -11.727
  427   1HG   ARG  54          HG2       ARG  54  -7.247  -2.337 -13.466
  428   2HG   ARG  54          HG1       ARG  54  -5.880  -3.008 -14.357
  429   1HD   ARG  54          HD2       ARG  54  -6.464  -5.275 -13.601
  430   2HD   ARG  54          HD1       ARG  54  -7.812  -4.621 -12.650
  431    HE   ARG  54           HE       ARG  54  -7.641  -4.286 -15.624
  432   1HH1  ARG  54          HH2       ARG  54  -9.652  -2.888 -13.692
  433   2HH1  ARG  54          HH2       ARG  54 -11.063  -3.848 -13.988
  434   1HH2  ARG  54          HH1       ARG  54  -9.328  -6.388 -15.585
  435   2HH2  ARG  54          HH1       ARG  54 -10.880  -5.830 -15.058
  436    H    LYS  55           HN       LYS  55  -6.337  -3.813  -9.514
  437    HA   LYS  55           HA       LYS  55  -9.013  -4.651  -9.591
  438   1HB   LYS  55          HB2       LYS  55  -6.696  -4.818  -7.867
  439   2HB   LYS  55          HB1       LYS  55  -8.165  -4.698  -6.900
  440   1HG   LYS  55          HG2       LYS  55  -8.381  -6.923  -7.262
  441   2HG   LYS  55          HG1       LYS  55  -8.901  -6.470  -8.885
  442   1HD   LYS  55          HD2       LYS  55  -6.015  -6.961  -8.100
  443   2HD   LYS  55          HD1       LYS  55  -7.049  -8.161  -8.877
  444   1HE   LYS  55          HE2       LYS  55  -7.453  -6.216 -10.637
  445   2HE   LYS  55          HE1       LYS  55  -5.892  -5.640 -10.021
  446   1HZ   LYS  55          HZ1       LYS  55  -4.993  -7.872 -10.349
  447   2HZ   LYS  55          HZ2       LYS  55  -5.550  -7.216 -11.814
  448   3HZ   LYS  55          HZ3       LYS  55  -6.473  -8.386 -10.998
  449    H    LYS  56           HN       LYS  56 -10.921  -3.701  -8.989
  450    HA   LYS  56           HA       LYS  56 -11.117  -0.960  -8.224
  451   1HB   LYS  56          HB2       LYS  56 -13.496  -1.550  -7.913
  452   2HB   LYS  56          HB1       LYS  56 -12.851  -2.307  -9.371
  453   1HG   LYS  56          HG2       LYS  56 -12.320  -4.321  -7.793
  454   2HG   LYS  56          HG1       LYS  56 -13.506  -3.574  -6.721
  455   1HD   LYS  56          HD2       LYS  56 -15.244  -4.189  -8.036
  456   2HD   LYS  56          HD1       LYS  56 -14.402  -3.712  -9.511
  457   1HE   LYS  56          HE2       LYS  56 -12.985  -5.958  -8.648
  458   2HE   LYS  56          HE1       LYS  56 -14.684  -6.374  -8.345
  459   1HZ   LYS  56          HZ1       LYS  56 -13.870  -5.040 -10.850
  460   2HZ   LYS  56          HZ2       LYS  56 -15.270  -5.950 -10.536
  461   3HZ   LYS  56          HZ3       LYS  56 -13.768  -6.727 -10.702
  462    H    TRP  57           HN       TRP  57 -11.171  -3.943  -6.272
  463    HA   TRP  57           HA       TRP  57 -11.986  -2.790  -3.809
  464   1HB   TRP  57          HB2       TRP  57 -11.781  -4.970  -3.221
  465   2HB   TRP  57          HB1       TRP  57 -11.204  -5.271  -4.852
  466    HD1  TRP  57           HD1      TRP  57  -8.562  -5.486  -5.203
  467    HE1  TRP  57           HE1      TRP  57  -6.662  -6.067  -3.562
  468    HE3  TRP  57           HE3      TRP  57 -10.973  -4.732  -0.767
  469    HZ2  TRP  57           HZ2      TRP  57  -6.223  -6.197  -0.739
  470    HZ3  TRP  57           HZ3      TRP  57  -9.793  -5.095   1.381
  471    HH2  TRP  57           HH2      TRP  57  -7.423  -5.825   1.402
  472    H    VAL  58           HN       VAL  58  -8.839  -2.796  -5.408
  473    HA   VAL  58           HA       VAL  58  -7.307  -1.892  -3.118
  474    HB   VAL  58           HB       VAL  58  -6.888  -1.663  -6.110
  475   1HG1  VAL  58          HG1       VAL  58  -5.498  -0.233  -4.350
  476   2HG1  VAL  58          HG1       VAL  58  -4.699  -1.012  -5.714
  477   3HG1  VAL  58          HG1       VAL  58  -4.655  -1.764  -4.120
  478   1HG2  VAL  58          HG2       VAL  58  -5.206  -3.616  -5.029
  479   2HG2  VAL  58          HG2       VAL  58  -6.666  -3.908  -5.972
  480   3HG2  VAL  58          HG2       VAL  58  -6.746  -3.871  -4.212
  481    H    GLN  59           HN       GLN  59  -8.736  -0.212  -5.943
  482    HA   GLN  59           HA       GLN  59  -7.917   2.425  -5.283
  483   1HB   GLN  59          HB2       GLN  59 -10.510   1.492  -6.569
  484   2HB   GLN  59          HB1       GLN  59  -9.739   3.063  -6.790
  485   1HG   GLN  59          HG2       GLN  59  -7.784   1.077  -7.366
  486   2HG   GLN  59          HG1       GLN  59  -9.256   0.629  -8.227
  487   1HE2  GLN  59          HE2       GLN  59  -6.545   2.039  -9.026
  488   2HE2  GLN  59          HE2       GLN  59  -7.075   3.348  -9.969
  489    H    LYS  60           HN       LYS  60 -10.413   0.350  -3.977
  490    HA   LYS  60           HA       LYS  60 -11.885   2.455  -2.625
  491   1HB   LYS  60          HB2       LYS  60 -12.842   0.273  -3.304
  492   2HB   LYS  60          HB1       LYS  60 -11.740  -0.547  -2.195
  493   1HG   LYS  60          HG2       LYS  60 -12.820   0.302  -0.289
  494   2HG   LYS  60          HG1       LYS  60 -13.574   1.619  -1.189
  495   1HD   LYS  60          HD2       LYS  60 -14.670  -0.455  -2.502
  496   2HD   LYS  60          HD1       LYS  60 -14.413  -1.228  -0.938
  497   1HE   LYS  60          HE2       LYS  60 -15.902   0.185   0.159
  498   2HE   LYS  60          HE1       LYS  60 -15.653   1.509  -0.998
  499   1HZ   LYS  60          HZ1       LYS  60 -16.839   0.346  -2.659
  500   2HZ   LYS  60          HZ2       LYS  60 -17.797   0.251  -1.261
  501   3HZ   LYS  60          HZ3       LYS  60 -16.873  -1.087  -1.753
  502    H    TYR  61           HN       TYR  61  -9.267   0.204  -1.757
  503    HA   TYR  61           HA       TYR  61  -9.260   0.982   1.060
  504   1HB   TYR  61          HB2       TYR  61  -7.809  -0.803  -0.793
  505   2HB   TYR  61          HB1       TYR  61  -6.836  -0.187   0.543
  506    HD1  TYR  61           HD1      TYR  61 -10.404  -1.298   0.129
  507    HD2  TYR  61           HD2      TYR  61  -6.746  -1.640   2.356
  508    HE1  TYR  61           HE1      TYR  61 -11.493  -2.908   1.671
  509    HE2  TYR  61           HE2      TYR  61  -7.835  -3.248   3.898
  510    HH   TYR  61           HH       TYR  61 -10.367  -3.681   4.616
  511    H    ILE  62           HN       ILE  62  -7.548   2.002  -1.863
  512    HA   ILE  62           HA       ILE  62  -5.521   3.572  -0.536
  513    HB   ILE  62           HB       ILE  62  -6.814   3.813  -3.278
  514   1HG1  ILE  62          HG1       ILE  62  -4.218   2.459  -2.493
  515   2HG1  ILE  62          HG1       ILE  62  -5.743   1.591  -2.656
  516   1HG2  ILE  62          HG2       ILE  62  -4.688   5.310  -1.910
  517   2HG2  ILE  62          HG2       ILE  62  -5.579   5.714  -3.378
  518   3HG2  ILE  62          HG2       ILE  62  -4.180   4.643  -3.461
  519   1HD1  ILE  62          HD1       ILE  62  -3.948   2.103  -4.712
  520   2HD1  ILE  62          HD1       ILE  62  -5.197   3.326  -4.946
  521   3HD1  ILE  62          HD1       ILE  62  -5.631   1.617  -4.914
  522    H    SER  63           HN       SER  63  -8.775   4.313  -1.798
  523    HA   SER  63           HA       SER  63  -8.739   7.130  -1.254
  524   1HB   SER  63          HB2       SER  63 -11.322   6.567  -1.124
  525   2HB   SER  63          HB1       SER  63 -10.462   6.377  -2.649
  526    HG   SER  63           HG       SER  63 -10.978   4.352  -2.537
  527    H    LEU  64           HN       LEU  64  -9.762   4.311   0.675
  528    HA   LEU  64           HA       LEU  64 -10.655   5.821   2.968
  529   1HB   LEU  64          HB2       LEU  64 -10.166   3.041   2.139
  530   2HB   LEU  64          HB1       LEU  64  -9.886   3.315   3.859
  531    HG   LEU  64           HG       LEU  64 -12.266   4.714   3.113
  532   1HD1  LEU  64          HD1       LEU  64 -12.256   3.059   1.208
  533   2HD1  LEU  64          HD1       LEU  64 -13.659   2.931   2.270
  534   3HD1  LEU  64          HD1       LEU  64 -12.339   1.769   2.408
  535   1HD2  LEU  64          HD2       LEU  64 -12.738   2.265   4.579
  536   2HD2  LEU  64          HD2       LEU  64 -12.800   3.929   5.159
  537   3HD2  LEU  64          HD2       LEU  64 -11.273   3.048   5.172
  538    H    LEU  65           HN       LEU  65  -7.711   3.775   2.604
  539    HA   LEU  65           HA       LEU  65  -6.392   4.805   4.922
  540   1HB   LEU  65          HB2       LEU  65  -5.348   3.595   2.339
  541   2HB   LEU  65          HB1       LEU  65  -4.364   3.831   3.782
  542    HG   LEU  65           HG       LEU  65  -6.799   2.046   3.489
  543   1HD1  LEU  65          HD1       LEU  65  -4.289   1.042   4.669
  544   2HD1  LEU  65          HD1       LEU  65  -4.142   1.541   2.985
  545   3HD1  LEU  65          HD1       LEU  65  -5.323   0.314   3.441
  546   1HD2  LEU  65          HD2       LEU  65  -7.026   3.027   5.658
  547   2HD2  LEU  65          HD2       LEU  65  -5.289   2.950   5.954
  548   3HD2  LEU  65          HD2       LEU  65  -6.246   1.468   5.925
  549    H    LYS  66           HN       LYS  66  -5.317   5.409   1.583
  550    HA   LYS  66           HA       LYS  66  -4.372   7.331   0.593
  551   1HB   LYS  66          HB2       LYS  66  -6.783   7.972   1.330
  552   2HB   LYS  66          HB1       LYS  66  -5.987   8.878   2.618
  553   1HG   LYS  66          HG2       LYS  66  -4.566   9.960   0.789
  554   2HG   LYS  66          HG1       LYS  66  -5.697   9.258  -0.368
  555   1HD   LYS  66          HD2       LYS  66  -6.550  11.018   1.945
  556   2HD   LYS  66          HD1       LYS  66  -6.249  11.626   0.317
  557   1HE   LYS  66          HE2       LYS  66  -8.246  10.847  -0.443
  558   2HE   LYS  66          HE1       LYS  66  -8.015   9.274   0.348
  559   1HZ   LYS  66          HZ1       LYS  66  -9.828  10.529   1.377
  560   2HZ   LYS  66          HZ2       LYS  66  -8.758  11.801   1.728
  561   3HZ   LYS  66          HZ3       LYS  66  -8.552  10.285   2.468
  562    H    THR  67           HN       THR  67  -2.211   7.426   1.142
  563    HA   THR  67           HA       THR  67  -1.451   9.145   3.420
  564    HB   THR  67           HB       THR  67  -0.316   6.365   3.106
  565    HG1  THR  67           HG1      THR  67  -2.423   7.198   4.807
  566   1HG2  THR  67          HG2       THR  67  -0.521   7.829   5.695
  567   2HG2  THR  67          HG2       THR  67   0.660   8.415   4.523
  568   3HG2  THR  67          HG2       THR  67   0.749   6.754   5.111
  569    HA   PRO  68           HA       PRO  68   1.232   9.005  -0.490
  570   1HB   PRO  68          HB2       PRO  68   0.521  11.425  -1.555
  571   2HB   PRO  68          HB1       PRO  68  -0.307   9.907  -1.961
  572   1HG   PRO  68          HG2       PRO  68  -1.123  12.063  -0.078
  573   2HG   PRO  68          HG1       PRO  68  -2.110  11.100  -1.189
  574   1HD   PRO  68          HD2       PRO  68  -1.967  10.626   1.488
  575   2HD   PRO  68          HD1       PRO  68  -2.309   9.364   0.284
  576    H    LYS  69           HN       LYS  69   0.392  11.574   1.799
  577    HA   LYS  69           HA       LYS  69   3.194  12.023   2.449
  578   1HB   LYS  69          HB2       LYS  69   2.610  13.176   0.170
  579   2HB   LYS  69          HB1       LYS  69   1.780  14.361   1.181
  580   1HG   LYS  69          HG2       LYS  69   3.725  15.242   1.954
  581   2HG   LYS  69          HG1       LYS  69   4.477  13.657   2.131
  582   1HD   LYS  69          HD2       LYS  69   5.405  13.717   0.048
  583   2HD   LYS  69          HD1       LYS  69   4.005  14.525  -0.660
  584   1HE   LYS  69          HE2       LYS  69   5.000  16.474   1.030
  585   2HE   LYS  69          HE1       LYS  69   6.476  15.699   0.419
  586   1HZ   LYS  69          HZ1       LYS  69   5.926  17.222  -1.239
  587   2HZ   LYS  69          HZ2       LYS  69   4.260  16.907  -1.121
  588   3HZ   LYS  69          HZ3       LYS  69   5.296  15.761  -1.827
  589    H    GLN  70           HN       GLN  70   3.389  13.249   4.370
  590    HA   GLN  70           HA       GLN  70   0.798  14.114   5.616
  591   1HB   GLN  70          HB2       GLN  70   3.226  12.634   6.598
  592   2HB   GLN  70          HB1       GLN  70   2.255  13.559   7.745
  593   1HG   GLN  70          HG2       GLN  70   0.270  12.271   6.471
  594   2HG   GLN  70          HG1       GLN  70   1.559  11.091   6.232
  595   1HE2  GLN  70          HE2       GLN  70   2.243   9.863   8.053
  596   2HE2  GLN  70          HE2       GLN  70   1.575  10.043   9.603
  597    H    LEU  71           HN       LEU  71   4.279  14.769   5.299
  598    HA   LEU  71           HA       LEU  71   3.818  17.504   6.435
  599   1HB   LEU  71          HB2       LEU  71   5.729  15.434   6.891
  600   2HB   LEU  71          HB1       LEU  71   6.584  16.791   6.154
  601    HG   LEU  71           HG       LEU  71   4.901  18.025   7.980
  602   1HD1  LEU  71          HD1       LEU  71   4.526  15.612   8.833
  603   2HD1  LEU  71          HD1       LEU  71   4.973  16.834  10.023
  604   3HD1  LEU  71          HD1       LEU  71   6.187  15.704   9.420
  605   1HD2  LEU  71          HD2       LEU  71   7.533  18.056   7.369
  606   2HD2  LEU  71          HD2       LEU  71   7.609  17.222   8.920
  607   3HD2  LEU  71          HD2       LEU  71   6.885  18.826   8.817
  Start of MODEL   15
    1   1H    THR   1          HT1       THR   1   0.684  14.037   5.465
    2   2H    THR   1          HT2       THR   1   1.734  15.311   5.064
    3   3H    THR   1          HT3       THR   1   0.086  15.620   5.344
    4    HA   THR   1           HA       THR   1   1.630  16.232   7.228
    5    HB   THR   1           HB       THR   1  -0.622  14.224   7.577
    6    HG1  THR   1           HG1      THR   1  -1.911  16.035   7.547
    7   1HG2  THR   1          HG2       THR   1   0.030  14.413   9.756
    8   2HG2  THR   1          HG2       THR   1  -0.827  15.952   9.659
    9   3HG2  THR   1          HG2       THR   1   0.925  15.905   9.463
   10    H    ARG   2           HN       ARG   2   0.689  12.789   7.480
   11    HA   ARG   2           HA       ARG   2   3.250  12.228   8.875
   12   1HB   ARG   2          HB2       ARG   2   0.769  10.558   8.348
   13   2HB   ARG   2          HB1       ARG   2   2.085  10.122   9.438
   14   1HG   ARG   2          HG2       ARG   2   1.617  12.357  10.625
   15   2HG   ARG   2          HG1       ARG   2   0.105  12.385   9.717
   16   1HD   ARG   2          HD2       ARG   2  -0.417  10.095  10.647
   17   2HD   ARG   2          HD1       ARG   2   1.007  10.264  11.693
   18    HE   ARG   2           HE       ARG   2  -1.056  12.415  11.715
   19   1HH1  ARG   2          HH1       ARG   2  -1.444   9.680  13.220
   20   2HH1  ARG   2          HH1       ARG   2  -1.011  10.176  14.821
   21   1HH2  ARG   2          HH2       ARG   2   0.436  13.155  13.793
   22   2HH2  ARG   2          HH2       ARG   2   0.055  12.143  15.147
   23    H    GLY   3           HN       GLY   3   4.881  11.902   7.353
   24   1HA   GLY   3          HA2       GLY   3   4.260  10.078   5.066
   25   2HA   GLY   3          HA1       GLY   3   5.543  11.290   5.047
   26    H    SER   4           HN       SER   4   7.086   9.610   4.535
   27    HA   SER   4           HA       SER   4   8.083   8.217   6.959
   28   1HB   SER   4          HB2       SER   4   6.384   6.839   5.525
   29   2HB   SER   4          HB1       SER   4   7.716   6.701   4.380
   30    HG   SER   4           HG       SER   4   7.557   5.002   6.013
   31    H    ASP   5           HN       ASP   5   9.902   6.578   5.386
   32    HA   ASP   5           HA       ASP   5  11.424   8.270   3.571
   33   1HB   ASP   5          HB2       ASP   5  11.762   8.489   6.439
   34   2HB   ASP   5          HB1       ASP   5  13.256   7.920   5.693
   35    H    ILE   6           HN       ILE   6  11.491   5.532   5.849
   36    HA   ILE   6           HA       ILE   6  13.360   4.089   4.013
   37    HB   ILE   6           HB       ILE   6  12.499   3.601   6.883
   38   1HG1  ILE   6          HG1       ILE   6  15.243   4.436   5.974
   39   2HG1  ILE   6          HG1       ILE   6  13.986   5.654   6.190
   40   1HG2  ILE   6          HG2       ILE   6  13.201   1.494   6.255
   41   2HG2  ILE   6          HG2       ILE   6  14.771   2.204   6.627
   42   3HG2  ILE   6          HG2       ILE   6  14.221   2.108   4.954
   43   1HD1  ILE   6          HD1       ILE   6  13.611   4.480   8.504
   44   2HD1  ILE   6          HD1       ILE   6  14.969   5.588   8.316
   45   3HD1  ILE   6          HD1       ILE   6  15.236   3.846   8.245
   46    H    SER   7           HN       SER   7  10.612   4.337   3.224
   47    HA   SER   7           HA       SER   7   9.634   1.545   3.652
   48   1HB   SER   7          HB2       SER   7   7.929   3.923   2.928
   49   2HB   SER   7          HB1       SER   7   7.435   2.417   3.694
   50    HG   SER   7           HG       SER   7   8.339   3.067   5.571
   51    H    LYS   8           HN       LYS   8  11.362   3.000   1.466
   52    HA   LYS   8           HA       LYS   8   9.708   2.816  -0.938
   53   1HB   LYS   8          HB2       LYS   8  12.412   3.630  -0.112
   54   2HB   LYS   8          HB1       LYS   8  12.363   2.876  -1.706
   55   1HG   LYS   8          HG2       LYS   8  10.648   4.445  -2.444
   56   2HG   LYS   8          HG1       LYS   8  10.566   5.156  -0.832
   57   1HD   LYS   8          HD2       LYS   8  13.054   5.680  -1.084
   58   2HD   LYS   8          HD1       LYS   8  12.872   5.261  -2.787
   59   1HE   LYS   8          HE2       LYS   8  12.400   7.524  -2.945
   60   2HE   LYS   8          HE1       LYS   8  10.772   6.960  -2.519
   61   1HZ   LYS   8          HZ1       LYS   8  12.879   7.893  -0.644
   62   2HZ   LYS   8          HZ2       LYS   8  11.417   7.178  -0.157
   63   3HZ   LYS   8          HZ3       LYS   8  11.407   8.665  -0.979
   64    H    THR   9           HN       THR   9   9.055   0.765  -1.505
   65    HA   THR   9           HA       THR   9  11.115  -1.231  -2.157
   66    HB   THR   9           HB       THR   9   9.029  -1.676   0.004
   67    HG1  THR   9           HG1      THR   9  10.662  -1.499   1.373
   68   1HG2  THR   9          HG2       THR   9   9.710  -3.604  -1.627
   69   2HG2  THR   9          HG2       THR   9   9.706  -3.909   0.109
   70   3HG2  THR   9          HG2       THR   9  11.226  -3.589  -0.726
   71    H    CYS  10           HN       CYS  10  10.350  -1.595  -4.233
   72    HA   CYS  10           HA       CYS  10   7.657  -1.416  -5.104
   73   1HB   CYS  10          HB2       CYS  10   9.959  -3.112  -6.140
   74   2HB   CYS  10          HB1       CYS  10   8.539  -2.635  -7.070
   75    H    CYS  11           HN       CYS  11   6.707  -3.656  -6.195
   76    HA   CYS  11           HA       CYS  11   6.767  -5.757  -4.057
   77   1HB   CYS  11          HB2       CYS  11   4.426  -4.331  -5.335
   78   2HB   CYS  11          HB1       CYS  11   4.243  -5.842  -4.447
   79    H    PHE  12           HN       PHE  12   5.618  -7.792  -4.871
   80    HA   PHE  12           HA       PHE  12   5.946  -8.176  -7.811
   81   1HB   PHE  12          HB2       PHE  12   7.175  -9.597  -5.470
   82   2HB   PHE  12          HB1       PHE  12   6.839 -10.515  -6.938
   83    HD1  PHE  12           HD1      PHE  12   7.485  -9.047  -9.179
   84    HD2  PHE  12           HD2      PHE  12   9.335  -8.764  -5.313
   85    HE1  PHE  12           HE1      PHE  12   9.536  -8.125 -10.228
   86    HE2  PHE  12           HE2      PHE  12  11.386  -7.844  -6.361
   87    HZ   PHE  12           HZ       PHE  12  11.486  -7.524  -8.818
   88    H    GLN  13           HN       GLN  13   4.802  -9.732  -4.796
   89    HA   GLN  13           HA       GLN  13   2.666 -11.128  -6.295
   90   1HB   GLN  13          HB2       GLN  13   3.617 -11.165  -3.413
   91   2HB   GLN  13          HB1       GLN  13   2.340 -12.205  -4.046
   92   1HG   GLN  13          HG2       GLN  13   4.041 -12.965  -5.807
   93   2HG   GLN  13          HG1       GLN  13   5.264 -12.176  -4.810
   94   1HE2  GLN  13          HE2       GLN  13   5.185 -12.892  -2.382
   95   2HE2  GLN  13          HE2       GLN  13   4.872 -14.534  -2.089
   96    H    TYR  14           HN       TYR  14   0.403 -10.864  -5.628
   97    HA   TYR  14           HA       TYR  14  -0.163  -8.416  -4.024
   98   1HB   TYR  14          HB2       TYR  14  -1.398  -9.109  -6.707
   99   2HB   TYR  14          HB1       TYR  14  -1.668  -7.635  -5.779
  100    HD1  TYR  14           HD1      TYR  14   0.017  -8.850  -8.533
  101    HD2  TYR  14           HD2      TYR  14   0.749  -6.545  -4.983
  102    HE1  TYR  14           HE1      TYR  14   1.994  -7.813  -9.614
  103    HE2  TYR  14           HE2      TYR  14   2.726  -5.509  -6.063
  104    HH   TYR  14           HH       TYR  14   4.219  -6.715  -8.705
  105    H    SER  15           HN       SER  15  -1.579  -9.006  -2.431
  106    HA   SER  15           HA       SER  15  -3.184 -11.466  -2.720
  107   1HB   SER  15          HB2       SER  15  -2.202  -9.663  -0.587
  108   2HB   SER  15          HB1       SER  15  -3.768 -10.406  -0.276
  109    HG   SER  15           HG       SER  15  -1.971 -11.689   0.420
  110    H    HIS  16           HN       HIS  16  -5.379 -11.453  -3.107
  111    HA   HIS  16           HA       HIS  16  -6.731  -8.785  -3.280
  112   1HB   HIS  16          HB2       HIS  16  -7.310 -11.473  -4.569
  113   2HB   HIS  16          HB1       HIS  16  -8.229  -9.996  -4.860
  114    HD1  HIS  16           HD1      HIS  16  -5.949  -7.959  -5.100
  115    HD2  HIS  16           HD2      HIS  16  -5.868 -11.699  -6.937
  116    HE1  HIS  16           HE1      HIS  16  -4.324  -7.771  -7.034
  117    H    LYS  17           HN       LYS  17  -6.944  -9.127  -0.800
  118    HA   LYS  17           HA       LYS  17  -9.505 -10.557  -0.275
  119   1HB   LYS  17          HB2       LYS  17  -6.943 -11.454   0.430
  120   2HB   LYS  17          HB1       LYS  17  -7.594 -10.758   1.913
  121   1HG   LYS  17          HG2       LYS  17  -9.750 -12.167   0.894
  122   2HG   LYS  17          HG1       LYS  17  -8.379 -13.206   0.506
  123   1HD   LYS  17          HD2       LYS  17  -7.798 -13.508   2.738
  124   2HD   LYS  17          HD1       LYS  17  -8.554 -11.996   3.245
  125   1HE   LYS  17          HE2       LYS  17 -10.801 -13.044   2.694
  126   2HE   LYS  17          HE1       LYS  17  -9.945 -14.586   2.495
  127   1HZ   LYS  17          HZ1       LYS  17 -10.588 -14.465   4.759
  128   2HZ   LYS  17          HZ2       LYS  17 -10.035 -12.865   4.911
  129   3HZ   LYS  17          HZ3       LYS  17  -8.924 -14.137   4.721
  130    HA   PRO  18           HA       PRO  18 -10.300  -6.793   1.902
  131   1HB   PRO  18          HB2       PRO  18 -12.439  -7.592   3.403
  132   2HB   PRO  18          HB1       PRO  18 -12.547  -7.288   1.657
  133   1HG   PRO  18          HG2       PRO  18 -12.401  -9.861   3.122
  134   2HG   PRO  18          HG1       PRO  18 -13.265  -9.453   1.634
  135   1HD   PRO  18          HD2       PRO  18 -10.872 -10.832   1.747
  136   2HD   PRO  18          HD1       PRO  18 -11.479  -9.963   0.321
  137    H    LEU  19           HN       LEU  19  -8.538  -6.516   3.327
  138    HA   LEU  19           HA       LEU  19  -8.019  -8.199   5.618
  139   1HB   LEU  19          HB2       LEU  19  -6.768  -6.190   4.168
  140   2HB   LEU  19          HB1       LEU  19  -7.091  -5.413   5.717
  141    HG   LEU  19           HG       LEU  19  -6.082  -8.149   6.011
  142   1HD1  LEU  19          HD1       LEU  19  -4.776  -6.335   4.126
  143   2HD1  LEU  19          HD1       LEU  19  -4.453  -8.040   4.446
  144   3HD1  LEU  19          HD1       LEU  19  -3.711  -6.798   5.453
  145   1HD2  LEU  19          HD2       LEU  19  -5.210  -7.231   7.905
  146   2HD2  LEU  19          HD2       LEU  19  -6.247  -5.856   7.521
  147   3HD2  LEU  19          HD2       LEU  19  -4.550  -5.843   7.037
  148    HA   PRO  20           HA       PRO  20 -10.980  -6.509   8.428
  149   1HB   PRO  20          HB2       PRO  20  -9.687  -6.958  10.806
  150   2HB   PRO  20          HB1       PRO  20 -10.470  -8.249   9.871
  151   1HG   PRO  20          HG2       PRO  20  -7.590  -7.492  10.006
  152   2HG   PRO  20          HG1       PRO  20  -8.332  -9.101   9.979
  153   1HD   PRO  20          HD2       PRO  20  -7.210  -7.979   7.787
  154   2HD   PRO  20          HD1       PRO  20  -8.594  -9.089   7.693
  155    H    TRP  21           HN       TRP  21 -11.102  -4.290   8.277
  156    HA   TRP  21           HA       TRP  21  -9.158  -2.339   8.300
  157   1HB   TRP  21          HB2       TRP  21 -11.932  -2.346   9.517
  158   2HB   TRP  21          HB1       TRP  21 -11.006  -0.877   9.196
  159    HD1  TRP  21           HD1      TRP  21 -13.032  -3.565   7.504
  160    HE1  TRP  21           HE1      TRP  21 -13.243  -3.027   4.990
  161    HE3  TRP  21           HE3      TRP  21  -9.710   0.294   7.150
  162    HZ2  TRP  21           HZ2      TRP  21 -12.139  -1.201   3.083
  163    HZ3  TRP  21           HZ3      TRP  21  -9.307   1.412   4.977
  164    HH2  TRP  21           HH2      TRP  21 -10.516   0.670   2.945
  165    H    THR  22           HN       THR  22 -10.424  -4.018  11.145
  166    HA   THR  22           HA       THR  22  -9.485  -2.315  13.198
  167    HB   THR  22           HB       THR  22  -9.210  -4.688  14.330
  168    HG1  THR  22           HG1      THR  22  -9.642  -6.301  13.074
  169   1HG2  THR  22          HG2       THR  22 -11.550  -4.701  14.768
  170   2HG2  THR  22          HG2       THR  22 -11.919  -3.968  13.208
  171   3HG2  THR  22          HG2       THR  22 -11.144  -3.011  14.471
  172    H    TRP  23           HN       TRP  23  -7.757  -4.566  11.121
  173    HA   TRP  23           HA       TRP  23  -5.235  -4.089  12.623
  174   1HB   TRP  23          HB2       TRP  23  -6.426  -6.219  10.946
  175   2HB   TRP  23          HB1       TRP  23  -4.695  -5.975  10.727
  176    HD1  TRP  23           HD1      TRP  23  -6.281  -5.317  14.126
  177    HE1  TRP  23           HE1      TRP  23  -5.433  -7.083  15.801
  178    HE3  TRP  23           HE3      TRP  23  -3.809  -8.447  10.935
  179    HZ2  TRP  23           HZ2      TRP  23  -3.906  -9.502  15.791
  180    HZ3  TRP  23           HZ3      TRP  23  -2.669 -10.473  11.794
  181    HH2  TRP  23           HH2      TRP  23  -2.715 -11.005  14.215
  182    H    VAL  24           HN       VAL  24  -6.859  -2.714  10.045
  183    HA   VAL  24           HA       VAL  24  -4.502  -2.423   8.286
  184    HB   VAL  24           HB       VAL  24  -7.230  -1.105   8.115
  185   1HG1  VAL  24          HG1       VAL  24  -5.000  -0.551   6.690
  186   2HG1  VAL  24          HG1       VAL  24  -6.620  -0.472   5.994
  187   3HG1  VAL  24          HG1       VAL  24  -5.620  -1.905   5.745
  188   1HG2  VAL  24          HG2       VAL  24  -7.714  -3.019   6.521
  189   2HG2  VAL  24          HG2       VAL  24  -7.607  -3.487   8.217
  190   3HG2  VAL  24          HG2       VAL  24  -6.256  -3.805   7.131
  191    H    ARG  25           HN       ARG  25  -3.503  -0.321   7.877
  192    HA   ARG  25           HA       ARG  25  -4.191   1.802   9.870
  193   1HB   ARG  25          HB2       ARG  25  -2.290   0.122  10.466
  194   2HB   ARG  25          HB1       ARG  25  -1.347   1.024   9.279
  195   1HG   ARG  25          HG2       ARG  25  -2.613   2.985  10.840
  196   2HG   ARG  25          HG1       ARG  25  -2.059   1.770  11.992
  197   1HD   ARG  25          HD2       ARG  25   0.095   1.999  10.251
  198   2HD   ARG  25          HD1       ARG  25  -0.483   3.669  10.418
  199    HE   ARG  25           HE       ARG  25  -0.523   3.073  12.972
  200   1HH1  ARG  25          HH1       ARG  25   0.860   0.407  12.127
  201   2HH1  ARG  25          HH1       ARG  25   2.493   0.761  12.585
  202   1HH2  ARG  25          HH2       ARG  25   1.940   4.169  12.917
  203   2HH2  ARG  25          HH2       ARG  25   3.104   2.891  13.033
  204    H    SER  26           HN       SER  26  -1.965   1.126   7.097
  205    HA   SER  26           HA       SER  26  -2.876   3.668   5.852
  206   1HB   SER  26          HB2       SER  26  -0.595   4.551   5.799
  207   2HB   SER  26          HB1       SER  26  -1.058   4.205   7.463
  208    HG   SER  26           HG       SER  26   0.998   3.252   6.099
  209    H    TYR  27           HN       TYR  27  -0.834   3.883   3.961
  210    HA   TYR  27           HA       TYR  27  -0.435   1.286   2.639
  211   1HB   TYR  27          HB2       TYR  27  -1.992   1.608   0.902
  212   2HB   TYR  27          HB1       TYR  27  -2.858   2.249   2.292
  213    HD1  TYR  27           HD1      TYR  27  -0.944   3.128  -0.752
  214    HD2  TYR  27           HD2      TYR  27  -3.321   4.615   2.500
  215    HE1  TYR  27           HE1      TYR  27  -1.120   5.327  -1.884
  216    HE2  TYR  27           HE2      TYR  27  -3.499   6.811   1.370
  217    HH   TYR  27           HH       TYR  27  -1.532   7.778  -1.087
  218    H    GLU  28           HN       GLU  28   0.376   1.960   0.198
  219    HA   GLU  28           HA       GLU  28   1.678   4.471  -0.186
  220   1HB   GLU  28          HB2       GLU  28   4.058   3.553   0.283
  221   2HB   GLU  28          HB1       GLU  28   3.074   3.996   1.676
  222   1HG   GLU  28          HG2       GLU  28   2.884   1.835   2.391
  223   2HG   GLU  28          HG1       GLU  28   2.760   1.202   0.751
  224    H    PHE  29           HN       PHE  29   2.441   4.560  -2.297
  225    HA   PHE  29           HA       PHE  29   2.022   2.215  -3.999
  226   1HB   PHE  29          HB2       PHE  29   2.082   5.038  -4.205
  227   2HB   PHE  29          HB1       PHE  29   3.367   4.443  -5.257
  228    HD1  PHE  29           HD1      PHE  29   2.847   2.779  -7.052
  229    HD2  PHE  29           HD2      PHE  29  -0.230   4.672  -4.729
  230    HE1  PHE  29           HE1      PHE  29   1.159   2.101  -8.739
  231    HE2  PHE  29           HE2      PHE  29  -1.921   3.994  -6.413
  232    HZ   PHE  29           HZ       PHE  29  -1.227   2.708  -8.419
  233    H    THR  30           HN       THR  30   3.825   1.709  -5.666
  234    HA   THR  30           HA       THR  30   6.330   1.197  -4.177
  235    HB   THR  30           HB       THR  30   6.719  -0.180  -6.335
  236    HG1  THR  30           HG1      THR  30   5.246   0.851  -7.649
  237   1HG2  THR  30          HG2       THR  30   4.249  -0.809  -4.697
  238   2HG2  THR  30          HG2       THR  30   5.901  -1.091  -4.147
  239   3HG2  THR  30          HG2       THR  30   5.277  -1.963  -5.546
  240    H    SER  31           HN       SER  31   8.411   1.472  -5.502
  241    HA   SER  31           HA       SER  31   8.663   4.213  -6.391
  242   1HB   SER  31          HB2       SER  31  10.357   2.599  -5.283
  243   2HB   SER  31          HB1       SER  31  10.596   1.946  -6.901
  244    HG   SER  31           HG       SER  31  11.305   4.406  -5.823
  245    H    ASN  32           HN       ASN  32   9.030   4.972  -8.540
  246    HA   ASN  32           HA       ASN  32   7.768   3.360 -10.656
  247   1HB   ASN  32          HB2       ASN  32   8.526   6.153 -10.094
  248   2HB   ASN  32          HB1       ASN  32   8.710   5.690 -11.786
  249   1HD2  ASN  32          HD2       ASN  32   6.832   6.920 -12.489
  250   2HD2  ASN  32          HD2       ASN  32   5.253   6.448 -12.082
  251    H    SER  33           HN       SER  33   9.836   1.825 -10.183
  252    HA   SER  33           HA       SER  33  11.498   1.959 -12.540
  253   1HB   SER  33          HB2       SER  33  13.623   2.482 -11.350
  254   2HB   SER  33          HB1       SER  33  12.475   3.814 -11.255
  255    HG   SER  33           HG       SER  33  13.641   2.617  -9.267
  256    H    CYS  34           HN       CYS  34   9.976  -0.114 -11.518
  257    HA   CYS  34           HA       CYS  34  12.071  -2.059 -10.627
  258   1HB   CYS  34          HB2       CYS  34   9.356  -1.433  -9.492
  259   2HB   CYS  34          HB1       CYS  34  10.093  -3.018  -9.243
  260    H    SER  35           HN       SER  35  11.182  -4.381 -10.945
  261    HA   SER  35           HA       SER  35  10.599  -4.901 -13.642
  262   1HB   SER  35          HB2       SER  35  11.107  -6.311 -11.320
  263   2HB   SER  35          HB1       SER  35   9.468  -6.816 -11.719
  264    HG   SER  35           HG       SER  35  11.860  -7.144 -13.136
  265    H    GLN  36           HN       GLN  36   8.342  -4.367 -10.942
  266    HA   GLN  36           HA       GLN  36   6.168  -3.897 -12.898
  267   1HB   GLN  36          HB2       GLN  36   6.603  -6.403 -11.745
  268   2HB   GLN  36          HB1       GLN  36   5.315  -5.702 -10.767
  269   1HG   GLN  36          HG2       GLN  36   5.213  -5.609 -13.780
  270   2HG   GLN  36          HG1       GLN  36   4.619  -7.010 -12.887
  271   1HE2  GLN  36          HE2       GLN  36   2.363  -6.621 -13.356
  272   2HE2  GLN  36          HE2       GLN  36   1.525  -5.289 -12.721
  273    H    ARG  37           HN       ARG  37   5.253  -2.014 -12.175
  274    HA   ARG  37           HA       ARG  37   5.615  -0.995  -9.491
  275   1HB   ARG  37          HB2       ARG  37   4.109  -0.288 -11.984
  276   2HB   ARG  37          HB1       ARG  37   3.669   0.535 -10.487
  277   1HG   ARG  37          HG2       ARG  37   5.926   1.338 -10.184
  278   2HG   ARG  37          HG1       ARG  37   6.510   0.354 -11.526
  279   1HD   ARG  37          HD2       ARG  37   4.276   2.157 -12.237
  280   2HD   ARG  37          HD1       ARG  37   5.780   2.983 -11.782
  281    HE   ARG  37           HE       ARG  37   6.928   1.437 -13.449
  282   1HH1  ARG  37          HH1       ARG  37   4.875   3.528 -14.580
  283   2HH1  ARG  37          HH1       ARG  37   4.162   2.575 -15.837
  284   1HH2  ARG  37          HH2       ARG  37   5.443  -0.423 -14.657
  285   2HH2  ARG  37          HH2       ARG  37   4.483   0.339 -15.882
  286    H    ALA  38           HN       ALA  38   3.825  -0.607  -7.940
  287    HA   ALA  38           HA       ALA  38   1.268  -1.962  -8.271
  288   1HB   ALA  38          HB1       ALA  38   3.622  -3.317  -7.115
  289   2HB   ALA  38          HB2       ALA  38   2.153  -4.012  -7.799
  290   3HB   ALA  38          HB3       ALA  38   2.163  -3.433  -6.133
  291    H    VAL  39           HN       VAL  39   0.330  -2.239  -5.837
  292    HA   VAL  39           HA       VAL  39   0.956   0.315  -4.380
  293    HB   VAL  39           HB       VAL  39  -1.640  -1.196  -4.832
  294   1HG1  VAL  39          HG1       VAL  39  -1.976  -0.280  -2.716
  295   2HG1  VAL  39          HG1       VAL  39  -2.501   1.050  -3.748
  296   3HG1  VAL  39          HG1       VAL  39  -0.894   1.079  -3.022
  297   1HG2  VAL  39          HG2       VAL  39  -1.188   0.017  -6.797
  298   2HG2  VAL  39          HG2       VAL  39  -0.427   1.341  -5.914
  299   3HG2  VAL  39          HG2       VAL  39  -2.179   1.139  -5.865
  300    H    ILE  40           HN       ILE  40   0.472   0.152  -2.001
  301    HA   ILE  40           HA       ILE  40   0.620  -2.648  -0.964
  302    HB   ILE  40           HB       ILE  40   2.395  -0.256  -0.438
  303   1HG1  ILE  40          HG1       ILE  40   3.397  -3.028  -0.853
  304   2HG1  ILE  40          HG1       ILE  40   2.676  -2.224  -2.248
  305   1HG2  ILE  40          HG2       ILE  40   2.048  -2.766   1.211
  306   2HG2  ILE  40          HG2       ILE  40   1.931  -1.094   1.757
  307   3HG2  ILE  40          HG2       ILE  40   3.496  -1.763   1.291
  308   1HD1  ILE  40          HD1       ILE  40   4.543  -1.000  -2.530
  309   2HD1  ILE  40          HD1       ILE  40   5.285  -1.838  -1.166
  310   3HD1  ILE  40          HD1       ILE  40   4.377  -0.351  -0.898
  311    H    PHE  41           HN       PHE  41  -0.002  -2.752   1.354
  312    HA   PHE  41           HA       PHE  41  -1.564  -0.416   2.364
  313   1HB   PHE  41          HB2       PHE  41  -2.500  -3.254   1.829
  314   2HB   PHE  41          HB1       PHE  41  -3.366  -2.177   2.926
  315    HD1  PHE  41           HD1      PHE  41  -3.560  -3.387  -0.254
  316    HD2  PHE  41           HD2      PHE  41  -3.380   0.398   1.768
  317    HE1  PHE  41           HE1      PHE  41  -4.666  -2.299  -2.187
  318    HE2  PHE  41           HE2      PHE  41  -4.483   1.487  -0.165
  319    HZ   PHE  41           HZ       PHE  41  -5.128   0.138  -2.145
  320    H    THR  42           HN       THR  42  -0.809  -0.087   4.445
  321    HA   THR  42           HA       THR  42   0.632  -2.294   5.779
  322    HB   THR  42           HB       THR  42   0.305   0.479   6.860
  323    HG1  THR  42           HG1      THR  42   1.831  -0.322   4.616
  324   1HG2  THR  42          HG2       THR  42   2.938  -0.196   6.961
  325   2HG2  THR  42          HG2       THR  42   2.183  -1.788   7.048
  326   3HG2  THR  42          HG2       THR  42   1.782  -0.556   8.244
  327    H    THR  43           HN       THR  43   0.194  -2.966   7.912
  328    HA   THR  43           HA       THR  43  -2.662  -2.715   8.708
  329    HB   THR  43           HB       THR  43  -2.144  -4.755   9.991
  330    HG1  THR  43           HG1      THR  43  -0.123  -5.418  10.256
  331   1HG2  THR  43          HG2       THR  43  -2.368  -5.966   8.107
  332   2HG2  THR  43          HG2       THR  43  -0.732  -5.559   7.589
  333   3HG2  THR  43          HG2       THR  43  -2.072  -4.482   7.200
  334    H    LYS  44           HN       LYS  44  -2.526  -3.243  11.389
  335    HA   LYS  44           HA       LYS  44  -1.530  -0.701  12.482
  336   1HB   LYS  44          HB2       LYS  44  -3.251  -3.002  13.326
  337   2HB   LYS  44          HB1       LYS  44  -2.590  -1.948  14.578
  338   1HG   LYS  44          HG2       LYS  44  -3.799  -0.603  12.215
  339   2HG   LYS  44          HG1       LYS  44  -4.913  -1.413  13.318
  340   1HD   LYS  44          HD2       LYS  44  -3.973  -0.166  15.214
  341   2HD   LYS  44          HD1       LYS  44  -2.823   0.626  14.137
  342   1HE   LYS  44          HE2       LYS  44  -4.913   1.408  12.806
  343   2HE   LYS  44          HE1       LYS  44  -5.817   0.986  14.275
  344   1HZ   LYS  44          HZ1       LYS  44  -4.875   3.324  14.169
  345   2HZ   LYS  44          HZ2       LYS  44  -3.344   2.613  14.358
  346   3HZ   LYS  44          HZ3       LYS  44  -4.524   2.430  15.567
  347    H    ARG  45           HN       ARG  45  -0.273  -3.870  12.123
  348    HA   ARG  45           HA       ARG  45   1.388  -3.759  14.569
  349   1HB   ARG  45          HB2       ARG  45   0.449  -5.705  12.611
  350   2HB   ARG  45          HB1       ARG  45   2.175  -5.888  12.926
  351   1HG   ARG  45          HG2       ARG  45   0.451  -5.459  15.307
  352   2HG   ARG  45          HG1       ARG  45   0.277  -7.014  14.489
  353   1HD   ARG  45          HD2       ARG  45   3.046  -5.989  15.054
  354   2HD   ARG  45          HD1       ARG  45   2.117  -6.741  16.366
  355    HE   ARG  45           HE       ARG  45   2.972  -8.090  13.867
  356   1HH1  ARG  45          HH1       ARG  45   3.597  -9.239  16.534
  357   2HH1  ARG  45          HH1       ARG  45   2.369 -10.447  16.721
  358   1HH2  ARG  45          HH2       ARG  45   0.343  -9.159  14.221
  359   2HH2  ARG  45          HH2       ARG  45   0.529 -10.403  15.412
  360    H    GLY  46           HN       GLY  46   1.612  -2.961  11.187
  361   1HA   GLY  46          HA2       GLY  46   3.484  -1.417  10.589
  362   2HA   GLY  46          HA1       GLY  46   4.537  -2.450  11.556
  363    H    LYS  47           HN       LYS  47   2.521  -4.578  10.064
  364    HA   LYS  47           HA       LYS  47   4.561  -5.339   8.109
  365   1HB   LYS  47          HB2       LYS  47   2.948  -6.744   9.654
  366   2HB   LYS  47          HB1       LYS  47   1.807  -6.526   8.326
  367   1HG   LYS  47          HG2       LYS  47   3.714  -7.343   6.793
  368   2HG   LYS  47          HG1       LYS  47   4.496  -7.898   8.275
  369   1HD   LYS  47          HD2       LYS  47   2.679  -9.367   8.793
  370   2HD   LYS  47          HD1       LYS  47   1.656  -8.647   7.548
  371   1HE   LYS  47          HE2       LYS  47   2.621  -9.877   5.875
  372   2HE   LYS  47          HE1       LYS  47   4.245  -9.727   6.577
  373   1HZ   LYS  47          HZ1       LYS  47   2.049 -11.461   7.578
  374   2HZ   LYS  47          HZ2       LYS  47   3.543 -11.246   8.356
  375   3HZ   LYS  47          HZ3       LYS  47   3.476 -11.986   6.828
  376    H    LYS  48           HN       LYS  48   4.592  -4.481   6.061
  377    HA   LYS  48           HA       LYS  48   2.153  -3.151   5.009
  378   1HB   LYS  48          HB2       LYS  48   4.933  -3.330   3.816
  379   2HB   LYS  48          HB1       LYS  48   3.687  -2.139   3.449
  380   1HG   LYS  48          HG2       LYS  48   3.915  -1.801   6.139
  381   2HG   LYS  48          HG1       LYS  48   5.567  -2.257   5.731
  382   1HD   LYS  48          HD2       LYS  48   4.118  -0.187   4.094
  383   2HD   LYS  48          HD1       LYS  48   4.904   0.265   5.607
  384   1HE   LYS  48          HE2       LYS  48   6.606  -1.420   3.904
  385   2HE   LYS  48          HE1       LYS  48   6.181   0.132   3.157
  386   1HZ   LYS  48          HZ1       LYS  48   7.450  -0.349   5.787
  387   2HZ   LYS  48          HZ2       LYS  48   6.670   1.117   5.430
  388   3HZ   LYS  48          HZ3       LYS  48   8.010   0.619   4.512
  389    H    VAL  49           HN       VAL  49   0.843  -4.208   3.580
  390    HA   VAL  49           HA       VAL  49   1.848  -6.723   2.317
  391    HB   VAL  49           HB       VAL  49  -0.930  -5.552   2.687
  392   1HG1  VAL  49          HG1       VAL  49  -1.794  -7.578   1.824
  393   2HG1  VAL  49          HG1       VAL  49  -0.240  -8.401   1.966
  394   3HG1  VAL  49          HG1       VAL  49  -0.478  -7.175   0.722
  395   1HG2  VAL  49          HG2       VAL  49   0.553  -7.768   4.140
  396   2HG2  VAL  49          HG2       VAL  49  -1.140  -7.348   4.397
  397   3HG2  VAL  49          HG2       VAL  49   0.127  -6.192   4.810
  398    H    CYS  50           HN       CYS  50   2.105  -6.833   0.098
  399    HA   CYS  50           HA       CYS  50   1.806  -4.374  -1.477
  400   1HB   CYS  50          HB2       CYS  50   2.802  -7.187  -1.974
  401   2HB   CYS  50          HB1       CYS  50   2.737  -5.977  -3.254
  402    H    THR  51           HN       THR  51   0.566  -4.314  -3.488
  403    HA   THR  51           HA       THR  51  -1.492  -6.375  -3.956
  404    HB   THR  51           HB       THR  51  -3.244  -4.453  -3.728
  405    HG1  THR  51           HG1      THR  51  -1.266  -3.474  -1.968
  406   1HG2  THR  51          HG2       THR  51  -2.524  -6.471  -2.091
  407   2HG2  THR  51          HG2       THR  51  -3.785  -5.311  -1.677
  408   3HG2  THR  51          HG2       THR  51  -2.153  -5.102  -1.043
  409    H    HIS  52           HN       HIS  52  -3.164  -4.879  -5.621
  410    HA   HIS  52           HA       HIS  52  -1.285  -3.765  -7.658
  411   1HB   HIS  52          HB2       HIS  52  -2.805  -6.122  -7.719
  412   2HB   HIS  52          HB1       HIS  52  -3.688  -4.987  -8.740
  413    HD1  HIS  52           HD1      HIS  52   0.072  -5.441  -8.262
  414    HD2  HIS  52           HD2      HIS  52  -2.785  -5.524 -11.297
  415    HE1  HIS  52           HE1      HIS  52   1.340  -5.767 -10.431
  416    HA   PRO  53           HA       PRO  53  -4.114  -0.348  -7.481
  417   1HB   PRO  53          HB2       PRO  53  -3.194   1.041  -9.648
  418   2HB   PRO  53          HB1       PRO  53  -2.329   0.987  -8.099
  419   1HG   PRO  53          HG2       PRO  53  -1.787  -0.476 -10.621
  420   2HG   PRO  53          HG1       PRO  53  -0.658   0.160  -9.417
  421   1HD   PRO  53          HD2       PRO  53  -1.393  -2.491  -9.644
  422   2HD   PRO  53          HD1       PRO  53  -0.729  -1.744  -8.176
  423    H    ARG  54           HN       ARG  54  -3.810  -2.507 -10.183
  424    HA   ARG  54           HA       ARG  54  -5.764  -1.408 -11.960
  425   1HB   ARG  54          HB2       ARG  54  -3.989  -3.359 -12.122
  426   2HB   ARG  54          HB1       ARG  54  -5.343  -4.357 -11.593
  427   1HG   ARG  54          HG2       ARG  54  -6.675  -3.705 -13.478
  428   2HG   ARG  54          HG1       ARG  54  -5.527  -2.443 -13.929
  429   1HD   ARG  54          HD2       ARG  54  -3.906  -4.666 -13.910
  430   2HD   ARG  54          HD1       ARG  54  -5.439  -5.334 -14.507
  431    HE   ARG  54           HE       ARG  54  -5.055  -2.866 -15.828
  432   1HH1  ARG  54          HH1       ARG  54  -2.311  -4.499 -15.478
  433   2HH1  ARG  54          HH1       ARG  54  -2.178  -5.108 -17.095
  434   1HH2  ARG  54          HH2       ARG  54  -5.431  -4.275 -17.961
  435   2HH2  ARG  54          HH2       ARG  54  -3.944  -4.982 -18.499
  436    H    LYS  55           HN       LYS  55  -6.067  -3.545  -9.138
  437    HA   LYS  55           HA       LYS  55  -8.854  -4.199  -9.560
  438   1HB   LYS  55          HB2       LYS  55  -6.698  -4.750  -7.745
  439   2HB   LYS  55          HB1       LYS  55  -8.130  -4.320  -6.807
  440   1HG   LYS  55          HG2       LYS  55  -8.665  -6.518  -7.112
  441   2HG   LYS  55          HG1       LYS  55  -9.242  -5.948  -8.679
  442   1HD   LYS  55          HD2       LYS  55  -6.422  -6.935  -8.174
  443   2HD   LYS  55          HD1       LYS  55  -7.714  -7.938  -8.833
  444   1HE   LYS  55          HE2       LYS  55  -7.748  -5.569 -10.374
  445   2HE   LYS  55          HE1       LYS  55  -6.040  -6.028 -10.220
  446   1HZ   LYS  55          HZ1       LYS  55  -8.259  -7.854 -10.984
  447   2HZ   LYS  55          HZ2       LYS  55  -6.625  -8.294 -10.821
  448   3HZ   LYS  55          HZ3       LYS  55  -7.100  -7.219 -12.049
  449    H    LYS  56           HN       LYS  56 -10.608  -2.934  -9.160
  450    HA   LYS  56           HA       LYS  56 -10.487  -0.207  -8.410
  451   1HB   LYS  56          HB2       LYS  56 -12.614  -2.342  -8.460
  452   2HB   LYS  56          HB1       LYS  56 -13.002  -0.701  -7.942
  453   1HG   LYS  56          HG2       LYS  56 -11.414  -0.717 -10.390
  454   2HG   LYS  56          HG1       LYS  56 -12.924  -1.611 -10.579
  455   1HD   LYS  56          HD2       LYS  56 -14.240   0.271  -9.945
  456   2HD   LYS  56          HD1       LYS  56 -12.834   1.138  -9.327
  457   1HE   LYS  56          HE2       LYS  56 -11.958   1.480 -11.544
  458   2HE   LYS  56          HE1       LYS  56 -13.150   0.367 -12.246
  459   1HZ   LYS  56          HZ1       LYS  56 -14.033   2.524 -12.533
  460   2HZ   LYS  56          HZ2       LYS  56 -13.655   2.984 -10.941
  461   3HZ   LYS  56          HZ3       LYS  56 -14.887   1.850 -11.233
  462    H    TRP  57           HN       TRP  57 -11.377  -3.050  -6.404
  463    HA   TRP  57           HA       TRP  57 -11.976  -1.723  -4.005
  464   1HB   TRP  57          HB2       TRP  57 -11.894  -3.868  -3.108
  465   2HB   TRP  57          HB1       TRP  57 -11.964  -4.254  -4.823
  466    HD1  TRP  57           HD1      TRP  57  -9.944  -5.505  -5.861
  467    HE1  TRP  57           HE1      TRP  57  -7.706  -6.386  -4.929
  468    HE3  TRP  57           HE3      TRP  57  -9.987  -3.309  -1.255
  469    HZ2  TRP  57           HZ2      TRP  57  -6.143  -6.171  -2.540
  470    HZ3  TRP  57           HZ3      TRP  57  -8.116  -3.668   0.327
  471    HH2  TRP  57           HH2      TRP  57  -6.195  -5.096  -0.308
  472    H    VAL  58           HN       VAL  58  -8.798  -2.445  -5.397
  473    HA   VAL  58           HA       VAL  58  -7.181  -1.843  -3.104
  474    HB   VAL  58           HB       VAL  58  -6.682  -1.489  -6.080
  475   1HG1  VAL  58          HG1       VAL  58  -4.505  -1.042  -5.603
  476   2HG1  VAL  58          HG1       VAL  58  -4.460  -2.215  -4.287
  477   3HG1  VAL  58          HG1       VAL  58  -5.109  -0.600  -4.006
  478   1HG2  VAL  58          HG2       VAL  58  -7.395  -3.785  -4.902
  479   2HG2  VAL  58          HG2       VAL  58  -5.681  -3.811  -4.491
  480   3HG2  VAL  58          HG2       VAL  58  -6.183  -3.741  -6.179
  481    H    GLN  59           HN       GLN  59  -8.112   0.236  -5.887
  482    HA   GLN  59           HA       GLN  59  -6.961   2.654  -4.945
  483   1HB   GLN  59          HB2       GLN  59  -9.392   1.991  -6.636
  484   2HB   GLN  59          HB1       GLN  59  -8.804   3.642  -6.427
  485   1HG   GLN  59          HG2       GLN  59  -7.195   1.322  -7.536
  486   2HG   GLN  59          HG1       GLN  59  -7.879   2.645  -8.482
  487   1HE2  GLN  59          HE2       GLN  59  -7.231   4.936  -7.287
  488   2HE2  GLN  59          HE2       GLN  59  -5.571   5.071  -6.965
  489    H    LYS  60           HN       LYS  60  -9.955   0.992  -4.169
  490    HA   LYS  60           HA       LYS  60 -11.221   3.122  -2.719
  491   1HB   LYS  60          HB2       LYS  60 -11.908   0.657  -3.623
  492   2HB   LYS  60          HB1       LYS  60 -11.642   0.290  -1.919
  493   1HG   LYS  60          HG2       LYS  60 -13.949   0.903  -2.114
  494   2HG   LYS  60          HG1       LYS  60 -13.132   2.286  -1.385
  495   1HD   LYS  60          HD2       LYS  60 -13.442   3.609  -3.219
  496   2HD   LYS  60          HD1       LYS  60 -13.206   2.272  -4.346
  497   1HE   LYS  60          HE2       LYS  60 -15.443   1.962  -4.536
  498   2HE   LYS  60          HE1       LYS  60 -15.632   1.898  -2.773
  499   1HZ   LYS  60          HZ1       LYS  60 -15.328   4.364  -4.408
  500   2HZ   LYS  60          HZ2       LYS  60 -15.430   4.319  -2.712
  501   3HZ   LYS  60          HZ3       LYS  60 -16.757   3.841  -3.659
  502    H    TYR  61           HN       TYR  61  -8.947   0.530  -1.831
  503    HA   TYR  61           HA       TYR  61  -9.022   1.045   1.018
  504   1HB   TYR  61          HB2       TYR  61  -7.553  -0.571  -0.955
  505   2HB   TYR  61          HB1       TYR  61  -6.571  -0.092   0.431
  506    HD1  TYR  61           HD1      TYR  61 -10.157  -1.092  -0.076
  507    HD2  TYR  61           HD2      TYR  61  -6.502  -1.706   2.097
  508    HE1  TYR  61           HE1      TYR  61 -11.276  -2.814   1.314
  509    HE2  TYR  61           HE2      TYR  61  -7.621  -3.429   3.489
  510    HH   TYR  61           HH       TYR  61 -10.946  -3.808   3.622
  511    H    ILE  62           HN       ILE  62  -7.191   2.367  -1.693
  512    HA   ILE  62           HA       ILE  62  -5.140   3.693  -0.180
  513    HB   ILE  62           HB       ILE  62  -6.455   4.387  -2.830
  514   1HG1  ILE  62          HG1       ILE  62  -5.535   2.054  -2.657
  515   2HG1  ILE  62          HG1       ILE  62  -4.715   3.044  -3.860
  516   1HG2  ILE  62          HG2       ILE  62  -3.667   5.026  -2.699
  517   2HG2  ILE  62          HG2       ILE  62  -4.472   5.741  -1.302
  518   3HG2  ILE  62          HG2       ILE  62  -5.033   6.119  -2.929
  519   1HD1  ILE  62          HD1       ILE  62  -3.613   3.024  -1.079
  520   2HD1  ILE  62          HD1       ILE  62  -2.771   3.186  -2.617
  521   3HD1  ILE  62          HD1       ILE  62  -3.342   1.605  -2.086
  522    H    SER  63           HN       SER  63  -8.396   4.670  -1.229
  523    HA   SER  63           HA       SER  63  -8.164   7.363  -0.119
  524   1HB   SER  63          HB2       SER  63 -10.325   7.610  -1.020
  525   2HB   SER  63          HB1       SER  63  -9.618   6.379  -2.063
  526    HG   SER  63           HG       SER  63 -11.108   5.077  -1.383
  527    H    LEU  64           HN       LEU  64  -9.059   4.219   1.083
  528    HA   LEU  64           HA       LEU  64 -10.531   5.299   3.407
  529   1HB   LEU  64          HB2       LEU  64  -9.740   2.551   2.407
  530   2HB   LEU  64          HB1       LEU  64 -10.598   2.795   3.930
  531    HG   LEU  64           HG       LEU  64 -11.630   4.015   1.377
  532   1HD1  LEU  64          HD1       LEU  64 -12.922   2.051   0.914
  533   2HD1  LEU  64          HD1       LEU  64 -12.428   1.290   2.425
  534   3HD1  LEU  64          HD1       LEU  64 -11.259   1.505   1.124
  535   1HD2  LEU  64          HD2       LEU  64 -12.403   3.992   4.111
  536   2HD2  LEU  64          HD2       LEU  64 -13.584   3.013   3.242
  537   3HD2  LEU  64          HD2       LEU  64 -13.289   4.681   2.750
  538    H    LEU  65           HN       LEU  65  -7.490   3.517   2.782
  539    HA   LEU  65           HA       LEU  65  -6.533   3.246   5.410
  540   1HB   LEU  65          HB2       LEU  65  -5.448   3.430   2.665
  541   2HB   LEU  65          HB1       LEU  65  -4.287   3.782   3.944
  542    HG   LEU  65           HG       LEU  65  -4.280   1.380   3.400
  543   1HD1  LEU  65          HD1       LEU  65  -4.431   2.523   5.912
  544   2HD1  LEU  65          HD1       LEU  65  -3.963   0.855   5.581
  545   3HD1  LEU  65          HD1       LEU  65  -5.634   1.239   5.999
  546   1HD2  LEU  65          HD2       LEU  65  -6.380   0.085   4.084
  547   2HD2  LEU  65          HD2       LEU  65  -6.503   1.022   2.593
  548   3HD2  LEU  65          HD2       LEU  65  -7.217   1.638   4.085
  549    H    LYS  66           HN       LYS  66  -5.617   5.866   3.169
  550    HA   LYS  66           HA       LYS  66  -5.677   7.802   5.419
  551   1HB   LYS  66          HB2       LYS  66  -3.380   6.530   4.776
  552   2HB   LYS  66          HB1       LYS  66  -3.306   7.858   3.618
  553   1HG   LYS  66          HG2       LYS  66  -2.358   8.970   5.374
  554   2HG   LYS  66          HG1       LYS  66  -4.039   9.220   5.844
  555   1HD   LYS  66          HD2       LYS  66  -3.209   8.322   7.810
  556   2HD   LYS  66          HD1       LYS  66  -3.715   6.844   6.990
  557   1HE   LYS  66          HE2       LYS  66  -1.578   6.105   7.157
  558   2HE   LYS  66          HE1       LYS  66  -1.093   7.411   6.056
  559   1HZ   LYS  66          HZ1       LYS  66  -1.255   8.891   8.107
  560   2HZ   LYS  66          HZ2       LYS  66   0.085   7.850   8.010
  561   3HZ   LYS  66          HZ3       LYS  66  -1.230   7.457   9.011
  562    H    THR  67           HN       THR  67  -4.804  10.046   4.218
  563    HA   THR  67           HA       THR  67  -6.875  10.818   2.427
  564    HB   THR  67           HB       THR  67  -5.572  12.381   3.777
  565    HG1  THR  67           HG1      THR  67  -4.985  13.844   2.086
  566   1HG2  THR  67          HG2       THR  67  -3.391  11.824   4.025
  567   2HG2  THR  67          HG2       THR  67  -3.142  12.720   2.526
  568   3HG2  THR  67          HG2       THR  67  -3.343  10.969   2.484
  569    HA   PRO  68           HA       PRO  68  -5.443   9.196  -1.402
  570   1HB   PRO  68          HB2       PRO  68  -6.614  10.954  -3.149
  571   2HB   PRO  68          HB1       PRO  68  -7.511   9.688  -2.287
  572   1HG   PRO  68          HG2       PRO  68  -7.335  12.599  -1.722
  573   2HG   PRO  68          HG1       PRO  68  -8.698  11.489  -1.534
  574   1HD   PRO  68          HD2       PRO  68  -7.129  12.368   0.540
  575   2HD   PRO  68          HD1       PRO  68  -8.061  10.856   0.558
  576    H    LYS  69           HN       LYS  69  -5.442  12.773  -1.792
  577    HA   LYS  69           HA       LYS  69  -2.548  12.951  -1.863
  578   1HB   LYS  69          HB2       LYS  69  -3.482  11.721  -4.026
  579   2HB   LYS  69          HB1       LYS  69  -3.818  13.372  -4.546
  580   1HG   LYS  69          HG2       LYS  69  -1.622  12.889  -5.343
  581   2HG   LYS  69          HG1       LYS  69  -1.395  13.911  -3.922
  582   1HD   LYS  69          HD2       LYS  69  -0.065  12.294  -3.087
  583   2HD   LYS  69          HD1       LYS  69  -1.511  11.300  -2.908
  584   1HE   LYS  69          HE2       LYS  69  -0.309  11.394  -5.635
  585   2HE   LYS  69          HE1       LYS  69   0.588  10.494  -4.395
  586   1HZ   LYS  69          HZ1       LYS  69  -1.190   9.191  -5.566
  587   2HZ   LYS  69          HZ2       LYS  69  -2.334  10.199  -4.817
  588   3HZ   LYS  69          HZ3       LYS  69  -1.317   9.217  -3.875
  589    H    GLN  70           HN       GLN  70  -4.744  14.413  -0.643
  590    HA   GLN  70           HA       GLN  70  -5.038  16.932  -2.143
  591   1HB   GLN  70          HB2       GLN  70  -6.137  15.586   0.255
  592   2HB   GLN  70          HB1       GLN  70  -6.065  17.346   0.355
  593   1HG   GLN  70          HG2       GLN  70  -7.154  17.367  -1.967
  594   2HG   GLN  70          HG1       GLN  70  -7.499  15.659  -1.700
  595   1HE2  GLN  70          HE2       GLN  70  -9.503  17.833  -1.889
  596   2HE2  GLN  70          HE2       GLN  70 -10.325  17.854  -0.405
  597    H    LEU  71           HN       LEU  71  -3.759  18.725  -1.824
  598    HA   LEU  71           HA       LEU  71  -2.308  19.152   0.695
  599   1HB   LEU  71          HB2       LEU  71  -1.075  17.423  -0.805
  600   2HB   LEU  71          HB1       LEU  71  -0.686  18.808  -1.828
  601    HG   LEU  71           HG       LEU  71   0.037  19.875   0.502
  602   1HD1  LEU  71          HD1       LEU  71  -0.568  17.192   1.204
  603   2HD1  LEU  71          HD1       LEU  71   0.166  18.430   2.223
  604   3HD1  LEU  71          HD1       LEU  71   1.187  17.353   1.271
  605   1HD2  LEU  71          HD2       LEU  71   2.062  19.762  -0.489
  606   2HD2  LEU  71          HD2       LEU  71   1.342  18.687  -1.687
  607   3HD2  LEU  71          HD2       LEU  71   2.133  18.015  -0.261
  Start of MODEL   16
    1   1H    THR   1          HT1       THR   1   1.968  13.581  -8.600
    2   2H    THR   1          HT2       THR   1   2.866  13.477  -7.162
    3   3H    THR   1          HT3       THR   1   3.281  12.511  -8.498
    4    HA   THR   1           HA       THR   1   3.751  14.612  -9.764
    5    HB   THR   1           HB       THR   1   3.768  15.863  -7.025
    6    HG1  THR   1           HG1      THR   1   1.636  16.549  -7.453
    7   1HG2  THR   1          HG2       THR   1   3.095  17.830  -8.637
    8   2HG2  THR   1          HG2       THR   1   3.726  16.759  -9.889
    9   3HG2  THR   1          HG2       THR   1   4.772  17.288  -8.570
   10    H    ARG   2           HN       ARG   2   4.814  14.180  -6.355
   11    HA   ARG   2           HA       ARG   2   7.440  13.189  -7.297
   12   1HB   ARG   2          HB2       ARG   2   6.982  15.905  -6.916
   13   2HB   ARG   2          HB1       ARG   2   7.721  15.402  -5.395
   14   1HG   ARG   2          HG2       ARG   2   9.707  15.551  -6.460
   15   2HG   ARG   2          HG1       ARG   2   9.234  14.087  -7.325
   16   1HD   ARG   2          HD2       ARG   2   7.958  15.758  -8.912
   17   2HD   ARG   2          HD1       ARG   2   9.096  16.947  -8.246
   18    HE   ARG   2           HE       ARG   2  10.841  15.027  -8.839
   19   1HH1  ARG   2          HH1       ARG   2   8.454  13.820 -10.449
   20   2HH1  ARG   2          HH1       ARG   2   8.893  14.321 -12.048
   21   1HH2  ARG   2          HH2       ARG   2  11.244  16.628 -10.967
   22   2HH2  ARG   2          HH2       ARG   2  10.472  15.909 -12.341
   23    H    GLY   3           HN       GLY   3   6.843  11.284  -6.061
   24   1HA   GLY   3          HA2       GLY   3   6.934  11.722  -3.102
   25   2HA   GLY   3          HA1       GLY   3   5.920  10.479  -3.835
   26    H    SER   4           HN       SER   4   9.057  11.215  -2.667
   27    HA   SER   4           HA       SER   4   9.905   8.423  -3.079
   28   1HB   SER   4          HB2       SER   4  10.464  10.326  -5.020
   29   2HB   SER   4          HB1       SER   4  11.936  10.307  -4.052
   30    HG   SER   4           HG       SER   4  12.220   8.676  -5.458
   31    H    ASP   5           HN       ASP   5  10.282   8.192  -0.855
   32    HA   ASP   5           HA       ASP   5  12.638   9.572   0.239
   33   1HB   ASP   5          HB2       ASP   5  10.197  10.773   0.523
   34   2HB   ASP   5          HB1       ASP   5  10.256   9.785   1.983
   35    H    ILE   6           HN       ILE   6   9.779   7.860   1.568
   36    HA   ILE   6           HA       ILE   6  11.665   5.800   2.673
   37    HB   ILE   6           HB       ILE   6   9.040   6.843   3.789
   38   1HG1  ILE   6          HG1       ILE   6  11.834   7.346   4.842
   39   2HG1  ILE   6          HG1       ILE   6  11.025   8.461   3.739
   40   1HG2  ILE   6          HG2       ILE   6  10.111   5.700   5.884
   41   2HG2  ILE   6          HG2       ILE   6  11.065   4.812   4.696
   42   3HG2  ILE   6          HG2       ILE   6   9.305   4.694   4.682
   43   1HD1  ILE   6          HD1       ILE   6   9.301   7.658   5.958
   44   2HD1  ILE   6          HD1       ILE   6   9.702   9.275   5.381
   45   3HD1  ILE   6          HD1       ILE   6  10.776   8.450   6.510
   46    H    SER   7           HN       SER   7  10.544   5.475   0.099
   47    HA   SER   7           HA       SER   7   8.621   3.248   0.603
   48   1HB   SER   7          HB2       SER   7   7.990   5.689  -0.489
   49   2HB   SER   7          HB1       SER   7   8.348   4.739  -1.928
   50    HG   SER   7           HG       SER   7   6.233   4.365  -1.479
   51    H    LYS   8           HN       LYS   8  11.624   3.515  -0.010
   52    HA   LYS   8           HA       LYS   8  12.048   2.579  -2.709
   53   1HB   LYS   8          HB2       LYS   8  14.317   2.054  -1.774
   54   2HB   LYS   8          HB1       LYS   8  13.775   3.692  -1.407
   55   1HG   LYS   8          HG2       LYS   8  13.349   3.192   0.836
   56   2HG   LYS   8          HG1       LYS   8  13.194   1.463   0.524
   57   1HD   LYS   8          HD2       LYS   8  15.802   2.190  -0.302
   58   2HD   LYS   8          HD1       LYS   8  15.546   2.950   1.269
   59   1HE   LYS   8          HE2       LYS   8  14.685   0.096   0.934
   60   2HE   LYS   8          HE1       LYS   8  16.414   0.442   1.135
   61   1HZ   LYS   8          HZ1       LYS   8  14.380   1.711   2.862
   62   2HZ   LYS   8          HZ2       LYS   8  16.047   1.536   3.142
   63   3HZ   LYS   8          HZ3       LYS   8  15.018   0.188   3.245
   64    H    THR   9           HN       THR   9  10.133   0.932  -2.355
   65    HA   THR   9           HA       THR   9  11.402  -1.708  -1.871
   66    HB   THR   9           HB       THR   9   8.727  -1.060  -0.665
   67    HG1  THR   9           HG1      THR   9   9.952  -0.566   1.268
   68   1HG2  THR   9          HG2       THR   9   9.541  -3.392  -0.764
   69   2HG2  THR   9          HG2       THR   9   9.408  -2.823   0.900
   70   3HG2  THR   9          HG2       THR   9  10.988  -2.913   0.121
   71    H    CYS  10           HN       CYS  10  10.716  -3.133  -3.444
   72    HA   CYS  10           HA       CYS  10   8.650  -2.255  -5.357
   73   1HB   CYS  10          HB2       CYS  10  10.818  -4.280  -5.146
   74   2HB   CYS  10          HB1       CYS  10   9.452  -4.715  -6.172
   75    H    CYS  11           HN       CYS  11   7.471  -4.608  -6.131
   76    HA   CYS  11           HA       CYS  11   6.288  -5.865  -3.706
   77   1HB   CYS  11          HB2       CYS  11   5.008  -3.993  -5.639
   78   2HB   CYS  11          HB1       CYS  11   4.041  -5.368  -5.106
   79    H    PHE  12           HN       PHE  12   6.626  -8.016  -4.180
   80    HA   PHE  12           HA       PHE  12   6.064  -8.937  -6.965
   81   1HB   PHE  12          HB2       PHE  12   7.635 -10.823  -6.302
   82   2HB   PHE  12          HB1       PHE  12   8.384  -9.230  -6.386
   83    HD1  PHE  12           HD1      PHE  12   7.165 -11.885  -4.129
   84    HD2  PHE  12           HD2      PHE  12   9.114  -8.065  -4.384
   85    HE1  PHE  12           HE1      PHE  12   7.865 -12.082  -1.759
   86    HE2  PHE  12           HE2      PHE  12   9.813  -8.262  -2.014
   87    HZ   PHE  12           HZ       PHE  12   9.188 -10.271  -0.700
   88    H    GLN  13           HN       GLN  13   3.957  -8.616  -5.101
   89    HA   GLN  13           HA       GLN  13   2.808 -11.282  -5.103
   90   1HB   GLN  13          HB2       GLN  13   4.539 -11.082  -3.145
   91   2HB   GLN  13          HB1       GLN  13   3.285 -10.114  -2.366
   92   1HG   GLN  13          HG2       GLN  13   2.412 -12.076  -1.664
   93   2HG   GLN  13          HG1       GLN  13   1.884 -12.303  -3.332
   94   1HE2  GLN  13          HE2       GLN  13   4.038 -13.485  -0.880
   95   2HE2  GLN  13          HE2       GLN  13   4.836 -14.636  -1.837
   96    H    TYR  14           HN       TYR  14   0.577 -11.021  -5.117
   97    HA   TYR  14           HA       TYR  14  -0.528  -8.472  -4.025
   98   1HB   TYR  14          HB2       TYR  14  -1.225  -9.824  -6.651
   99   2HB   TYR  14          HB1       TYR  14  -1.900  -8.306  -6.056
  100    HD1  TYR  14           HD1      TYR  14   0.272  -6.779  -5.037
  101    HD2  TYR  14           HD2      TYR  14   0.249  -9.430  -8.418
  102    HE1  TYR  14           HE1      TYR  14   2.182  -5.542  -6.021
  103    HE2  TYR  14           HE2      TYR  14   2.160  -8.191  -9.401
  104    HH   TYR  14           HH       TYR  14   3.033  -5.254  -8.638
  105    H    SER  15           HN       SER  15  -2.076  -8.958  -2.530
  106    HA   SER  15           HA       SER  15  -3.246 -11.654  -2.410
  107   1HB   SER  15          HB2       SER  15  -2.668  -9.449  -0.669
  108   2HB   SER  15          HB1       SER  15  -4.385  -9.826  -0.536
  109    HG   SER  15           HG       SER  15  -3.884 -11.628   0.419
  110    H    HIS  16           HN       HIS  16  -5.795 -11.053  -1.407
  111    HA   HIS  16           HA       HIS  16  -7.262  -9.249  -3.161
  112   1HB   HIS  16          HB2       HIS  16  -8.384 -11.055  -4.441
  113   2HB   HIS  16          HB1       HIS  16  -6.643 -11.057  -4.722
  114    HD1  HIS  16           HD1      HIS  16  -5.247 -12.842  -3.241
  115    HD2  HIS  16           HD2      HIS  16  -9.368 -13.447  -3.414
  116    HE1  HIS  16           HE1      HIS  16  -5.654 -15.218  -2.466
  117    H    LYS  17           HN       LYS  17  -7.644  -9.002  -0.636
  118    HA   LYS  17           HA       LYS  17 -10.281 -10.163  -0.069
  119   1HB   LYS  17          HB2       LYS  17  -7.750 -11.193   1.025
  120   2HB   LYS  17          HB1       LYS  17  -8.953 -10.823   2.261
  121   1HG   LYS  17          HG2       LYS  17 -10.264 -12.132   0.071
  122   2HG   LYS  17          HG1       LYS  17  -8.863 -13.092   0.548
  123   1HD   LYS  17          HD2       LYS  17  -9.710 -12.691   2.980
  124   2HD   LYS  17          HD1       LYS  17 -11.241 -12.281   2.205
  125   1HE   LYS  17          HE2       LYS  17  -9.831 -14.823   1.416
  126   2HE   LYS  17          HE1       LYS  17 -10.803 -14.781   2.898
  127   1HZ   LYS  17          HZ1       LYS  17 -12.095 -13.461   0.694
  128   2HZ   LYS  17          HZ2       LYS  17 -12.688 -14.668   1.733
  129   3HZ   LYS  17          HZ3       LYS  17 -11.779 -15.095   0.364
  130    HA   PRO  18           HA       PRO  18 -10.494  -6.278   2.014
  131   1HB   PRO  18          HB2       PRO  18 -12.701  -6.713   3.573
  132   2HB   PRO  18          HB1       PRO  18 -12.795  -6.434   1.821
  133   1HG   PRO  18          HG2       PRO  18 -12.951  -8.981   3.343
  134   2HG   PRO  18          HG1       PRO  18 -13.841  -8.467   1.902
  135   1HD   PRO  18          HD2       PRO  18 -11.710 -10.180   1.840
  136   2HD   PRO  18          HD1       PRO  18 -12.184  -9.140   0.479
  137    H    LEU  19           HN       LEU  19  -8.751  -6.117   3.431
  138    HA   LEU  19           HA       LEU  19  -8.366  -7.829   5.741
  139   1HB   LEU  19          HB2       LEU  19  -6.890  -6.089   4.202
  140   2HB   LEU  19          HB1       LEU  19  -7.110  -5.159   5.683
  141    HG   LEU  19           HG       LEU  19  -6.454  -7.952   6.226
  142   1HD1  LEU  19          HD1       LEU  19  -4.926  -8.194   4.561
  143   2HD1  LEU  19          HD1       LEU  19  -3.933  -7.116   5.543
  144   3HD1  LEU  19          HD1       LEU  19  -4.892  -6.466   4.214
  145   1HD2  LEU  19          HD2       LEU  19  -4.912  -5.441   6.918
  146   2HD2  LEU  19          HD2       LEU  19  -4.991  -6.951   7.826
  147   3HD2  LEU  19          HD2       LEU  19  -6.397  -5.889   7.756
  148    HA   PRO  20           HA       PRO  20 -10.971  -5.720   8.617
  149   1HB   PRO  20          HB2       PRO  20  -9.614  -6.237  10.947
  150   2HB   PRO  20          HB1       PRO  20 -10.592  -7.451  10.104
  151   1HG   PRO  20          HG2       PRO  20  -7.641  -7.046  10.072
  152   2HG   PRO  20          HG1       PRO  20  -8.571  -8.551  10.142
  153   1HD   PRO  20          HD2       PRO  20  -7.435  -7.644   7.863
  154   2HD   PRO  20          HD1       PRO  20  -8.946  -8.579   7.871
  155    H    TRP  21           HN       TRP  21 -10.915  -3.521   8.479
  156    HA   TRP  21           HA       TRP  21  -8.773  -1.786   8.272
  157   1HB   TRP  21          HB2       TRP  21 -11.486  -1.480   9.568
  158   2HB   TRP  21          HB1       TRP  21 -10.426  -0.110   9.219
  159    HD1  TRP  21           HD1      TRP  21 -12.703  -2.626   7.573
  160    HE1  TRP  21           HE1      TRP  21 -12.878  -2.102   5.054
  161    HE3  TRP  21           HE3      TRP  21  -9.065   0.926   7.163
  162    HZ2  TRP  21           HZ2      TRP  21 -11.625  -0.400   3.122
  163    HZ3  TRP  21           HZ3      TRP  21  -8.578   1.984   4.979
  164    HH2  TRP  21           HH2      TRP  21  -9.853   1.325   2.957
  165    H    THR  22           HN       THR  22 -10.151  -3.010  11.330
  166    HA   THR  22           HA       THR  22  -8.805  -1.334  13.158
  167    HB   THR  22           HB       THR  22 -10.512  -3.022  13.692
  168    HG1  THR  22           HG1      THR  22  -9.401  -3.925  15.520
  169   1HG2  THR  22          HG2       THR  22  -8.344  -5.081  13.268
  170   2HG2  THR  22          HG2       THR  22  -9.579  -4.709  12.066
  171   3HG2  THR  22          HG2       THR  22 -10.045  -5.373  13.630
  172    H    TRP  23           HN       TRP  23  -7.633  -4.250  11.486
  173    HA   TRP  23           HA       TRP  23  -4.965  -3.992  12.727
  174   1HB   TRP  23          HB2       TRP  23  -6.576  -5.974  11.258
  175   2HB   TRP  23          HB1       TRP  23  -4.862  -5.998  10.850
  176    HD1  TRP  23           HD1      TRP  23  -6.269  -5.135  14.316
  177    HE1  TRP  23           HE1      TRP  23  -5.392  -6.873  16.008
  178    HE3  TRP  23           HE3      TRP  23  -3.901  -8.346  11.131
  179    HZ2  TRP  23           HZ2      TRP  23  -3.883  -9.305  16.008
  180    HZ3  TRP  23           HZ3      TRP  23  -2.752 -10.362  12.001
  181    HH2  TRP  23           HH2      TRP  23  -2.740 -10.845  14.433
  182    H    VAL  24           HN       VAL  24  -6.477  -2.409  10.266
  183    HA   VAL  24           HA       VAL  24  -4.198  -2.508   8.370
  184    HB   VAL  24           HB       VAL  24  -6.929  -1.193   8.268
  185   1HG1  VAL  24          HG1       VAL  24  -6.374  -0.311   6.243
  186   2HG1  VAL  24          HG1       VAL  24  -5.426  -1.726   5.782
  187   3HG1  VAL  24          HG1       VAL  24  -4.714  -0.485   6.814
  188   1HG2  VAL  24          HG2       VAL  24  -6.081  -3.901   7.929
  189   2HG2  VAL  24          HG2       VAL  24  -6.507  -3.273   6.336
  190   3HG2  VAL  24          HG2       VAL  24  -7.685  -3.229   7.646
  191    H    ARG  25           HN       ARG  25  -2.659  -0.910   8.436
  192    HA   ARG  25           HA       ARG  25  -3.134   1.425  10.211
  193   1HB   ARG  25          HB2       ARG  25  -1.132   0.009  10.471
  194   2HB   ARG  25          HB1       ARG  25  -0.664   0.360   8.806
  195   1HG   ARG  25          HG2       ARG  25   0.418   2.186   9.557
  196   2HG   ARG  25          HG1       ARG  25  -1.143   2.865  10.016
  197   1HD   ARG  25          HD2       ARG  25  -0.565   2.690  12.198
  198   2HD   ARG  25          HD1       ARG  25  -0.389   0.935  12.005
  199    HE   ARG  25           HE       ARG  25   1.930   1.634  10.952
  200   1HH1  ARG  25          HH1       ARG  25   1.099   1.616  14.078
  201   2HH1  ARG  25          HH1       ARG  25   2.158   2.879  14.611
  202   1HH2  ARG  25          HH2       ARG  25   2.949   3.936  11.405
  203   2HH2  ARG  25          HH2       ARG  25   3.205   4.192  13.099
  204    H    SER  26           HN       SER  26  -1.579   0.955   6.991
  205    HA   SER  26           HA       SER  26  -3.112   3.217   5.887
  206   1HB   SER  26          HB2       SER  26  -1.132   4.625   5.580
  207   2HB   SER  26          HB1       SER  26  -1.309   4.230   7.286
  208    HG   SER  26           HG       SER  26   0.806   3.872   5.893
  209    H    TYR  27           HN       TYR  27  -1.204   3.800   3.818
  210    HA   TYR  27           HA       TYR  27  -0.661   1.198   2.511
  211   1HB   TYR  27          HB2       TYR  27  -2.411   1.356   1.052
  212   2HB   TYR  27          HB1       TYR  27  -3.068   2.522   2.189
  213    HD1  TYR  27           HD1      TYR  27  -1.848   1.997  -1.147
  214    HD2  TYR  27           HD2      TYR  27  -2.465   5.001   1.859
  215    HE1  TYR  27           HE1      TYR  27  -1.709   3.762  -2.882
  216    HE2  TYR  27           HE2      TYR  27  -2.327   6.767   0.125
  217    HH   TYR  27           HH       TYR  27  -1.457   7.108  -2.084
  218    H    GLU  28           HN       GLU  28   0.191   1.882   0.103
  219    HA   GLU  28           HA       GLU  28   1.513   4.404  -0.227
  220   1HB   GLU  28          HB2       GLU  28   3.841   3.589   0.279
  221   2HB   GLU  28          HB1       GLU  28   2.811   3.674   1.706
  222   1HG   GLU  28          HG2       GLU  28   2.385   1.285   1.606
  223   2HG   GLU  28          HG1       GLU  28   3.262   1.159   0.081
  224    H    PHE  29           HN       PHE  29   2.384   4.511  -2.322
  225    HA   PHE  29           HA       PHE  29   1.951   2.139  -4.037
  226   1HB   PHE  29          HB2       PHE  29   1.540   4.846  -4.276
  227   2HB   PHE  29          HB1       PHE  29   3.047   4.636  -5.167
  228    HD1  PHE  29           HD1      PHE  29  -0.518   4.263  -5.256
  229    HD2  PHE  29           HD2      PHE  29   3.136   2.758  -6.940
  230    HE1  PHE  29           HE1      PHE  29  -1.784   3.340  -7.177
  231    HE2  PHE  29           HE2      PHE  29   1.869   1.834  -8.862
  232    HZ   PHE  29           HZ       PHE  29  -0.592   2.124  -8.981
  233    H    THR  30           HN       THR  30   3.655   1.280  -5.396
  234    HA   THR  30           HA       THR  30   6.244   1.077  -4.162
  235    HB   THR  30           HB       THR  30   6.745   0.005  -6.451
  236    HG1  THR  30           HG1      THR  30   5.084   1.298  -7.489
  237   1HG2  THR  30          HG2       THR  30   4.723  -1.710  -5.962
  238   2HG2  THR  30          HG2       THR  30   4.695  -0.795  -4.454
  239   3HG2  THR  30          HG2       THR  30   6.167  -1.628  -4.953
  240    H    SER  31           HN       SER  31   8.259   1.526  -5.723
  241    HA   SER  31           HA       SER  31   8.301   4.425  -6.180
  242   1HB   SER  31          HB2       SER  31  10.709   3.943  -6.595
  243   2HB   SER  31          HB1       SER  31  10.147   3.222  -5.089
  244    HG   SER  31           HG       SER  31  11.204   1.617  -6.139
  245    H    ASN  32           HN       ASN  32   9.797   4.894  -8.337
  246    HA   ASN  32           HA       ASN  32   8.088   4.015 -10.589
  247   1HB   ASN  32          HB2       ASN  32   8.949   6.406  -9.972
  248   2HB   ASN  32          HB1       ASN  32  10.455   5.877 -10.723
  249   1HD2  ASN  32          HD2       ASN  32   8.605   7.951 -11.769
  250   2HD2  ASN  32          HD2       ASN  32   8.088   7.401 -13.290
  251    H    SER  33           HN       SER  33  11.545   3.972  -9.673
  252    HA   SER  33           HA       SER  33  12.508   2.620 -12.003
  253   1HB   SER  33          HB2       SER  33  13.753   3.872 -10.146
  254   2HB   SER  33          HB1       SER  33  13.586   2.408  -9.181
  255    HG   SER  33           HG       SER  33  15.473   2.135 -10.223
  256    H    CYS  34           HN       CYS  34  10.632   1.472  -9.335
  257    HA   CYS  34           HA       CYS  34  11.437  -1.189  -8.992
  258   1HB   CYS  34          HB2       CYS  34   9.618   0.109  -7.818
  259   2HB   CYS  34          HB1       CYS  34   8.591  -0.162  -9.227
  260    H    SER  35           HN       SER  35  10.804  -3.167 -10.037
  261    HA   SER  35           HA       SER  35  10.550  -2.969 -12.946
  262   1HB   SER  35          HB2       SER  35  10.853  -5.136 -10.878
  263   2HB   SER  35          HB1       SER  35  10.512  -5.553 -12.554
  264    HG   SER  35           HG       SER  35  12.378  -4.442 -13.158
  265    H    GLN  36           HN       GLN  36   8.341  -3.253 -10.307
  266    HA   GLN  36           HA       GLN  36   6.115  -3.681 -12.232
  267   1HB   GLN  36          HB2       GLN  36   7.238  -5.736 -10.727
  268   2HB   GLN  36          HB1       GLN  36   5.826  -5.257  -9.783
  269   1HG   GLN  36          HG2       GLN  36   4.685  -5.266 -12.204
  270   2HG   GLN  36          HG1       GLN  36   5.965  -6.438 -12.521
  271   1HE2  GLN  36          HE2       GLN  36   6.134  -8.244 -10.769
  272   2HE2  GLN  36          HE2       GLN  36   4.673  -8.824 -10.127
  273    H    ARG  37           HN       ARG  37   5.415  -1.530 -11.746
  274    HA   ARG  37           HA       ARG  37   5.194  -0.361  -9.172
  275   1HB   ARG  37          HB2       ARG  37   3.489   1.073 -10.338
  276   2HB   ARG  37          HB1       ARG  37   4.976   0.869 -11.267
  277   1HG   ARG  37          HG2       ARG  37   3.198  -1.292 -11.904
  278   2HG   ARG  37          HG1       ARG  37   2.321   0.231 -12.070
  279   1HD   ARG  37          HD2       ARG  37   5.038   0.389 -13.164
  280   2HD   ARG  37          HD1       ARG  37   4.034  -0.827 -13.980
  281    HE   ARG  37           HE       ARG  37   2.267   1.038 -14.112
  282   1HH1  ARG  37          HH1       ARG  37   4.362   1.395 -16.195
  283   2HH1  ARG  37          HH1       ARG  37   4.849   3.040 -15.956
  284   1HH2  ARG  37          HH2       ARG  37   3.449   3.276 -12.794
  285   2HH2  ARG  37          HH2       ARG  37   4.333   4.105 -14.032
  286    H    ALA  38           HN       ALA  38   3.747  -0.693  -7.508
  287    HA   ALA  38           HA       ALA  38   1.125  -1.929  -8.018
  288   1HB   ALA  38          HB1       ALA  38   2.455  -3.429  -5.939
  289   2HB   ALA  38          HB2       ALA  38   3.426  -3.458  -7.411
  290   3HB   ALA  38          HB3       ALA  38   1.755  -4.021  -7.447
  291    H    VAL  39           HN       VAL  39  -0.284  -1.739  -6.155
  292    HA   VAL  39           HA       VAL  39   0.470   0.452  -4.327
  293    HB   VAL  39           HB       VAL  39  -2.046  -1.163  -4.848
  294   1HG1  VAL  39          HG1       VAL  39  -1.669   1.269  -3.069
  295   2HG1  VAL  39          HG1       VAL  39  -1.987  -0.370  -2.501
  296   3HG1  VAL  39          HG1       VAL  39  -3.208   0.489  -3.437
  297   1HG2  VAL  39          HG2       VAL  39  -1.032   0.601  -6.509
  298   2HG2  VAL  39          HG2       VAL  39  -1.652   1.776  -5.350
  299   3HG2  VAL  39          HG2       VAL  39  -2.756   0.654  -6.143
  300    H    ILE  40           HN       ILE  40   0.063   0.165  -1.945
  301    HA   ILE  40           HA       ILE  40   0.331  -2.662  -1.023
  302    HB   ILE  40           HB       ILE  40   2.127  -0.282  -0.520
  303   1HG1  ILE  40          HG1       ILE  40   3.012  -3.084  -1.096
  304   2HG1  ILE  40          HG1       ILE  40   2.376  -2.103  -2.416
  305   1HG2  ILE  40          HG2       ILE  40   1.562  -1.365   1.655
  306   2HG2  ILE  40          HG2       ILE  40   3.260  -1.559   1.219
  307   3HG2  ILE  40          HG2       ILE  40   2.136  -2.901   1.003
  308   1HD1  ILE  40          HD1       ILE  40   4.205  -0.524  -0.852
  309   2HD1  ILE  40          HD1       ILE  40   4.311  -0.969  -2.554
  310   3HD1  ILE  40          HD1       ILE  40   4.987  -2.033  -1.322
  311    H    PHE  41           HN       PHE  41  -0.429  -2.984   1.124
  312    HA   PHE  41           HA       PHE  41  -1.873  -0.673   2.379
  313   1HB   PHE  41          HB2       PHE  41  -2.705  -3.554   1.902
  314   2HB   PHE  41          HB1       PHE  41  -3.563  -2.489   3.017
  315    HD1  PHE  41           HD1      PHE  41  -3.735   0.056   1.804
  316    HD2  PHE  41           HD2      PHE  41  -3.857  -3.785  -0.109
  317    HE1  PHE  41           HE1      PHE  41  -4.991   1.044  -0.092
  318    HE2  PHE  41           HE2      PHE  41  -5.113  -2.799  -2.008
  319    HZ   PHE  41           HZ       PHE  41  -5.680  -0.384  -1.999
  320    H    THR  42           HN       THR  42  -0.707  -0.312   4.269
  321    HA   THR  42           HA       THR  42   0.753  -2.530   5.517
  322    HB   THR  42           HB       THR  42   0.556   0.145   6.803
  323    HG1  THR  42           HG1      THR  42   0.907   1.140   5.006
  324   1HG2  THR  42          HG2       THR  42   2.572  -1.978   6.265
  325   2HG2  THR  42          HG2       THR  42   2.261  -1.067   7.743
  326   3HG2  THR  42          HG2       THR  42   3.162  -0.324   6.421
  327    H    THR  43           HN       THR  43   0.364  -3.383   7.574
  328    HA   THR  43           HA       THR  43  -2.396  -3.018   8.603
  329    HB   THR  43           HB       THR  43  -1.819  -5.105   9.845
  330    HG1  THR  43           HG1      THR  43   0.207  -5.493  10.099
  331   1HG2  THR  43          HG2       THR  43  -1.875  -6.531   7.950
  332   2HG2  THR  43          HG2       THR  43  -0.984  -5.377   6.957
  333   3HG2  THR  43          HG2       THR  43  -2.653  -5.040   7.419
  334    H    LYS  44           HN       LYS  44  -2.395  -3.362  11.169
  335    HA   LYS  44           HA       LYS  44  -0.872  -1.096  12.282
  336   1HB   LYS  44          HB2       LYS  44  -3.088  -2.935  13.180
  337   2HB   LYS  44          HB1       LYS  44  -2.328  -1.812  14.308
  338   1HG   LYS  44          HG2       LYS  44  -2.872  -0.349  11.936
  339   2HG   LYS  44          HG1       LYS  44  -4.330  -1.265  12.318
  340   1HD   LYS  44          HD2       LYS  44  -4.402  -0.350  14.554
  341   2HD   LYS  44          HD1       LYS  44  -2.825   0.412  14.344
  342   1HE   LYS  44          HE2       LYS  44  -4.415   1.310  12.177
  343   2HE   LYS  44          HE1       LYS  44  -5.417   1.459  13.635
  344   1HZ   LYS  44          HZ1       LYS  44  -2.609   2.397  13.370
  345   2HZ   LYS  44          HZ2       LYS  44  -3.572   2.528  14.763
  346   3HZ   LYS  44          HZ3       LYS  44  -3.979   3.396  13.361
  347    H    ARG  45           HN       ARG  45  -0.639  -4.556  12.193
  348    HA   ARG  45           HA       ARG  45   0.906  -4.821  14.669
  349   1HB   ARG  45          HB2       ARG  45  -0.648  -6.485  13.333
  350   2HB   ARG  45          HB1       ARG  45   0.831  -6.826  12.434
  351   1HG   ARG  45          HG2       ARG  45   1.999  -7.384  14.517
  352   2HG   ARG  45          HG1       ARG  45   0.554  -6.991  15.449
  353   1HD   ARG  45          HD2       ARG  45  -0.071  -8.874  13.319
  354   2HD   ARG  45          HD1       ARG  45   1.191  -9.507  14.394
  355    HE   ARG  45           HE       ARG  45  -1.519  -8.621  15.273
  356   1HH1  ARG  45          HH1       ARG  45  -0.171 -11.419  15.482
  357   2HH1  ARG  45          HH1       ARG  45   0.155 -11.470  17.183
  358   1HH2  ARG  45          HH2       ARG  45  -0.351  -8.069  17.646
  359   2HH2  ARG  45          HH2       ARG  45   0.053  -9.572  18.408
  360    H    GLY  46           HN       GLY  46   1.698  -3.442  11.750
  361   1HA   GLY  46          HA2       GLY  46   3.899  -2.692  11.169
  362   2HA   GLY  46          HA1       GLY  46   4.573  -3.937  12.221
  363    H    LYS  47           HN       LYS  47   2.053  -4.773   9.964
  364    HA   LYS  47           HA       LYS  47   4.074  -6.278   8.362
  365   1HB   LYS  47          HB2       LYS  47   1.806  -7.076   9.812
  366   2HB   LYS  47          HB1       LYS  47   1.312  -7.152   8.120
  367   1HG   LYS  47          HG2       LYS  47   2.528  -9.018   7.801
  368   2HG   LYS  47          HG1       LYS  47   3.979  -8.213   8.396
  369   1HD   LYS  47          HD2       LYS  47   3.713  -9.008  10.542
  370   2HD   LYS  47          HD1       LYS  47   1.954  -9.055  10.418
  371   1HE   LYS  47          HE2       LYS  47   1.999 -11.087   9.150
  372   2HE   LYS  47          HE1       LYS  47   3.747 -10.955   8.876
  373   1HZ   LYS  47          HZ1       LYS  47   3.925 -10.907  11.393
  374   2HZ   LYS  47          HZ2       LYS  47   3.546 -12.404  10.687
  375   3HZ   LYS  47          HZ3       LYS  47   2.327 -11.474  11.420
  376    H    LYS  48           HN       LYS  48   4.304  -5.558   6.286
  377    HA   LYS  48           HA       LYS  48   2.166  -3.818   5.134
  378   1HB   LYS  48          HB2       LYS  48   4.512  -3.001   5.357
  379   2HB   LYS  48          HB1       LYS  48   5.044  -4.316   4.307
  380   1HG   LYS  48          HG2       LYS  48   4.379  -3.223   2.443
  381   2HG   LYS  48          HG1       LYS  48   2.818  -2.813   3.155
  382   1HD   LYS  48          HD2       LYS  48   3.570  -0.687   3.257
  383   2HD   LYS  48          HD1       LYS  48   4.619  -1.231   4.566
  384   1HE   LYS  48          HE2       LYS  48   5.338  -1.182   1.612
  385   2HE   LYS  48          HE1       LYS  48   5.998  -0.125   2.876
  386   1HZ   LYS  48          HZ1       LYS  48   7.529  -1.858   2.745
  387   2HZ   LYS  48          HZ2       LYS  48   6.327  -3.046   2.567
  388   3HZ   LYS  48          HZ3       LYS  48   6.560  -2.286   4.069
  389    H    VAL  49           HN       VAL  49   1.029  -4.495   3.338
  390    HA   VAL  49           HA       VAL  49   1.882  -7.082   2.065
  391    HB   VAL  49           HB       VAL  49  -0.898  -5.928   2.476
  392   1HG1  VAL  49          HG1       VAL  49   0.064  -8.640   1.512
  393   2HG1  VAL  49          HG1       VAL  49  -0.745  -7.416   0.532
  394   3HG1  VAL  49          HG1       VAL  49  -1.618  -8.221   1.837
  395   1HG2  VAL  49          HG2       VAL  49  -0.823  -8.166   3.990
  396   2HG2  VAL  49          HG2       VAL  49  -0.417  -6.573   4.628
  397   3HG2  VAL  49          HG2       VAL  49   0.864  -7.673   4.121
  398    H    CYS  50           HN       CYS  50   2.035  -7.070  -0.177
  399    HA   CYS  50           HA       CYS  50   1.773  -4.481  -1.562
  400   1HB   CYS  50          HB2       CYS  50   2.829  -7.238  -2.166
  401   2HB   CYS  50          HB1       CYS  50   2.614  -6.073  -3.470
  402    H    THR  51           HN       THR  51   0.511  -4.267  -3.545
  403    HA   THR  51           HA       THR  51  -1.546  -6.296  -4.147
  404    HB   THR  51           HB       THR  51  -3.298  -4.401  -3.785
  405    HG1  THR  51           HG1      THR  51  -2.177  -2.650  -3.313
  406   1HG2  THR  51          HG2       THR  51  -3.827  -5.390  -1.791
  407   2HG2  THR  51          HG2       THR  51  -2.195  -5.208  -1.149
  408   3HG2  THR  51          HG2       THR  51  -2.560  -6.514  -2.279
  409    H    HIS  52           HN       HIS  52  -3.010  -5.326  -5.988
  410    HA   HIS  52           HA       HIS  52  -1.217  -3.859  -7.857
  411   1HB   HIS  52          HB2       HIS  52  -2.850  -6.157  -8.010
  412   2HB   HIS  52          HB1       HIS  52  -3.645  -4.935  -9.002
  413    HD1  HIS  52           HD1      HIS  52   0.098  -5.365  -8.500
  414    HD2  HIS  52           HD2      HIS  52  -2.744  -5.676 -11.533
  415    HE1  HIS  52           HE1      HIS  52   1.383  -5.743 -10.650
  416    HA   PRO  53           HA       PRO  53  -3.932  -0.385  -7.583
  417   1HB   PRO  53          HB2       PRO  53  -3.172   0.944  -9.844
  418   2HB   PRO  53          HB1       PRO  53  -2.164   0.872  -8.386
  419   1HG   PRO  53          HG2       PRO  53  -1.902  -0.605 -10.938
  420   2HG   PRO  53          HG1       PRO  53  -0.652  -0.045  -9.819
  421   1HD   PRO  53          HD2       PRO  53  -1.587  -2.655 -10.021
  422   2HD   PRO  53          HD1       PRO  53  -0.692  -1.983  -8.643
  423    H    ARG  54           HN       ARG  54  -3.813  -2.347 -10.515
  424    HA   ARG  54           HA       ARG  54  -6.022  -1.250 -11.930
  425   1HB   ARG  54          HB2       ARG  54  -4.267  -3.009 -12.592
  426   2HB   ARG  54          HB1       ARG  54  -5.296  -4.181 -11.767
  427   1HG   ARG  54          HG2       ARG  54  -7.214  -3.227 -13.215
  428   2HG   ARG  54          HG1       ARG  54  -5.936  -2.513 -14.198
  429   1HD   ARG  54          HD2       ARG  54  -5.013  -4.666 -14.730
  430   2HD   ARG  54          HD1       ARG  54  -6.028  -5.468 -13.514
  431    HE   ARG  54           HE       ARG  54  -7.287  -3.997 -15.793
  432   1HH1  ARG  54          HH2       ARG  54  -6.196  -7.064 -15.191
  433   2HH1  ARG  54          HH2       ARG  54  -7.731  -7.853 -15.334
  434   1HH2  ARG  54          HH1       ARG  54  -9.541  -4.897 -15.408
  435   2HH2  ARG  54          HH1       ARG  54  -9.625  -6.626 -15.456
  436    H    LYS  55           HN       LYS  55  -5.916  -3.753  -9.383
  437    HA   LYS  55           HA       LYS  55  -8.616  -4.572  -9.417
  438   1HB   LYS  55          HB2       LYS  55  -6.303  -4.639  -7.675
  439   2HB   LYS  55          HB1       LYS  55  -7.774  -4.413  -6.727
  440   1HG   LYS  55          HG2       LYS  55  -8.348  -6.565  -7.034
  441   2HG   LYS  55          HG1       LYS  55  -8.257  -6.370  -8.784
  442   1HD   LYS  55          HD2       LYS  55  -5.759  -6.697  -7.128
  443   2HD   LYS  55          HD1       LYS  55  -6.673  -8.100  -7.681
  444   1HE   LYS  55          HE2       LYS  55  -6.093  -6.032  -9.744
  445   2HE   LYS  55          HE1       LYS  55  -4.714  -6.992  -9.173
  446   1HZ   LYS  55          HZ1       LYS  55  -5.814  -8.171 -10.946
  447   2HZ   LYS  55          HZ2       LYS  55  -7.313  -8.046 -10.157
  448   3HZ   LYS  55          HZ3       LYS  55  -6.075  -9.000  -9.490
  449    H    LYS  56           HN       LYS  56 -10.430  -3.334  -9.200
  450    HA   LYS  56           HA       LYS  56 -10.479  -0.589  -8.498
  451   1HB   LYS  56          HB2       LYS  56 -12.311  -2.789  -9.068
  452   2HB   LYS  56          HB1       LYS  56 -12.995  -1.648  -7.909
  453   1HG   LYS  56          HG2       LYS  56 -12.204   0.195  -9.528
  454   2HG   LYS  56          HG1       LYS  56 -12.009  -1.102 -10.709
  455   1HD   LYS  56          HD2       LYS  56 -14.267  -1.433 -10.922
  456   2HD   LYS  56          HD1       LYS  56 -14.584  -1.057  -9.228
  457   1HE   LYS  56          HE2       LYS  56 -14.923   1.162  -9.661
  458   2HE   LYS  56          HE1       LYS  56 -13.598   1.226 -10.841
  459   1HZ   LYS  56          HZ1       LYS  56 -15.830   1.415 -11.869
  460   2HZ   LYS  56          HZ2       LYS  56 -16.190  -0.149 -11.309
  461   3HZ   LYS  56          HZ3       LYS  56 -14.943   0.086 -12.439
  462    H    TRP  57           HN       TRP  57 -11.138  -3.469  -6.473
  463    HA   TRP  57           HA       TRP  57 -11.994  -2.146  -4.133
  464   1HB   TRP  57          HB2       TRP  57 -11.757  -4.259  -3.176
  465   2HB   TRP  57          HB1       TRP  57 -11.743  -4.682  -4.884
  466    HD1  TRP  57           HD1      TRP  57  -9.673  -5.930  -5.759
  467    HE1  TRP  57           HE1      TRP  57  -7.370  -6.548  -4.777
  468    HE3  TRP  57           HE3      TRP  57  -9.840  -3.292  -1.390
  469    HZ2  TRP  57           HZ2      TRP  57  -5.808  -5.991  -2.443
  470    HZ3  TRP  57           HZ3      TRP  57  -7.932  -3.356   0.192
  471    HH2  TRP  57           HH2      TRP  57  -5.919  -4.701  -0.330
  472    H    VAL  58           HN       VAL  58  -8.717  -2.630  -5.380
  473    HA   VAL  58           HA       VAL  58  -7.271  -1.844  -3.027
  474    HB   VAL  58           HB       VAL  58  -6.599  -1.535  -5.969
  475   1HG1  VAL  58          HG1       VAL  58  -4.433  -1.112  -5.357
  476   2HG1  VAL  58          HG1       VAL  58  -4.534  -2.119  -3.914
  477   3HG1  VAL  58          HG1       VAL  58  -5.210  -0.490  -3.901
  478   1HG2  VAL  58          HG2       VAL  58  -5.901  -3.760  -5.983
  479   2HG2  VAL  58          HG2       VAL  58  -7.307  -3.859  -4.928
  480   3HG2  VAL  58          HG2       VAL  58  -5.687  -3.810  -4.234
  481    H    GLN  59           HN       GLN  59  -8.306   0.028  -5.902
  482    HA   GLN  59           HA       GLN  59  -7.322   2.563  -5.048
  483   1HB   GLN  59          HB2       GLN  59  -9.672   1.697  -6.766
  484   2HB   GLN  59          HB1       GLN  59  -9.127   3.371  -6.646
  485   1HG   GLN  59          HG2       GLN  59  -7.355   1.063  -7.491
  486   2HG   GLN  59          HG1       GLN  59  -8.161   2.156  -8.615
  487   1HE2  GLN  59          HE2       GLN  59  -5.258   1.699  -6.974
  488   2HE2  GLN  59          HE2       GLN  59  -4.682   3.295  -7.015
  489    H    LYS  60           HN       LYS  60 -10.130   0.677  -4.154
  490    HA   LYS  60           HA       LYS  60 -11.588   2.843  -2.889
  491   1HB   LYS  60          HB2       LYS  60 -12.496   0.654  -3.792
  492   2HB   LYS  60          HB1       LYS  60 -11.747  -0.147  -2.409
  493   1HG   LYS  60          HG2       LYS  60 -13.194   0.833  -0.878
  494   2HG   LYS  60          HG1       LYS  60 -13.515   2.222  -1.917
  495   1HD   LYS  60          HD2       LYS  60 -14.662   0.550  -3.506
  496   2HD   LYS  60          HD1       LYS  60 -14.624  -0.577  -2.149
  497   1HE   LYS  60          HE2       LYS  60 -15.818   1.130  -0.750
  498   2HE   LYS  60          HE1       LYS  60 -15.962   2.150  -2.195
  499   1HZ   LYS  60          HZ1       LYS  60 -17.863   0.547  -1.735
  500   2HZ   LYS  60          HZ2       LYS  60 -16.793  -0.689  -2.202
  501   3HZ   LYS  60          HZ3       LYS  60 -17.213   0.535  -3.302
  502    H    TYR  61           HN       TYR  61  -9.244   0.380  -1.831
  503    HA   TYR  61           HA       TYR  61  -9.504   1.055   0.998
  504   1HB   TYR  61          HB2       TYR  61  -8.009  -0.771  -0.763
  505   2HB   TYR  61          HB1       TYR  61  -7.101  -0.249   0.656
  506    HD1  TYR  61           HD1      TYR  61  -7.524  -1.206   2.767
  507    HD2  TYR  61           HD2      TYR  61 -10.417  -1.632  -0.380
  508    HE1  TYR  61           HE1      TYR  61  -8.838  -2.759   4.183
  509    HE2  TYR  61           HE2      TYR  61 -11.732  -3.185   1.037
  510    HH   TYR  61           HH       TYR  61 -10.855  -3.788   4.405
  511    H    ILE  62           HN       ILE  62  -7.433   2.032  -1.687
  512    HA   ILE  62           HA       ILE  62  -5.414   3.399  -0.174
  513    HB   ILE  62           HB       ILE  62  -6.549   3.799  -2.962
  514   1HG1  ILE  62          HG1       ILE  62  -3.945   2.479  -2.201
  515   2HG1  ILE  62          HG1       ILE  62  -5.452   1.563  -2.223
  516   1HG2  ILE  62          HG2       ILE  62  -3.940   4.639  -3.045
  517   2HG2  ILE  62          HG2       ILE  62  -4.437   5.206  -1.452
  518   3HG2  ILE  62          HG2       ILE  62  -5.325   5.719  -2.887
  519   1HD1  ILE  62          HD1       ILE  62  -5.476   1.479  -4.480
  520   2HD1  ILE  62          HD1       ILE  62  -3.809   2.056  -4.419
  521   3HD1  ILE  62          HD1       ILE  62  -5.133   3.203  -4.615
  522    H    SER  63           HN       SER  63  -8.394   4.603  -1.765
  523    HA   SER  63           HA       SER  63  -8.160   7.318  -0.889
  524   1HB   SER  63          HB2       SER  63  -9.666   6.190  -2.668
  525   2HB   SER  63          HB1       SER  63 -10.734   5.790  -1.326
  526    HG   SER  63           HG       SER  63 -10.542   8.137  -0.827
  527    H    LEU  64           HN       LEU  64  -9.705   4.457   0.566
  528    HA   LEU  64           HA       LEU  64 -10.864   5.874   2.808
  529   1HB   LEU  64          HB2       LEU  64 -10.509   3.137   1.803
  530   2HB   LEU  64          HB1       LEU  64 -10.490   3.234   3.565
  531    HG   LEU  64           HG       LEU  64 -12.579   4.831   3.140
  532   1HD1  LEU  64          HD1       LEU  64 -13.905   4.104   1.233
  533   2HD1  LEU  64          HD1       LEU  64 -12.680   2.916   0.792
  534   3HD1  LEU  64          HD1       LEU  64 -12.326   4.639   0.655
  535   1HD2  LEU  64          HD2       LEU  64 -12.332   1.862   3.358
  536   2HD2  LEU  64          HD2       LEU  64 -13.934   2.525   3.040
  537   3HD2  LEU  64          HD2       LEU  64 -13.049   3.012   4.486
  538    H    LEU  65           HN       LEU  65  -8.002   3.695   2.606
  539    HA   LEU  65           HA       LEU  65  -7.039   4.174   5.229
  540   1HB   LEU  65          HB2       LEU  65  -5.882   3.320   2.594
  541   2HB   LEU  65          HB1       LEU  65  -4.763   3.698   3.899
  542    HG   LEU  65           HG       LEU  65  -6.979   1.626   3.948
  543   1HD1  LEU  65          HD1       LEU  65  -4.424   1.422   2.976
  544   2HD1  LEU  65          HD1       LEU  65  -5.351   0.070   3.621
  545   3HD1  LEU  65          HD1       LEU  65  -4.200   0.921   4.651
  546   1HD2  LEU  65          HD2       LEU  65  -5.705   3.088   6.109
  547   2HD2  LEU  65          HD2       LEU  65  -5.336   1.368   6.218
  548   3HD2  LEU  65          HD2       LEU  65  -7.015   1.909   6.186
  549    H    LYS  66           HN       LYS  66  -5.266   5.438   2.436
  550    HA   LYS  66           HA       LYS  66  -4.097   7.485   2.187
  551   1HB   LYS  66          HB2       LYS  66  -6.873   8.047   3.165
  552   2HB   LYS  66          HB1       LYS  66  -5.755   9.400   2.983
  553   1HG   LYS  66          HG2       LYS  66  -5.388   7.919   0.652
  554   2HG   LYS  66          HG1       LYS  66  -7.130   7.851   0.926
  555   1HD   LYS  66          HD2       LYS  66  -5.927  10.507   1.378
  556   2HD   LYS  66          HD1       LYS  66  -5.846   9.942  -0.292
  557   1HE   LYS  66          HE2       LYS  66  -8.341   9.373  -0.069
  558   2HE   LYS  66          HE1       LYS  66  -8.311  10.341   1.418
  559   1HZ   LYS  66          HZ1       LYS  66  -8.775  11.889  -0.250
  560   2HZ   LYS  66          HZ2       LYS  66  -7.672  11.194  -1.341
  561   3HZ   LYS  66          HZ3       LYS  66  -7.107  12.064   0.004
  562    H    THR  67           HN       THR  67  -2.656   6.625   4.062
  563    HA   THR  67           HA       THR  67  -2.582   8.707   6.167
  564    HB   THR  67           HB       THR  67  -2.404   5.782   6.845
  565    HG1  THR  67           HG1      THR  67  -4.727   7.388   7.006
  566   1HG2  THR  67          HG2       THR  67  -3.568   7.546   8.818
  567   2HG2  THR  67          HG2       THR  67  -2.010   8.170   8.273
  568   3HG2  THR  67          HG2       THR  67  -2.123   6.542   8.941
  569    HA   PRO  68           HA       PRO  68   1.498   7.124   4.407
  570   1HB   PRO  68          HB2       PRO  68   2.334   9.514   3.360
  571   2HB   PRO  68          HB1       PRO  68   1.382   8.333   2.438
  572   1HG   PRO  68          HG2       PRO  68   0.478  10.806   3.840
  573   2HG   PRO  68          HG1       PRO  68  -0.007  10.164   2.261
  574   1HD   PRO  68          HD2       PRO  68  -1.529   9.887   4.473
  575   2HD   PRO  68          HD1       PRO  68  -1.494   8.672   3.173
  576    H    LYS  69           HN       LYS  69   0.337   9.553   6.539
  577    HA   LYS  69           HA       LYS  69   2.826   9.428   8.111
  578   1HB   LYS  69          HB2       LYS  69   3.069  11.891   8.082
  579   2HB   LYS  69          HB1       LYS  69   3.168  11.238   6.446
  580   1HG   LYS  69          HG2       LYS  69   0.532  11.640   6.518
  581   2HG   LYS  69          HG1       LYS  69   0.995  12.851   7.715
  582   1HD   LYS  69          HD2       LYS  69   2.296  12.652   4.989
  583   2HD   LYS  69          HD1       LYS  69   0.904  13.685   5.316
  584   1HE   LYS  69          HE2       LYS  69   3.028  14.014   7.311
  585   2HE   LYS  69          HE1       LYS  69   3.549  14.436   5.668
  586   1HZ   LYS  69          HZ1       LYS  69   1.302  15.594   5.501
  587   2HZ   LYS  69          HZ2       LYS  69   2.498  16.355   6.439
  588   3HZ   LYS  69          HZ3       LYS  69   1.244  15.490   7.193
  589    H    GLN  70           HN       GLN  70   2.483  10.451  10.281
  590    HA   GLN  70           HA       GLN  70  -0.299  11.152  11.001
  591   1HB   GLN  70          HB2       GLN  70   0.019   8.605  10.941
  592   2HB   GLN  70          HB1       GLN  70   1.099   8.813  12.322
  593   1HG   GLN  70          HG2       GLN  70  -0.865   8.510  13.477
  594   2HG   GLN  70          HG1       GLN  70  -0.984  10.250  13.216
  595   1HE2  GLN  70          HE2       GLN  70  -2.973   7.726  13.178
  596   2HE2  GLN  70          HE2       GLN  70  -3.956   8.088  11.842
  597    H    LEU  71           HN       LEU  71   2.080  12.709  11.112
  598    HA   LEU  71           HA       LEU  71   2.342  13.059  14.072
  599   1HB   LEU  71          HB2       LEU  71   4.798  13.410  13.672
  600   2HB   LEU  71          HB1       LEU  71   4.265  11.772  13.293
  601    HG   LEU  71           HG       LEU  71   4.001  13.581  11.011
  602   1HD1  LEU  71          HD1       LEU  71   6.821  12.947  11.894
  603   2HD1  LEU  71          HD1       LEU  71   6.051  14.489  12.269
  604   3HD1  LEU  71          HD1       LEU  71   6.300  14.013  10.589
  605   1HD2  LEU  71          HD2       LEU  71   4.072  10.936  11.329
  606   2HD2  LEU  71          HD2       LEU  71   5.802  11.194  11.104
  607   3HD2  LEU  71          HD2       LEU  71   4.666  11.691   9.850
  Start of MODEL   17
    1   1H    THR   1          HT1       THR   1  21.104   6.741  12.800
    2   2H    THR   1          HT2       THR   1  22.157   7.472  11.685
    3   3H    THR   1          HT3       THR   1  21.606   5.887  11.423
    4    HA   THR   1           HA       THR   1  19.744   8.194  11.557
    5    HB   THR   1           HB       THR   1  21.006   6.954   9.096
    6    HG1  THR   1           HG1      THR   1  21.652   9.396  10.385
    7   1HG2  THR   1          HG2       THR   1  18.825   8.058   8.781
    8   2HG2  THR   1          HG2       THR   1  20.114   8.978   8.006
    9   3HG2  THR   1          HG2       THR   1  19.451   9.516   9.549
   10    H    ARG   2           HN       ARG   2  19.312   5.632  12.705
   11    HA   ARG   2           HA       ARG   2  18.080   3.781  10.852
   12   1HB   ARG   2          HB2       ARG   2  19.000   3.238  13.102
   13   2HB   ARG   2          HB1       ARG   2  17.711   4.190  13.839
   14   1HG   ARG   2          HG2       ARG   2  16.180   2.547  13.545
   15   2HG   ARG   2          HG1       ARG   2  16.729   2.217  11.902
   16   1HD   ARG   2          HD2       ARG   2  18.617   0.897  12.766
   17   2HD   ARG   2          HD1       ARG   2  18.118   1.259  14.431
   18    HE   ARG   2           HE       ARG   2  15.836   0.215  13.591
   19   1HH1  ARG   2          HH1       ARG   2  16.891  -0.813  11.036
   20   2HH1  ARG   2          HH1       ARG   2  17.421  -2.410  11.447
   21   1HH2  ARG   2          HH2       ARG   2  17.445  -1.810  14.862
   22   2HH2  ARG   2          HH2       ARG   2  17.733  -2.975  13.612
   23    H    GLY   3           HN       GLY   3  16.984   6.657  12.519
   24   1HA   GLY   3          HA2       GLY   3  14.139   6.056  12.155
   25   2HA   GLY   3          HA1       GLY   3  14.810   7.575  12.752
   26    H    SER   4           HN       SER   4  13.817   5.814   9.912
   27    HA   SER   4           HA       SER   4  13.613   8.307   8.387
   28   1HB   SER   4          HB2       SER   4  16.067   7.330   8.387
   29   2HB   SER   4          HB1       SER   4  15.403   6.195   7.215
   30    HG   SER   4           HG       SER   4  15.373   7.741   5.796
   31    H    ASP   5           HN       ASP   5  12.864   7.723   6.053
   32    HA   ASP   5           HA       ASP   5  10.701   5.768   6.262
   33   1HB   ASP   5          HB2       ASP   5  11.243   8.129   4.889
   34   2HB   ASP   5          HB1       ASP   5  11.285   6.896   3.626
   35    H    ILE   6           HN       ILE   6  11.161   3.619   5.970
   36    HA   ILE   6           HA       ILE   6  13.110   2.885   3.808
   37    HB   ILE   6           HB       ILE   6  12.467   1.502   6.435
   38   1HG1  ILE   6          HG1       ILE   6  15.012   2.898   5.557
   39   2HG1  ILE   6          HG1       ILE   6  13.784   3.657   6.570
   40   1HG2  ILE   6          HG2       ILE   6  13.297  -0.314   5.371
   41   2HG2  ILE   6          HG2       ILE   6  14.857   0.507   5.426
   42   3HG2  ILE   6          HG2       ILE   6  13.837   0.646   3.994
   43   1HD1  ILE   6          HD1       ILE   6  14.145   2.137   8.347
   44   2HD1  ILE   6          HD1       ILE   6  15.767   2.520   7.771
   45   3HD1  ILE   6          HD1       ILE   6  15.004   0.998   7.310
   46    H    SER   7           HN       SER   7  10.219   3.278   3.510
   47    HA   SER   7           HA       SER   7   9.234   0.486   3.165
   48   1HB   SER   7          HB2       SER   7   7.029   1.711   2.935
   49   2HB   SER   7          HB1       SER   7   7.821   1.928   4.493
   50    HG   SER   7           HG       SER   7   7.491   3.964   3.966
   51    H    LYS   8           HN       LYS   8  10.944   2.575   1.346
   52    HA   LYS   8           HA       LYS   8   9.307   2.587  -1.091
   53   1HB   LYS   8          HB2       LYS   8  11.936   3.623  -0.128
   54   2HB   LYS   8          HB1       LYS   8  11.732   3.430  -1.870
   55   1HG   LYS   8          HG2       LYS   8   9.860   4.975  -0.051
   56   2HG   LYS   8          HG1       LYS   8  11.056   5.694  -1.129
   57   1HD   LYS   8          HD2       LYS   8   9.825   4.202  -2.945
   58   2HD   LYS   8          HD1       LYS   8   8.487   4.312  -1.802
   59   1HE   LYS   8          HE2       LYS   8   9.278   6.916  -1.851
   60   2HE   LYS   8          HE1       LYS   8   9.674   6.426  -3.510
   61   1HZ   LYS   8          HZ1       LYS   8   7.408   7.005  -3.558
   62   2HZ   LYS   8          HZ2       LYS   8   7.074   6.190  -2.106
   63   3HZ   LYS   8          HZ3       LYS   8   7.424   5.310  -3.517
   64    H    THR   9           HN       THR   9   9.109   0.175  -1.235
   65    HA   THR   9           HA       THR   9  11.582  -1.060  -2.398
   66    HB   THR   9           HB       THR   9  10.913  -1.859  -0.119
   67    HG1  THR   9           HG1      THR   9  11.906  -3.243  -1.704
   68   1HG2  THR   9          HG2       THR   9   8.841  -3.245   0.034
   69   2HG2  THR   9          HG2       THR   9   8.407  -2.716  -1.592
   70   3HG2  THR   9          HG2       THR   9   8.505  -1.542  -0.279
   71    H    CYS  10           HN       CYS  10  10.063  -3.476  -3.086
   72    HA   CYS  10           HA       CYS  10   8.377  -2.382  -5.317
   73   1HB   CYS  10          HB2       CYS  10  10.586  -4.350  -5.128
   74   2HB   CYS  10          HB1       CYS  10   9.244  -4.829  -6.166
   75    H    CYS  11           HN       CYS  11   7.272  -4.773  -6.186
   76    HA   CYS  11           HA       CYS  11   6.017  -6.059  -3.809
   77   1HB   CYS  11          HB2       CYS  11   4.744  -4.296  -5.874
   78   2HB   CYS  11          HB1       CYS  11   3.801  -5.621  -5.192
   79    H    PHE  12           HN       PHE  12   6.840  -8.108  -4.401
   80    HA   PHE  12           HA       PHE  12   6.274  -9.084  -7.154
   81   1HB   PHE  12          HB2       PHE  12   8.210  -9.677  -4.961
   82   2HB   PHE  12          HB1       PHE  12   7.785 -10.999  -6.047
   83    HD1  PHE  12           HD1      PHE  12   8.651 -11.104  -8.255
   84    HD2  PHE  12           HD2      PHE  12   9.064  -7.499  -5.958
   85    HE1  PHE  12           HE1      PHE  12  10.168 -10.176  -9.983
   86    HE2  PHE  12           HE2      PHE  12  10.581  -6.571  -7.685
   87    HZ   PHE  12           HZ       PHE  12  11.133  -7.909  -9.699
   88    H    GLN  13           HN       GLN  13   4.238  -8.823  -4.949
   89    HA   GLN  13           HA       GLN  13   3.058 -11.491  -5.230
   90   1HB   GLN  13          HB2       GLN  13   2.971 -11.816  -2.739
   91   2HB   GLN  13          HB1       GLN  13   4.615 -11.835  -3.378
   92   1HG   GLN  13          HG2       GLN  13   5.097 -10.228  -1.868
   93   2HG   GLN  13          HG1       GLN  13   4.125  -9.138  -2.857
   94   1HE2  GLN  13          HE2       GLN  13   4.372 -10.482   0.254
   95   2HE2  GLN  13          HE2       GLN  13   2.799 -10.144   0.792
   96    H    TYR  14           HN       TYR  14   0.794 -11.377  -4.903
   97    HA   TYR  14           HA       TYR  14  -0.286  -8.796  -3.866
   98   1HB   TYR  14          HB2       TYR  14  -1.066 -10.260  -6.407
   99   2HB   TYR  14          HB1       TYR  14  -1.833  -8.790  -5.804
  100    HD1  TYR  14           HD1      TYR  14   0.236  -9.757  -8.279
  101    HD2  TYR  14           HD2      TYR  14   0.296  -7.103  -4.903
  102    HE1  TYR  14           HE1      TYR  14   1.986  -8.392  -9.384
  103    HE2  TYR  14           HE2      TYR  14   2.044  -5.736  -6.008
  104    HH   TYR  14           HH       TYR  14   3.160  -5.373  -7.932
  105    H    SER  15           HN       SER  15  -2.255  -9.006  -2.759
  106    HA   SER  15           HA       SER  15  -3.395 -11.761  -2.555
  107   1HB   SER  15          HB2       SER  15  -2.468  -9.787  -0.511
  108   2HB   SER  15          HB1       SER  15  -3.859 -10.791  -0.108
  109    HG   SER  15           HG       SER  15  -2.621 -12.532  -0.131
  110    H    HIS  16           HN       HIS  16  -5.456 -11.654  -3.381
  111    HA   HIS  16           HA       HIS  16  -6.918  -9.092  -3.425
  112   1HB   HIS  16          HB2       HIS  16  -6.848 -10.629  -5.357
  113   2HB   HIS  16          HB1       HIS  16  -7.595 -11.894  -4.381
  114    HD1  HIS  16           HD1      HIS  16  -8.356  -8.397  -5.681
  115    HD2  HIS  16           HD2      HIS  16 -10.371 -11.778  -4.308
  116    HE1  HIS  16           HE1      HIS  16 -10.822  -7.959  -6.049
  117    H    LYS  17           HN       LYS  17  -7.196  -8.934  -1.037
  118    HA   LYS  17           HA       LYS  17  -9.686 -10.233  -0.174
  119   1HB   LYS  17          HB2       LYS  17  -7.013 -11.152   0.560
  120   2HB   LYS  17          HB1       LYS  17  -7.984 -10.750   1.977
  121   1HG   LYS  17          HG2       LYS  17  -9.500 -12.223  -0.050
  122   2HG   LYS  17          HG1       LYS  17  -8.118 -13.131   0.563
  123   1HD   LYS  17          HD2       LYS  17  -8.876 -12.652   2.890
  124   2HD   LYS  17          HD1       LYS  17 -10.303 -11.851   2.230
  125   1HE   LYS  17          HE2       LYS  17 -10.889 -13.994   1.044
  126   2HE   LYS  17          HE1       LYS  17  -9.551 -14.776   1.910
  127   1HZ   LYS  17          HZ1       LYS  17 -11.977 -13.515   3.035
  128   2HZ   LYS  17          HZ2       LYS  17 -10.582 -13.739   3.978
  129   3HZ   LYS  17          HZ3       LYS  17 -11.382 -15.078   3.306
  130    HA   PRO  18           HA       PRO  18  -9.789  -6.266   1.817
  131   1HB   PRO  18          HB2       PRO  18 -12.038  -6.632   3.326
  132   2HB   PRO  18          HB1       PRO  18 -12.088  -6.352   1.574
  133   1HG   PRO  18          HG2       PRO  18 -12.380  -8.885   3.093
  134   2HG   PRO  18          HG1       PRO  18 -13.196  -8.351   1.616
  135   1HD   PRO  18          HD2       PRO  18 -11.107 -10.134   1.674
  136   2HD   PRO  18          HD1       PRO  18 -11.534  -9.135   0.268
  137    H    LEU  19           HN       LEU  19  -8.173  -6.023   3.344
  138    HA   LEU  19           HA       LEU  19  -7.739  -7.804   5.576
  139   1HB   LEU  19          HB2       LEU  19  -6.384  -5.818   4.233
  140   2HB   LEU  19          HB1       LEU  19  -6.782  -5.013   5.748
  141    HG   LEU  19           HG       LEU  19  -5.827  -7.752   6.147
  142   1HD1  LEU  19          HD1       LEU  19  -3.446  -6.289   5.634
  143   2HD1  LEU  19          HD1       LEU  19  -4.461  -6.133   4.202
  144   3HD1  LEU  19          HD1       LEU  19  -4.022  -7.732   4.803
  145   1HD2  LEU  19          HD2       LEU  19  -4.531  -6.680   7.878
  146   2HD2  LEU  19          HD2       LEU  19  -6.112  -5.900   7.861
  147   3HD2  LEU  19          HD2       LEU  19  -4.726  -5.099   7.121
  148    HA   PRO  20           HA       PRO  20 -10.714  -6.185   8.412
  149   1HB   PRO  20          HB2       PRO  20  -9.427  -6.675  10.787
  150   2HB   PRO  20          HB1       PRO  20 -10.204  -7.949   9.825
  151   1HG   PRO  20          HG2       PRO  20  -7.326  -7.181   9.966
  152   2HG   PRO  20          HG1       PRO  20  -8.059  -8.793   9.931
  153   1HD   PRO  20          HD2       PRO  20  -6.953  -7.672   7.742
  154   2HD   PRO  20          HD1       PRO  20  -8.361  -8.752   7.644
  155    H    TRP  21           HN       TRP  21 -10.772  -3.958   8.164
  156    HA   TRP  21           HA       TRP  21  -8.847  -2.010   8.304
  157   1HB   TRP  21          HB2       TRP  21 -11.702  -2.093   9.272
  158   2HB   TRP  21          HB1       TRP  21 -10.777  -0.590   9.251
  159    HD1  TRP  21           HD1      TRP  21 -12.830  -2.757   7.089
  160    HE1  TRP  21           HE1      TRP  21 -12.647  -2.016   4.623
  161    HE3  TRP  21           HE3      TRP  21  -8.857   0.428   7.422
  162    HZ2  TRP  21           HZ2      TRP  21 -11.018  -0.299   3.010
  163    HZ3  TRP  21           HZ3      TRP  21  -8.011   1.596   5.409
  164    HH2  TRP  21           HH2      TRP  21  -9.085   1.241   3.206
  165    H    THR  22           HN       THR  22 -10.226  -3.695  11.090
  166    HA   THR  22           HA       THR  22  -9.367  -1.972  13.168
  167    HB   THR  22           HB       THR  22  -9.294  -4.206  14.434
  168    HG1  THR  22           HG1      THR  22  -9.597  -5.995  13.317
  169   1HG2  THR  22          HG2       THR  22 -11.853  -4.404  13.109
  170   2HG2  THR  22          HG2       THR  22 -11.429  -2.711  13.364
  171   3HG2  THR  22          HG2       THR  22 -11.489  -3.822  14.733
  172    H    TRP  23           HN       TRP  23  -7.616  -4.380  11.273
  173    HA   TRP  23           HA       TRP  23  -5.119  -3.849  12.797
  174   1HB   TRP  23          HB2       TRP  23  -6.180  -5.985  10.970
  175   2HB   TRP  23          HB1       TRP  23  -4.442  -5.833  11.196
  176    HD1  TRP  23           HD1      TRP  23  -6.304  -4.857  14.265
  177    HE1  TRP  23           HE1      TRP  23  -6.185  -6.743  16.016
  178    HE3  TRP  23           HE3      TRP  23  -4.450  -8.636  11.370
  179    HZ2  TRP  23           HZ2      TRP  23  -5.409  -9.491  16.171
  180    HZ3  TRP  23           HZ3      TRP  23  -4.032 -10.875  12.345
  181    HH2  TRP  23           HH2      TRP  23  -4.509 -11.308  14.740
  182    H    VAL  24           HN       VAL  24  -6.624  -2.383  10.288
  183    HA   VAL  24           HA       VAL  24  -4.299  -2.304   8.462
  184    HB   VAL  24           HB       VAL  24  -7.014  -0.960   8.366
  185   1HG1  VAL  24          HG1       VAL  24  -4.813  -1.296   6.304
  186   2HG1  VAL  24          HG1       VAL  24  -5.378   0.221   7.001
  187   3HG1  VAL  24          HG1       VAL  24  -6.435  -0.707   5.938
  188   1HG2  VAL  24          HG2       VAL  24  -5.924  -3.564   7.285
  189   2HG2  VAL  24          HG2       VAL  24  -7.306  -2.768   6.532
  190   3HG2  VAL  24          HG2       VAL  24  -7.399  -3.296   8.210
  191    H    ARG  25           HN       ARG  25  -3.070  -0.382   8.115
  192    HA   ARG  25           HA       ARG  25  -3.548   1.800  10.123
  193   1HB   ARG  25          HB2       ARG  25  -1.612   0.205  10.510
  194   2HB   ARG  25          HB1       ARG  25  -0.894   0.833   9.026
  195   1HG   ARG  25          HG2       ARG  25  -1.791   2.962  10.817
  196   2HG   ARG  25          HG1       ARG  25  -0.576   1.922  11.562
  197   1HD   ARG  25          HD2       ARG  25   0.205   2.445   8.840
  198   2HD   ARG  25          HD1       ARG  25  -0.127   3.983   9.661
  199    HE   ARG  25           HE       ARG  25   1.383   2.119  11.320
  200   1HH1  ARG  25          HH2       ARG  25   1.304   5.224  10.215
  201   2HH1  ARG  25          HH2       ARG  25   3.010   5.401   9.975
  202   1HH2  ARG  25          HH1       ARG  25   3.691   2.032  10.432
  203   2HH2  ARG  25          HH1       ARG  25   4.362   3.593  10.096
  204    H    SER  26           HN       SER  26  -1.604   1.246   7.138
  205    HA   SER  26           HA       SER  26  -2.870   3.631   5.904
  206   1HB   SER  26          HB2       SER  26  -0.738   4.785   5.689
  207   2HB   SER  26          HB1       SER  26  -0.985   4.383   7.385
  208    HG   SER  26           HG       SER  26   0.920   3.524   5.629
  209    H    TYR  27           HN       TYR  27  -0.955   3.978   3.873
  210    HA   TYR  27           HA       TYR  27  -0.506   1.339   2.613
  211   1HB   TYR  27          HB2       TYR  27  -2.102   1.623   0.923
  212   2HB   TYR  27          HB1       TYR  27  -2.924   2.373   2.284
  213    HD1  TYR  27           HD1      TYR  27  -2.710   4.923   2.567
  214    HD2  TYR  27           HD2      TYR  27  -1.624   2.850  -1.032
  215    HE1  TYR  27           HE1      TYR  27  -2.833   7.054   1.302
  216    HE2  TYR  27           HE2      TYR  27  -1.746   4.977  -2.297
  217    HH   TYR  27           HH       TYR  27  -2.329   8.064  -0.661
  218    H    GLU  28           HN       GLU  28   0.317   1.957   0.168
  219    HA   GLU  28           HA       GLU  28   1.667   4.474  -0.186
  220   1HB   GLU  28          HB2       GLU  28   3.970   3.688   0.303
  221   2HB   GLU  28          HB1       GLU  28   2.953   3.602   1.740
  222   1HG   GLU  28          HG2       GLU  28   2.528   1.192   1.248
  223   2HG   GLU  28          HG1       GLU  28   3.656   1.302  -0.104
  224    H    PHE  29           HN       PHE  29   2.494   4.601  -2.285
  225    HA   PHE  29           HA       PHE  29   2.000   2.272  -4.046
  226   1HB   PHE  29          HB2       PHE  29   1.632   4.997  -4.218
  227   2HB   PHE  29          HB1       PHE  29   3.118   4.774  -5.142
  228    HD1  PHE  29           HD1      PHE  29  -0.382   4.782  -5.362
  229    HD2  PHE  29           HD2      PHE  29   3.060   2.630  -6.768
  230    HE1  PHE  29           HE1      PHE  29  -1.699   3.927  -7.282
  231    HE2  PHE  29           HE2      PHE  29   1.743   1.775  -8.687
  232    HZ   PHE  29           HZ       PHE  29  -0.638   2.424  -8.945
  233    H    THR  30           HN       THR  30   3.666   1.238  -5.226
  234    HA   THR  30           HA       THR  30   6.265   1.056  -4.100
  235    HB   THR  30           HB       THR  30   6.688   0.135  -6.551
  236    HG1  THR  30           HG1      THR  30   4.830   1.210  -7.377
  237   1HG2  THR  30          HG2       THR  30   6.253  -1.856  -5.578
  238   2HG2  THR  30          HG2       THR  30   4.542  -1.468  -5.386
  239   3HG2  THR  30          HG2       THR  30   5.709  -0.934  -4.176
  240    H    SER  31           HN       SER  31   8.253   1.481  -5.779
  241    HA   SER  31           HA       SER  31   8.323   4.407  -6.117
  242   1HB   SER  31          HB2       SER  31  10.146   2.176  -5.717
  243   2HB   SER  31          HB1       SER  31  10.716   3.239  -6.999
  244    HG   SER  31           HG       SER  31  11.446   4.043  -5.052
  245    H    ASN  32           HN       ASN  32   9.630   5.088  -8.227
  246    HA   ASN  32           HA       ASN  32   8.013   4.210 -10.523
  247   1HB   ASN  32          HB2       ASN  32   9.268   6.055 -11.632
  248   2HB   ASN  32          HB1       ASN  32   8.555   6.574 -10.104
  249   1HD2  ASN  32          HD2       ASN  32  11.643   5.509 -11.578
  250   2HD2  ASN  32          HD2       ASN  32  12.633   6.242 -10.410
  251    H    SER  33           HN       SER  33  11.227   3.660  -9.242
  252    HA   SER  33           HA       SER  33  12.317   2.591 -11.741
  253   1HB   SER  33          HB2       SER  33  13.363   2.266  -8.924
  254   2HB   SER  33          HB1       SER  33  14.287   2.298 -10.423
  255    HG   SER  33           HG       SER  33  13.099   4.383  -8.980
  256    H    CYS  34           HN       CYS  34  10.181   1.369  -9.402
  257    HA   CYS  34           HA       CYS  34  11.075  -1.334  -9.097
  258   1HB   CYS  34          HB2       CYS  34   9.290  -0.024  -7.829
  259   2HB   CYS  34          HB1       CYS  34   8.224  -0.313  -9.204
  260    H    SER  35           HN       SER  35  10.412  -3.233 -10.264
  261    HA   SER  35           HA       SER  35   9.862  -2.753 -13.131
  262   1HB   SER  35          HB2       SER  35  11.177  -4.706 -11.446
  263   2HB   SER  35          HB1       SER  35  10.043  -5.507 -12.532
  264    HG   SER  35           HG       SER  35  11.783  -5.291 -13.780
  265    H    GLN  36           HN       GLN  36   7.816  -2.671 -10.710
  266    HA   GLN  36           HA       GLN  36   5.615  -3.880 -12.238
  267   1HB   GLN  36          HB2       GLN  36   6.992  -5.555 -10.628
  268   2HB   GLN  36          HB1       GLN  36   5.867  -4.889  -9.443
  269   1HG   GLN  36          HG2       GLN  36   4.453  -6.495 -10.217
  270   2HG   GLN  36          HG1       GLN  36   4.191  -5.370 -11.551
  271   1HE2  GLN  36          HE2       GLN  36   6.011  -8.282 -10.592
  272   2HE2  GLN  36          HE2       GLN  36   6.405  -8.758 -12.173
  273    H    ARG  37           HN       ARG  37   4.890  -1.626 -12.124
  274    HA   ARG  37           HA       ARG  37   4.583  -0.035  -9.827
  275   1HB   ARG  37          HB2       ARG  37   3.086  -0.396 -12.413
  276   2HB   ARG  37          HB1       ARG  37   2.493   0.756 -11.218
  277   1HG   ARG  37          HG2       ARG  37   5.127   1.412 -11.244
  278   2HG   ARG  37          HG1       ARG  37   4.920   0.876 -12.912
  279   1HD   ARG  37          HD2       ARG  37   3.410   2.577 -13.416
  280   2HD   ARG  37          HD1       ARG  37   2.877   2.740 -11.731
  281    HE   ARG  37           HE       ARG  37   5.707   3.400 -12.253
  282   1HH1  ARG  37          HH1       ARG  37   3.584   5.261 -13.575
  283   2HH1  ARG  37          HH1       ARG  37   3.514   6.520 -12.387
  284   1HH2  ARG  37          HH2       ARG  37   5.137   4.675  -9.944
  285   2HH2  ARG  37          HH2       ARG  37   4.390   6.188 -10.332
  286    H    ALA  38           HN       ALA  38   3.664  -0.753  -7.921
  287    HA   ALA  38           HA       ALA  38   0.924  -1.881  -8.049
  288   1HB   ALA  38          HB1       ALA  38   3.356  -3.329  -7.554
  289   2HB   ALA  38          HB2       ALA  38   1.706  -3.950  -7.608
  290   3HB   ALA  38          HB3       ALA  38   2.372  -3.344  -6.091
  291    H    VAL  39           HN       VAL  39  -0.267  -1.550  -6.087
  292    HA   VAL  39           HA       VAL  39   0.865   0.572  -4.331
  293    HB   VAL  39           HB       VAL  39  -1.938  -0.570  -4.590
  294   1HG1  VAL  39          HG1       VAL  39  -0.679   1.452  -2.879
  295   2HG1  VAL  39          HG1       VAL  39  -2.245   0.658  -2.711
  296   3HG1  VAL  39          HG1       VAL  39  -2.079   2.069  -3.756
  297   1HG2  VAL  39          HG2       VAL  39  -0.387   1.240  -6.277
  298   2HG2  VAL  39          HG2       VAL  39  -1.865   1.998  -5.684
  299   3HG2  VAL  39          HG2       VAL  39  -1.951   0.488  -6.592
  300    H    ILE  40           HN       ILE  40   0.631   0.330  -1.969
  301    HA   ILE  40           HA       ILE  40   0.403  -2.522  -1.079
  302    HB   ILE  40           HB       ILE  40   2.389  -0.358  -0.323
  303   1HG1  ILE  40          HG1       ILE  40   3.304  -3.001  -1.244
  304   2HG1  ILE  40          HG1       ILE  40   2.420  -2.082  -2.462
  305   1HG2  ILE  40          HG2       ILE  40   1.826  -1.648   1.656
  306   2HG2  ILE  40          HG2       ILE  40   3.416  -2.151   1.082
  307   3HG2  ILE  40          HG2       ILE  40   2.005  -3.158   0.763
  308   1HD1  ILE  40          HD1       ILE  40   4.086  -0.564  -2.686
  309   2HD1  ILE  40          HD1       ILE  40   5.096  -1.758  -1.869
  310   3HD1  ILE  40          HD1       ILE  40   4.341  -0.461  -0.945
  311    H    PHE  41           HN       PHE  41  -0.254  -2.753   1.168
  312    HA   PHE  41           HA       PHE  41  -1.530  -0.331   2.390
  313   1HB   PHE  41          HB2       PHE  41  -2.637  -3.146   2.059
  314   2HB   PHE  41          HB1       PHE  41  -3.425  -1.866   2.984
  315    HD1  PHE  41           HD1      PHE  41  -3.528   0.479   1.601
  316    HD2  PHE  41           HD2      PHE  41  -3.411  -3.458  -0.110
  317    HE1  PHE  41           HE1      PHE  41  -4.555   1.354  -0.479
  318    HE2  PHE  41           HE2      PHE  41  -4.438  -2.584  -2.191
  319    HZ   PHE  41           HZ       PHE  41  -5.011  -0.179  -2.375
  320    H    THR  42           HN       THR  42  -0.711  -0.097   4.471
  321    HA   THR  42           HA       THR  42   0.695  -2.426   5.639
  322    HB   THR  42           HB       THR  42   0.709   0.276   6.891
  323    HG1  THR  42           HG1      THR  42   1.575   1.222   5.230
  324   1HG2  THR  42          HG2       THR  42   2.585  -2.008   6.435
  325   2HG2  THR  42          HG2       THR  42   2.208  -1.153   7.931
  326   3HG2  THR  42          HG2       THR  42   3.250  -0.401   6.725
  327    H    THR  43           HN       THR  43   0.267  -3.210   7.713
  328    HA   THR  43           HA       THR  43  -2.467  -2.629   8.734
  329    HB   THR  43           HB       THR  43  -2.142  -4.820   9.859
  330    HG1  THR  43           HG1      THR  43   0.306  -4.996   8.481
  331   1HG2  THR  43          HG2       THR  43  -2.331  -6.131   7.912
  332   2HG2  THR  43          HG2       THR  43  -1.210  -5.113   7.010
  333   3HG2  THR  43          HG2       THR  43  -2.832  -4.528   7.376
  334    H    LYS  44           HN       LYS  44  -2.433  -3.184  11.300
  335    HA   LYS  44           HA       LYS  44  -0.939  -1.014  12.534
  336   1HB   LYS  44          HB2       LYS  44  -2.813  -3.197  13.455
  337   2HB   LYS  44          HB1       LYS  44  -2.083  -2.063  14.592
  338   1HG   LYS  44          HG2       LYS  44  -3.337  -0.884  12.165
  339   2HG   LYS  44          HG1       LYS  44  -4.434  -1.569  13.366
  340   1HD   LYS  44          HD2       LYS  44  -2.850  -0.218  15.039
  341   2HD   LYS  44          HD1       LYS  44  -2.587   0.766  13.599
  342   1HE   LYS  44          HE2       LYS  44  -4.572   1.790  13.974
  343   2HE   LYS  44          HE1       LYS  44  -5.393   0.228  13.775
  344   1HZ   LYS  44          HZ1       LYS  44  -4.305   1.433  16.245
  345   2HZ   LYS  44          HZ2       LYS  44  -4.549  -0.244  16.123
  346   3HZ   LYS  44          HZ3       LYS  44  -5.862   0.822  15.966
  347    H    ARG  45           HN       ARG  45  -0.322  -4.368  11.958
  348    HA   ARG  45           HA       ARG  45   1.495  -4.744  14.230
  349   1HB   ARG  45          HB2       ARG  45   0.698  -6.284  11.755
  350   2HB   ARG  45          HB1       ARG  45   1.975  -6.866  12.824
  351   1HG   ARG  45          HG2       ARG  45  -0.380  -6.025  14.321
  352   2HG   ARG  45          HG1       ARG  45  -0.764  -7.290  13.152
  353   1HD   ARG  45          HD2       ARG  45   1.548  -8.295  14.160
  354   2HD   ARG  45          HD1       ARG  45   0.934  -7.431  15.584
  355    HE   ARG  45           HE       ARG  45  -0.352  -9.734  14.290
  356   1HH1  ARG  45          HH1       ARG  45  -2.447  -7.612  14.493
  357   2HH1  ARG  45          HH1       ARG  45  -3.093  -7.885  16.076
  358   1HH2  ARG  45          HH2       ARG  45  -0.412  -9.818  17.125
  359   2HH2  ARG  45          HH2       ARG  45  -1.940  -9.132  17.567
  360    H    GLY  46           HN       GLY  46   1.715  -3.566  10.956
  361   1HA   GLY  46          HA2       GLY  46   3.711  -2.222  10.375
  362   2HA   GLY  46          HA1       GLY  46   4.680  -3.376  11.289
  363    H    LYS  47           HN       LYS  47   2.409  -5.175   9.654
  364    HA   LYS  47           HA       LYS  47   4.401  -6.004   7.647
  365   1HB   LYS  47          HB2       LYS  47   1.612  -7.022   8.276
  366   2HB   LYS  47          HB1       LYS  47   2.850  -7.875   7.352
  367   1HG   LYS  47          HG2       LYS  47   4.268  -7.419   9.581
  368   2HG   LYS  47          HG1       LYS  47   2.654  -7.424  10.294
  369   1HD   LYS  47          HD2       LYS  47   3.458  -9.607   8.389
  370   2HD   LYS  47          HD1       LYS  47   3.951  -9.686  10.081
  371   1HE   LYS  47          HE2       LYS  47   1.832 -10.154  10.796
  372   2HE   LYS  47          HE1       LYS  47   1.098  -9.007   9.659
  373   1HZ   LYS  47          HZ1       LYS  47   1.453 -10.519   7.866
  374   2HZ   LYS  47          HZ2       LYS  47   0.663 -11.377   9.103
  375   3HZ   LYS  47          HZ3       LYS  47   2.329 -11.586   8.851
  376    H    LYS  48           HN       LYS  48   4.420  -4.824   5.755
  377    HA   LYS  48           HA       LYS  48   1.998  -3.453   4.809
  378   1HB   LYS  48          HB2       LYS  48   4.819  -3.212   4.592
  379   2HB   LYS  48          HB1       LYS  48   4.186  -3.421   2.959
  380   1HG   LYS  48          HG2       LYS  48   3.294  -1.351   2.951
  381   2HG   LYS  48          HG1       LYS  48   2.533  -1.608   4.521
  382   1HD   LYS  48          HD2       LYS  48   4.168   0.236   4.634
  383   2HD   LYS  48          HD1       LYS  48   4.681  -1.119   5.640
  384   1HE   LYS  48          HE2       LYS  48   5.697  -1.543   2.990
  385   2HE   LYS  48          HE1       LYS  48   6.135   0.095   3.514
  386   1HZ   LYS  48          HZ1       LYS  48   7.056  -0.726   5.505
  387   2HZ   LYS  48          HZ2       LYS  48   7.663  -1.740   4.284
  388   3HZ   LYS  48          HZ3       LYS  48   6.393  -2.271   5.280
  389    H    VAL  49           HN       VAL  49   0.606  -4.287   3.327
  390    HA   VAL  49           HA       VAL  49   1.331  -6.860   1.992
  391    HB   VAL  49           HB       VAL  49  -1.320  -5.421   2.328
  392   1HG1  VAL  49          HG1       VAL  49  -2.347  -7.404   1.557
  393   2HG1  VAL  49          HG1       VAL  49  -0.877  -8.353   1.773
  394   3HG1  VAL  49          HG1       VAL  49  -0.986  -7.181   0.459
  395   1HG2  VAL  49          HG2       VAL  49  -1.721  -6.862   4.209
  396   2HG2  VAL  49          HG2       VAL  49  -0.133  -6.139   4.463
  397   3HG2  VAL  49          HG2       VAL  49  -0.263  -7.799   3.881
  398    H    CYS  50           HN       CYS  50   1.790  -6.842  -0.176
  399    HA   CYS  50           HA       CYS  50   1.593  -4.371  -1.735
  400   1HB   CYS  50          HB2       CYS  50   2.584  -7.185  -2.095
  401   2HB   CYS  50          HB1       CYS  50   2.389  -6.161  -3.514
  402    H    THR  51           HN       THR  51   0.218  -4.061  -3.565
  403    HA   THR  51           HA       THR  51  -1.780  -6.140  -4.242
  404    HB   THR  51           HB       THR  51  -3.643  -4.561  -3.740
  405    HG1  THR  51           HG1      THR  51  -1.616  -3.011  -2.511
  406   1HG2  THR  51          HG2       THR  51  -1.889  -4.856  -1.298
  407   2HG2  THR  51          HG2       THR  51  -2.694  -6.235  -2.049
  408   3HG2  THR  51          HG2       THR  51  -3.650  -4.909  -1.388
  409    H    HIS  52           HN       HIS  52  -2.905  -5.614  -6.253
  410    HA   HIS  52           HA       HIS  52  -1.303  -3.926  -8.046
  411   1HB   HIS  52          HB2       HIS  52  -3.307  -6.079  -8.171
  412   2HB   HIS  52          HB1       HIS  52  -3.470  -4.884  -9.458
  413    HD1  HIS  52           HD1      HIS  52  -2.562  -7.590 -10.365
  414    HD2  HIS  52           HD2      HIS  52   0.142  -4.699  -9.055
  415    HE1  HIS  52           HE1      HIS  52  -0.315  -8.209 -11.354
  416    HA   PRO  53           HA       PRO  53  -4.012  -0.456  -7.748
  417   1HB   PRO  53          HB2       PRO  53  -3.360   0.823 -10.075
  418   2HB   PRO  53          HB1       PRO  53  -2.288   0.789  -8.661
  419   1HG   PRO  53          HG2       PRO  53  -2.145  -0.767 -11.179
  420   2HG   PRO  53          HG1       PRO  53  -0.842  -0.149 -10.154
  421   1HD   PRO  53          HD2       PRO  53  -1.716  -2.772 -10.202
  422   2HD   PRO  53          HD1       PRO  53  -0.809  -2.022  -8.873
  423    H    ARG  54           HN       ARG  54  -4.071  -2.609 -10.507
  424    HA   ARG  54           HA       ARG  54  -6.344  -1.516 -11.885
  425   1HB   ARG  54          HB2       ARG  54  -4.925  -4.166 -11.707
  426   2HB   ARG  54          HB1       ARG  54  -6.413  -4.033 -12.644
  427   1HG   ARG  54          HG2       ARG  54  -4.635  -1.813 -13.217
  428   2HG   ARG  54          HG1       ARG  54  -3.829  -3.356 -13.505
  429   1HD   ARG  54          HD2       ARG  54  -4.959  -2.769 -15.561
  430   2HD   ARG  54          HD1       ARG  54  -5.928  -4.052 -14.807
  431    HE   ARG  54           HE       ARG  54  -6.869  -1.607 -13.756
  432   1HH1  ARG  54          HH2       ARG  54  -6.384  -0.638 -16.551
  433   2HH1  ARG  54          HH2       ARG  54  -7.881  -1.020 -17.332
  434   1HH2  ARG  54          HH1       ARG  54  -8.917  -3.220 -14.862
  435   2HH2  ARG  54          HH1       ARG  54  -9.313  -2.483 -16.379
  436    H    LYS  55           HN       LYS  55  -6.055  -4.006  -9.339
  437    HA   LYS  55           HA       LYS  55  -8.717  -4.897  -9.205
  438   1HB   LYS  55          HB2       LYS  55  -6.339  -4.721  -7.499
  439   2HB   LYS  55          HB1       LYS  55  -7.840  -4.723  -6.574
  440   1HG   LYS  55          HG2       LYS  55  -7.026  -7.026  -6.952
  441   2HG   LYS  55          HG1       LYS  55  -8.576  -6.758  -7.750
  442   1HD   LYS  55          HD2       LYS  55  -7.548  -7.574  -9.601
  443   2HD   LYS  55          HD1       LYS  55  -6.790  -5.985  -9.699
  444   1HE   LYS  55          HE2       LYS  55  -4.908  -7.374  -9.734
  445   2HE   LYS  55          HE1       LYS  55  -5.062  -7.078  -7.989
  446   1HZ   LYS  55          HZ1       LYS  55  -6.023  -9.411  -9.541
  447   2HZ   LYS  55          HZ2       LYS  55  -6.632  -9.048  -7.997
  448   3HZ   LYS  55          HZ3       LYS  55  -4.982  -9.402  -8.202
  449    H    LYS  56           HN       LYS  56 -10.568  -3.724  -8.933
  450    HA   LYS  56           HA       LYS  56 -10.638  -0.953  -8.235
  451   1HB   LYS  56          HB2       LYS  56 -12.768  -3.117  -8.165
  452   2HB   LYS  56          HB1       LYS  56 -13.089  -1.383  -8.165
  453   1HG   LYS  56          HG2       LYS  56 -11.936  -1.167 -10.338
  454   2HG   LYS  56          HG1       LYS  56 -11.625  -2.902 -10.343
  455   1HD   LYS  56          HD2       LYS  56 -14.447  -2.075  -9.920
  456   2HD   LYS  56          HD1       LYS  56 -13.786  -1.808 -11.533
  457   1HE   LYS  56          HE2       LYS  56 -13.502  -4.076 -11.943
  458   2HE   LYS  56          HE1       LYS  56 -13.295  -4.464 -10.223
  459   1HZ   LYS  56          HZ1       LYS  56 -15.832  -3.403 -11.324
  460   2HZ   LYS  56          HZ2       LYS  56 -15.571  -4.121  -9.807
  461   3HZ   LYS  56          HZ3       LYS  56 -15.520  -5.066 -11.217
  462    H    TRP  57           HN       TRP  57 -10.302  -3.716  -6.213
  463    HA   TRP  57           HA       TRP  57 -11.610  -2.498  -3.882
  464   1HB   TRP  57          HB2       TRP  57 -11.266  -4.596  -2.924
  465   2HB   TRP  57          HB1       TRP  57 -11.214  -5.033  -4.626
  466    HD1  TRP  57           HD1      TRP  57  -9.049  -6.108  -5.504
  467    HE1  TRP  57           HE1      TRP  57  -6.726  -6.596  -4.495
  468    HE3  TRP  57           HE3      TRP  57  -9.454  -3.577  -1.088
  469    HZ2  TRP  57           HZ2      TRP  57  -5.241  -5.985  -2.128
  470    HZ3  TRP  57           HZ3      TRP  57  -7.573  -3.553   0.525
  471    HH2  TRP  57           HH2      TRP  57  -5.468  -4.753   0.011
  472    H    VAL  58           HN       VAL  58  -8.428  -2.649  -5.316
  473    HA   VAL  58           HA       VAL  58  -6.901  -1.808  -3.004
  474    HB   VAL  58           HB       VAL  58  -6.459  -1.691  -6.001
  475   1HG1  VAL  58          HG1       VAL  58  -4.111  -1.289  -5.524
  476   2HG1  VAL  58          HG1       VAL  58  -4.412  -1.376  -3.788
  477   3HG1  VAL  58          HG1       VAL  58  -5.063  -0.034  -4.730
  478   1HG2  VAL  58          HG2       VAL  58  -6.418  -3.946  -5.530
  479   2HG2  VAL  58          HG2       VAL  58  -5.993  -3.686  -3.839
  480   3HG2  VAL  58          HG2       VAL  58  -4.757  -3.557  -5.088
  481    H    GLN  59           HN       GLN  59  -8.099  -0.043  -5.905
  482    HA   GLN  59           HA       GLN  59  -7.232   2.548  -5.119
  483   1HB   GLN  59          HB2       GLN  59  -9.128   3.260  -6.648
  484   2HB   GLN  59          HB1       GLN  59  -8.042   2.065  -7.355
  485   1HG   GLN  59          HG2       GLN  59  -9.842   0.771  -7.745
  486   2HG   GLN  59          HG1       GLN  59  -9.996   0.568  -6.000
  487   1HE2  GLN  59          HE2       GLN  59 -11.564   1.823  -8.765
  488   2HE2  GLN  59          HE2       GLN  59 -12.750   2.739  -7.967
  489    H    LYS  60           HN       LYS  60  -9.830   0.519  -3.998
  490    HA   LYS  60           HA       LYS  60 -11.371   2.621  -2.720
  491   1HB   LYS  60          HB2       LYS  60 -11.743  -0.003  -3.451
  492   2HB   LYS  60          HB1       LYS  60 -11.534  -0.147  -1.705
  493   1HG   LYS  60          HG2       LYS  60 -13.448   1.051  -1.236
  494   2HG   LYS  60          HG1       LYS  60 -13.324   2.024  -2.702
  495   1HD   LYS  60          HD2       LYS  60 -14.596   0.582  -3.888
  496   2HD   LYS  60          HD1       LYS  60 -13.712  -0.818  -3.277
  497   1HE   LYS  60          HE2       LYS  60 -15.026  -0.276  -1.034
  498   2HE   LYS  60          HE1       LYS  60 -16.159   0.507  -2.156
  499   1HZ   LYS  60          HZ1       LYS  60 -15.892  -1.595  -3.540
  500   2HZ   LYS  60          HZ2       LYS  60 -16.831  -1.717  -2.128
  501   3HZ   LYS  60          HZ3       LYS  60 -15.236  -2.303  -2.145
  502    H    TYR  61           HN       TYR  61  -8.798   0.358  -1.755
  503    HA   TYR  61           HA       TYR  61  -8.914   1.090   1.069
  504   1HB   TYR  61          HB2       TYR  61  -7.338  -0.618  -0.766
  505   2HB   TYR  61          HB1       TYR  61  -6.470  -0.046   0.659
  506    HD1  TYR  61           HD1      TYR  61  -6.566  -1.414   2.533
  507    HD2  TYR  61           HD2      TYR  61  -9.898  -1.343  -0.177
  508    HE1  TYR  61           HE1      TYR  61  -7.734  -3.101   3.925
  509    HE2  TYR  61           HE2      TYR  61 -11.066  -3.030   1.216
  510    HH   TYR  61           HH       TYR  61 -10.930  -3.714   3.772
  511    H    ILE  62           HN       ILE  62  -7.002   2.094  -1.742
  512    HA   ILE  62           HA       ILE  62  -5.060   3.668  -0.350
  513    HB   ILE  62           HB       ILE  62  -6.319   3.996  -3.099
  514   1HG1  ILE  62          HG1       ILE  62  -3.779   2.558  -2.267
  515   2HG1  ILE  62          HG1       ILE  62  -5.308   1.748  -2.610
  516   1HG2  ILE  62          HG2       ILE  62  -4.383   5.574  -1.680
  517   2HG2  ILE  62          HG2       ILE  62  -4.977   5.792  -3.326
  518   3HG2  ILE  62          HG2       ILE  62  -3.579   4.761  -3.023
  519   1HD1  ILE  62          HD1       ILE  62  -3.845   1.730  -4.595
  520   2HD1  ILE  62          HD1       ILE  62  -3.766   3.491  -4.552
  521   3HD1  ILE  62          HD1       ILE  62  -5.297   2.686  -4.892
  522    H    SER  63           HN       SER  63  -8.221   4.557  -1.790
  523    HA   SER  63           HA       SER  63  -8.174   7.316  -1.034
  524   1HB   SER  63          HB2       SER  63 -10.562   5.458  -1.260
  525   2HB   SER  63          HB1       SER  63 -10.544   7.198  -1.535
  526    HG   SER  63           HG       SER  63 -10.416   6.167  -3.511
  527    H    LEU  64           HN       LEU  64  -9.668   4.484   0.579
  528    HA   LEU  64           HA       LEU  64 -10.601   5.833   2.905
  529   1HB   LEU  64          HB2       LEU  64 -10.194   3.146   1.898
  530   2HB   LEU  64          HB1       LEU  64  -9.757   3.223   3.606
  531    HG   LEU  64           HG       LEU  64 -12.235   4.665   2.918
  532   1HD1  LEU  64          HD1       LEU  64 -12.195   2.544   1.443
  533   2HD1  LEU  64          HD1       LEU  64 -13.598   2.776   2.488
  534   3HD1  LEU  64          HD1       LEU  64 -12.326   1.648   2.957
  535   1HD2  LEU  64          HD2       LEU  64 -11.045   3.055   5.095
  536   2HD2  LEU  64          HD2       LEU  64 -12.790   2.882   4.915
  537   3HD2  LEU  64          HD2       LEU  64 -12.085   4.475   5.187
  538    H    LEU  65           HN       LEU  65  -7.513   4.123   2.309
  539    HA   LEU  65           HA       LEU  65  -6.386   4.966   4.876
  540   1HB   LEU  65          HB2       LEU  65  -5.408   3.534   2.399
  541   2HB   LEU  65          HB1       LEU  65  -4.303   3.948   3.707
  542    HG   LEU  65           HG       LEU  65  -6.787   2.221   3.928
  543   1HD1  LEU  65          HD1       LEU  65  -5.116   0.835   3.054
  544   2HD1  LEU  65          HD1       LEU  65  -4.868   0.632   4.788
  545   3HD1  LEU  65          HD1       LEU  65  -3.826   1.715   3.869
  546   1HD2  LEU  65          HD2       LEU  65  -5.244   3.720   5.916
  547   2HD2  LEU  65          HD2       LEU  65  -5.315   1.995   6.272
  548   3HD2  LEU  65          HD2       LEU  65  -6.805   2.920   6.085
  549    H    LYS  66           HN       LYS  66  -7.007   7.359   4.051
  550    HA   LYS  66           HA       LYS  66  -4.983   8.518   2.251
  551   1HB   LYS  66          HB2       LYS  66  -7.619   9.026   2.898
  552   2HB   LYS  66          HB1       LYS  66  -6.762  10.297   3.771
  553   1HG   LYS  66          HG2       LYS  66  -6.009   9.728   0.923
  554   2HG   LYS  66          HG1       LYS  66  -7.465  10.669   1.253
  555   1HD   LYS  66          HD2       LYS  66  -6.218  12.326   2.468
  556   2HD   LYS  66          HD1       LYS  66  -4.766  11.325   2.458
  557   1HE   LYS  66          HE2       LYS  66  -5.089  11.450  -0.178
  558   2HE   LYS  66          HE1       LYS  66  -5.960  12.940   0.234
  559   1HZ   LYS  66          HZ1       LYS  66  -3.668  13.497   0.033
  560   2HZ   LYS  66          HZ2       LYS  66  -3.195  12.198   1.023
  561   3HZ   LYS  66          HZ3       LYS  66  -4.039  13.513   1.688
  562    H    THR  67           HN       THR  67  -3.839   7.393   4.638
  563    HA   THR  67           HA       THR  67  -3.409   9.520   6.587
  564    HB   THR  67           HB       THR  67  -2.018   6.862   6.136
  565    HG1  THR  67           HG1      THR  67  -4.002   6.291   6.632
  566   1HG2  THR  67          HG2       THR  67  -2.078   8.794   8.460
  567   2HG2  THR  67          HG2       THR  67  -0.665   8.239   7.562
  568   3HG2  THR  67          HG2       THR  67  -1.539   7.120   8.608
  569    HA   PRO  68           HA       PRO  68   0.864   9.716   4.476
  570   1HB   PRO  68          HB2       PRO  68   1.141   8.681   1.961
  571   2HB   PRO  68          HB1       PRO  68   1.444   7.737   3.433
  572   1HG   PRO  68          HG2       PRO  68  -0.898   7.709   1.618
  573   2HG   PRO  68          HG1       PRO  68  -0.156   6.387   2.529
  574   1HD   PRO  68          HD2       PRO  68  -2.465   7.698   3.250
  575   2HD   PRO  68          HD1       PRO  68  -1.429   6.780   4.360
  576    H    LYS  69           HN       LYS  69   1.567  11.463   3.088
  577    HA   LYS  69           HA       LYS  69  -0.268  12.482   1.020
  578   1HB   LYS  69          HB2       LYS  69  -0.529  14.645   2.249
  579   2HB   LYS  69          HB1       LYS  69  -1.246  13.286   3.117
  580   1HG   LYS  69          HG2       LYS  69   0.243  13.432   4.825
  581   2HG   LYS  69          HG1       LYS  69   1.597  13.746   3.741
  582   1HD   LYS  69          HD2       LYS  69   0.272  16.067   3.433
  583   2HD   LYS  69          HD1       LYS  69  -0.250  15.666   5.070
  584   1HE   LYS  69          HE2       LYS  69   2.573  15.145   4.853
  585   2HE   LYS  69          HE1       LYS  69   2.238  16.798   4.299
  586   1HZ   LYS  69          HZ1       LYS  69   0.972  15.684   6.730
  587   2HZ   LYS  69          HZ2       LYS  69   1.119  17.312   6.267
  588   3HZ   LYS  69          HZ3       LYS  69   2.483  16.451   6.797
  589    H    GLN  70           HN       GLN  70   0.704  14.447  -0.049
  590    HA   GLN  70           HA       GLN  70   3.610  14.838   0.478
  591   1HB   GLN  70          HB2       GLN  70   2.648  13.056  -1.406
  592   2HB   GLN  70          HB1       GLN  70   2.915  14.513  -2.363
  593   1HG   GLN  70          HG2       GLN  70   5.204  14.563  -1.898
  594   2HG   GLN  70          HG1       GLN  70   5.027  13.596  -0.431
  595   1HE2  GLN  70          HE2       GLN  70   3.484  12.735  -3.518
  596   2HE2  GLN  70          HE2       GLN  70   4.409  11.339  -3.786
  597    H    LEU  71           HN       LEU  71   3.912  17.028   0.517
  598    HA   LEU  71           HA       LEU  71   1.914  18.854  -0.611
  599   1HB   LEU  71          HB2       LEU  71   3.598  18.889   1.515
  600   2HB   LEU  71          HB1       LEU  71   4.559  19.809   0.356
  601    HG   LEU  71           HG       LEU  71   2.444  21.185  -0.083
  602   1HD1  LEU  71          HD1       LEU  71   0.743  19.805   0.856
  603   2HD1  LEU  71          HD1       LEU  71   0.898  21.167   1.964
  604   3HD1  LEU  71          HD1       LEU  71   1.629  19.615   2.369
  605   1HD2  LEU  71          HD2       LEU  71   3.666  22.605   1.175
  606   2HD2  LEU  71          HD2       LEU  71   4.360  21.265   2.090
  607   3HD2  LEU  71          HD2       LEU  71   2.828  21.980   2.596
  Start of MODEL   18
    1   1H    THR   1          HT1       THR   1  18.654   3.379  11.016
    2   2H    THR   1          HT2       THR   1  19.300   1.942  10.380
    3   3H    THR   1          HT3       THR   1  17.953   1.887  11.415
    4    HA   THR   1           HA       THR   1  16.726   3.248   9.684
    5    HB   THR   1           HB       THR   1  19.155   2.318   8.118
    6    HG1  THR   1           HG1      THR   1  19.978   4.137   8.705
    7   1HG2  THR   1          HG2       THR   1  17.680   4.323   6.775
    8   2HG2  THR   1          HG2       THR   1  16.505   3.139   7.347
    9   3HG2  THR   1          HG2       THR   1  17.845   2.627   6.321
   10    H    ARG   2           HN       ARG   2  16.203   0.920  10.961
   11    HA   ARG   2           HA       ARG   2  15.245  -0.819   8.804
   12   1HB   ARG   2          HB2       ARG   2  17.729  -1.336   9.288
   13   2HB   ARG   2          HB1       ARG   2  17.163  -1.994  10.824
   14   1HG   ARG   2          HG2       ARG   2  16.790  -3.926   9.715
   15   2HG   ARG   2          HG1       ARG   2  15.428  -3.105   8.951
   16   1HD   ARG   2          HD2       ARG   2  17.882  -2.341   7.625
   17   2HD   ARG   2          HD1       ARG   2  17.728  -4.108   7.653
   18    HE   ARG   2           HE       ARG   2  15.368  -2.467   6.862
   19   1HH1  ARG   2          HH2       ARG   2  17.485  -2.779   4.713
   20   2HH1  ARG   2          HH2       ARG   2  16.925  -4.192   3.882
   21   1HH2  ARG   2          HH1       ARG   2  14.778  -5.161   6.427
   22   2HH2  ARG   2          HH1       ARG   2  15.391  -5.541   4.852
   23    H    GLY   3           HN       GLY   3  14.247   0.718  11.210
   24   1HA   GLY   3          HA2       GLY   3  12.684  -1.519  12.384
   25   2HA   GLY   3          HA1       GLY   3  13.513  -0.418  13.486
   26    H    SER   4           HN       SER   4  11.957   0.470  10.425
   27    HA   SER   4           HA       SER   4   9.721   1.757  11.908
   28   1HB   SER   4          HB2       SER   4  11.621   3.350  11.840
   29   2HB   SER   4          HB1       SER   4  11.678   3.198  10.086
   30    HG   SER   4           HG       SER   4  10.245   4.731  10.105
   31    H    ASP   5           HN       ASP   5   8.195   2.822  10.210
   32    HA   ASP   5           HA       ASP   5   7.554   0.839   8.181
   33   1HB   ASP   5          HB2       ASP   5   5.695   2.428   7.740
   34   2HB   ASP   5          HB1       ASP   5   5.881   2.118   9.466
   35    H    ILE   6           HN       ILE   6   9.968   1.369   7.312
   36    HA   ILE   6           HA       ILE   6   9.677   3.434   5.149
   37    HB   ILE   6           HB       ILE   6  12.131   2.470   6.654
   38   1HG1  ILE   6          HG1       ILE   6  10.675   5.132   6.738
   39   2HG1  ILE   6          HG1       ILE   6  10.577   3.890   7.988
   40   1HG2  ILE   6          HG2       ILE   6  11.885   3.702   4.113
   41   2HG2  ILE   6          HG2       ILE   6  13.361   3.448   5.043
   42   3HG2  ILE   6          HG2       ILE   6  12.452   4.948   5.225
   43   1HD1  ILE   6          HD1       ILE   6  13.342   4.473   7.320
   44   2HD1  ILE   6          HD1       ILE   6  12.539   4.537   8.888
   45   3HD1  ILE   6          HD1       ILE   6  12.489   5.935   7.815
   46    H    SER   7           HN       SER   7   8.767   0.789   4.728
   47    HA   SER   7           HA       SER   7  10.956  -0.509   3.179
   48   1HB   SER   7          HB2       SER   7   8.933  -1.395   4.964
   49   2HB   SER   7          HB1       SER   7   8.524  -2.035   3.375
   50    HG   SER   7           HG       SER   7  10.760  -2.490   4.991
   51    H    LYS   8           HN       LYS   8   9.451   1.856   2.190
   52    HA   LYS   8           HA       LYS   8   7.424   1.026   0.311
   53   1HB   LYS   8          HB2       LYS   8   7.772   3.315  -0.558
   54   2HB   LYS   8          HB1       LYS   8   7.729   3.318   1.205
   55   1HG   LYS   8          HG2       LYS   8  10.400   2.882   0.695
   56   2HG   LYS   8          HG1       LYS   8   9.944   3.976  -0.612
   57   1HD   LYS   8          HD2       LYS   8   8.871   5.467   1.117
   58   2HD   LYS   8          HD1       LYS   8   9.572   4.431   2.360
   59   1HE   LYS   8          HE2       LYS   8  11.842   4.861   1.234
   60   2HE   LYS   8          HE1       LYS   8  11.025   6.163   0.346
   61   1HZ   LYS   8          HZ1       LYS   8  10.133   6.851   2.608
   62   2HZ   LYS   8          HZ2       LYS   8  11.773   7.174   2.305
   63   3HZ   LYS   8          HZ3       LYS   8  11.330   5.850   3.273
   64    H    THR   9           HN       THR   9   8.834  -0.913  -0.454
   65    HA   THR   9           HA       THR   9  10.780  -0.068  -2.568
   66    HB   THR   9           HB       THR   9  11.608  -1.571  -0.812
   67    HG1  THR   9           HG1      THR   9  12.294  -1.918  -2.979
   68   1HG2  THR   9          HG2       THR   9   9.067  -2.987  -1.456
   69   2HG2  THR   9          HG2       THR   9   9.862  -2.756   0.102
   70   3HG2  THR   9          HG2       THR   9  10.456  -3.981  -1.019
   71    H    CYS  10           HN       CYS  10  10.673  -2.458  -4.064
   72    HA   CYS  10           HA       CYS  10   8.367  -1.977  -5.754
   73   1HB   CYS  10          HB2       CYS  10  10.361  -4.268  -5.689
   74   2HB   CYS  10          HB1       CYS  10   9.366  -3.793  -7.062
   75    H    CYS  11           HN       CYS  11   7.260  -4.271  -6.492
   76    HA   CYS  11           HA       CYS  11   6.414  -5.735  -4.022
   77   1HB   CYS  11          HB2       CYS  11   4.776  -4.257  -6.079
   78   2HB   CYS  11          HB1       CYS  11   4.069  -5.587  -5.163
   79    H    PHE  12           HN       PHE  12   5.109  -7.765  -4.726
   80    HA   PHE  12           HA       PHE  12   5.844  -8.769  -7.415
   81   1HB   PHE  12          HB2       PHE  12   6.700  -9.964  -4.764
   82   2HB   PHE  12          HB1       PHE  12   6.846 -10.804  -6.308
   83    HD1  PHE  12           HD1      PHE  12   8.517  -8.700  -4.027
   84    HD2  PHE  12           HD2      PHE  12   7.998  -9.369  -8.238
   85    HE1  PHE  12           HE1      PHE  12  10.642  -7.503  -4.479
   86    HE2  PHE  12           HE2      PHE  12  10.124  -8.174  -8.690
   87    HZ   PHE  12           HZ       PHE  12  11.446  -7.241  -6.811
   88    H    GLN  13           HN       GLN  13   4.615 -10.078  -4.306
   89    HA   GLN  13           HA       GLN  13   2.525 -11.571  -5.749
   90   1HB   GLN  13          HB2       GLN  13   2.100 -12.468  -3.474
   91   2HB   GLN  13          HB1       GLN  13   3.812 -12.557  -3.889
   92   1HG   GLN  13          HG2       GLN  13   4.398 -11.095  -2.261
   93   2HG   GLN  13          HG1       GLN  13   3.053 -10.015  -2.632
   94   1HE2  GLN  13          HE2       GLN  13   3.869 -10.831   0.077
   95   2HE2  GLN  13          HE2       GLN  13   2.556 -11.670   0.750
   96    H    TYR  14           HN       TYR  14   0.224 -11.331  -5.101
   97    HA   TYR  14           HA       TYR  14  -0.442  -8.654  -3.964
   98   1HB   TYR  14          HB2       TYR  14  -1.588  -9.954  -6.455
   99   2HB   TYR  14          HB1       TYR  14  -2.078  -8.393  -5.798
  100    HD1  TYR  14           HD1      TYR  14  -0.035  -6.727  -5.320
  101    HD2  TYR  14           HD2      TYR  14   0.015  -9.961  -8.145
  102    HE1  TYR  14           HE1      TYR  14   1.817  -5.625  -6.548
  103    HE2  TYR  14           HE2      TYR  14   1.867  -8.860  -9.373
  104    HH   TYR  14           HH       TYR  14   2.727  -6.466  -9.641
  105    H    SER  15           HN       SER  15  -1.925  -8.884  -2.337
  106    HA   SER  15           HA       SER  15  -3.202 -11.472  -1.850
  107   1HB   SER  15          HB2       SER  15  -2.973  -8.796  -0.518
  108   2HB   SER  15          HB1       SER  15  -4.224  -9.906   0.030
  109    HG   SER  15           HG       SER  15  -2.610 -10.677   1.161
  110    H    HIS  16           HN       HIS  16  -5.487 -11.828  -1.836
  111    HA   HIS  16           HA       HIS  16  -7.119  -9.767  -3.283
  112   1HB   HIS  16          HB2       HIS  16  -6.350 -11.782  -4.624
  113   2HB   HIS  16          HB1       HIS  16  -7.308 -12.784  -3.533
  114    HD1  HIS  16           HD1      HIS  16  -9.741 -13.021  -4.080
  115    HD2  HIS  16           HD2      HIS  16  -8.029  -9.755  -6.023
  116    HE1  HIS  16           HE1      HIS  16 -11.519 -12.095  -5.627
  117    H    LYS  17           HN       LYS  17  -7.502  -9.336  -0.804
  118    HA   LYS  17           HA       LYS  17 -10.079 -10.525  -0.093
  119   1HB   LYS  17          HB2       LYS  17  -7.561 -11.610   0.838
  120   2HB   LYS  17          HB1       LYS  17  -8.495 -10.998   2.203
  121   1HG   LYS  17          HG2       LYS  17 -10.291 -12.372   0.457
  122   2HG   LYS  17          HG1       LYS  17  -8.897 -13.416   0.735
  123   1HD   LYS  17          HD2       LYS  17  -9.499 -13.803   2.875
  124   2HD   LYS  17          HD1       LYS  17  -9.763 -12.087   3.183
  125   1HE   LYS  17          HE2       LYS  17 -11.893 -12.736   1.530
  126   2HE   LYS  17          HE1       LYS  17 -11.728 -14.172   2.562
  127   1HZ   LYS  17          HZ1       LYS  17 -11.825 -12.875   4.497
  128   2HZ   LYS  17          HZ2       LYS  17 -13.066 -12.258   3.512
  129   3HZ   LYS  17          HZ3       LYS  17 -11.593 -11.423   3.652
  130    HA   PRO  18           HA       PRO  18 -10.249  -6.565   1.855
  131   1HB   PRO  18          HB2       PRO  18 -12.405  -6.951   3.494
  132   2HB   PRO  18          HB1       PRO  18 -12.554  -6.728   1.739
  133   1HG   PRO  18          HG2       PRO  18 -12.669  -9.224   3.347
  134   2HG   PRO  18          HG1       PRO  18 -13.592  -8.761   1.909
  135   1HD   PRO  18          HD2       PRO  18 -11.453 -10.474   1.868
  136   2HD   PRO  18          HD1       PRO  18 -11.973  -9.498   0.477
  137    H    LEU  19           HN       LEU  19  -8.520  -6.277   3.242
  138    HA   LEU  19           HA       LEU  19  -7.936  -7.953   5.516
  139   1HB   LEU  19          HB2       LEU  19  -6.700  -6.019   3.975
  140   2HB   LEU  19          HB1       LEU  19  -6.929  -5.187   5.513
  141    HG   LEU  19           HG       LEU  19  -6.008  -7.911   5.925
  142   1HD1  LEU  19          HD1       LEU  19  -4.711  -7.953   4.017
  143   2HD1  LEU  19          HD1       LEU  19  -3.612  -7.073   5.081
  144   3HD1  LEU  19          HD1       LEU  19  -4.610  -6.195   3.921
  145   1HD2  LEU  19          HD2       LEU  19  -4.616  -5.291   6.530
  146   2HD2  LEU  19          HD2       LEU  19  -4.479  -6.815   7.407
  147   3HD2  LEU  19          HD2       LEU  19  -5.975  -5.883   7.486
  148    HA   PRO  20           HA       PRO  20 -10.615  -6.147   8.524
  149   1HB   PRO  20          HB2       PRO  20  -9.124  -6.512  10.797
  150   2HB   PRO  20          HB1       PRO  20  -9.985  -7.834   9.981
  151   1HG   PRO  20          HG2       PRO  20  -7.102  -7.088   9.846
  152   2HG   PRO  20          HG1       PRO  20  -7.849  -8.692   9.936
  153   1HD   PRO  20          HD2       PRO  20  -6.911  -7.649   7.621
  154   2HD   PRO  20          HD1       PRO  20  -8.297  -8.759   7.680
  155    H    TRP  21           HN       TRP  21 -10.743  -3.933   8.294
  156    HA   TRP  21           HA       TRP  21  -8.741  -2.021   8.137
  157   1HB   TRP  21          HB2       TRP  21 -11.521  -1.978   9.325
  158   2HB   TRP  21          HB1       TRP  21 -10.572  -0.505   9.103
  159    HD1  TRP  21           HD1      TRP  21 -12.754  -2.901   7.271
  160    HE1  TRP  21           HE1      TRP  21 -12.790  -2.324   4.757
  161    HE3  TRP  21           HE3      TRP  21  -8.933   0.476   7.089
  162    HZ2  TRP  21           HZ2      TRP  21 -11.377  -0.648   2.915
  163    HZ3  TRP  21           HZ3      TRP  21  -8.301   1.547   4.949
  164    HH2  TRP  21           HH2      TRP  21  -9.516   0.990   2.862
  165    H    THR  22           HN       THR  22  -9.978  -3.560  11.070
  166    HA   THR  22           HA       THR  22  -8.909  -1.786  13.019
  167    HB   THR  22           HB       THR  22  -8.998  -3.845  14.438
  168    HG1  THR  22           HG1      THR  22  -9.522  -5.777  13.448
  169   1HG2  THR  22          HG2       THR  22 -11.411  -4.005  12.692
  170   2HG2  THR  22          HG2       THR  22 -11.056  -2.460  13.464
  171   3HG2  THR  22          HG2       THR  22 -11.304  -3.902  14.449
  172    H    TRP  23           HN       TRP  23  -7.421  -4.378  11.131
  173    HA   TRP  23           HA       TRP  23  -4.827  -4.020  12.522
  174   1HB   TRP  23          HB2       TRP  23  -6.265  -6.139  11.355
  175   2HB   TRP  23          HB1       TRP  23  -4.891  -5.867  10.285
  176    HD1  TRP  23           HD1      TRP  23  -5.032  -5.504  14.125
  177    HE1  TRP  23           HE1      TRP  23  -3.216  -7.027  15.144
  178    HE3  TRP  23           HE3      TRP  23  -3.299  -7.763   9.887
  179    HZ2  TRP  23           HZ2      TRP  23  -1.283  -8.950  14.272
  180    HZ3  TRP  23           HZ3      TRP  23  -1.473  -9.435  10.009
  181    HH2  TRP  23           HH2      TRP  23  -0.464 -10.030  12.194
  182    H    VAL  24           HN       VAL  24  -6.330  -2.318  10.190
  183    HA   VAL  24           HA       VAL  24  -3.967  -2.143   8.385
  184    HB   VAL  24           HB       VAL  24  -6.795  -1.086   8.102
  185   1HG1  VAL  24          HG1       VAL  24  -6.223  -0.429   5.945
  186   2HG1  VAL  24          HG1       VAL  24  -4.894  -1.584   5.836
  187   3HG1  VAL  24          HG1       VAL  24  -4.707  -0.112   6.789
  188   1HG2  VAL  24          HG2       VAL  24  -7.409  -3.102   7.246
  189   2HG2  VAL  24          HG2       VAL  24  -5.981  -3.731   8.065
  190   3HG2  VAL  24          HG2       VAL  24  -5.894  -3.281   6.363
  191    H    ARG  25           HN       ARG  25  -2.750  -0.217   8.365
  192    HA   ARG  25           HA       ARG  25  -3.785   1.977  10.125
  193   1HB   ARG  25          HB2       ARG  25  -1.490   2.314  10.825
  194   2HB   ARG  25          HB1       ARG  25  -1.876   0.603  10.987
  195   1HG   ARG  25          HG2       ARG  25   0.029   0.269   9.804
  196   2HG   ARG  25          HG1       ARG  25  -0.939   0.724   8.405
  197   1HD   ARG  25          HD2       ARG  25   1.068   2.098   8.393
  198   2HD   ARG  25          HD1       ARG  25  -0.282   3.143   8.880
  199    HE   ARG  25           HE       ARG  25   0.629   2.064  11.271
  200   1HH1  ARG  25          HH1       ARG  25   1.104   4.805   9.532
  201   2HH1  ARG  25          HH1       ARG  25   2.705   5.144  10.101
  202   1HH2  ARG  25          HH2       ARG  25   3.098   2.059  11.636
  203   2HH2  ARG  25          HH2       ARG  25   3.834   3.588  11.293
  204    H    SER  26           HN       SER  26  -2.163   1.248   7.040
  205    HA   SER  26           HA       SER  26  -2.977   3.813   5.947
  206   1HB   SER  26          HB2       SER  26  -0.770   4.852   5.865
  207   2HB   SER  26          HB1       SER  26  -1.152   4.448   7.534
  208    HG   SER  26           HG       SER  26   0.692   3.313   5.770
  209    H    TYR  27           HN       TYR  27  -0.861   4.109   4.053
  210    HA   TYR  27           HA       TYR  27  -0.476   1.510   2.737
  211   1HB   TYR  27          HB2       TYR  27  -1.959   1.888   0.941
  212   2HB   TYR  27          HB1       TYR  27  -2.862   2.456   2.339
  213    HD1  TYR  27           HD1      TYR  27  -1.712   3.286  -0.906
  214    HD2  TYR  27           HD2      TYR  27  -2.558   5.008   2.936
  215    HE1  TYR  27           HE1      TYR  27  -1.892   5.523  -1.951
  216    HE2  TYR  27           HE2      TYR  27  -2.740   7.246   1.893
  217    HH   TYR  27           HH       TYR  27  -1.547   8.158  -0.725
  218    H    GLU  28           HN       GLU  28   0.211   2.275   0.231
  219    HA   GLU  28           HA       GLU  28   1.665   4.709  -0.086
  220   1HB   GLU  28          HB2       GLU  28   3.982   3.712   0.221
  221   2HB   GLU  28          HB1       GLU  28   3.067   3.899   1.716
  222   1HG   GLU  28          HG2       GLU  28   3.435   1.709   2.100
  223   2HG   GLU  28          HG1       GLU  28   2.343   1.366   0.758
  224    H    PHE  29           HN       PHE  29   2.743   4.761  -2.163
  225    HA   PHE  29           HA       PHE  29   1.982   2.480  -3.935
  226   1HB   PHE  29          HB2       PHE  29   1.642   5.223  -4.075
  227   2HB   PHE  29          HB1       PHE  29   3.035   4.955  -5.123
  228    HD1  PHE  29           HD1      PHE  29   2.847   3.051  -6.879
  229    HD2  PHE  29           HD2      PHE  29  -0.529   4.781  -4.862
  230    HE1  PHE  29           HE1      PHE  29   1.347   2.200  -8.660
  231    HE2  PHE  29           HE2      PHE  29  -2.029   3.930  -6.644
  232    HZ   PHE  29           HZ       PHE  29  -1.091   2.640  -8.544
  233    H    THR  30           HN       THR  30   3.560   1.612  -5.410
  234    HA   THR  30           HA       THR  30   6.248   1.392  -4.381
  235    HB   THR  30           HB       THR  30   6.439   0.370  -6.839
  236    HG1  THR  30           HG1      THR  30   4.546   1.211  -7.635
  237   1HG2  THR  30          HG2       THR  30   4.531  -1.276  -5.408
  238   2HG2  THR  30          HG2       THR  30   5.720  -0.590  -4.300
  239   3HG2  THR  30          HG2       THR  30   6.252  -1.550  -5.682
  240    H    SER  31           HN       SER  31   8.199   1.921  -5.807
  241    HA   SER  31           HA       SER  31   8.023   4.731  -6.676
  242   1HB   SER  31          HB2       SER  31   9.916   2.998  -5.481
  243   2HB   SER  31          HB1       SER  31  10.588   3.457  -7.044
  244    HG   SER  31           HG       SER  31  10.396   5.594  -6.478
  245    H    ASN  32           HN       ASN  32   9.442   5.211  -8.742
  246    HA   ASN  32           HA       ASN  32   8.230   3.759 -10.980
  247   1HB   ASN  32          HB2       ASN  32   8.587   6.234 -10.854
  248   2HB   ASN  32          HB1       ASN  32  10.328   5.952 -10.892
  249   1HD2  ASN  32          HD2       ASN  32   8.007   6.966 -12.913
  250   2HD2  ASN  32          HD2       ASN  32   8.517   6.264 -14.372
  251    H    SER  33           HN       SER  33  11.339   3.829  -9.339
  252    HA   SER  33           HA       SER  33  12.998   2.679 -11.344
  253   1HB   SER  33          HB2       SER  33  13.004   3.248  -8.509
  254   2HB   SER  33          HB1       SER  33  13.751   1.679  -8.804
  255    HG   SER  33           HG       SER  33  14.372   4.040 -10.253
  256    H    CYS  34           HN       CYS  34  10.522   1.265  -9.313
  257    HA   CYS  34           HA       CYS  34  11.356  -1.495  -9.541
  258   1HB   CYS  34          HB2       CYS  34   8.695  -0.135  -9.005
  259   2HB   CYS  34          HB1       CYS  34   8.981  -1.862  -8.791
  260    H    SER  35           HN       SER  35  10.696  -3.056 -11.062
  261    HA   SER  35           HA       SER  35   9.848  -2.056 -13.685
  262   1HB   SER  35          HB2       SER  35  11.428  -3.757 -13.834
  263   2HB   SER  35          HB1       SER  35  10.787  -4.611 -12.434
  264    HG   SER  35           HG       SER  35   9.340  -4.338 -14.851
  265    H    GLN  36           HN       GLN  36   8.333  -3.482 -10.898
  266    HA   GLN  36           HA       GLN  36   5.806  -3.870 -12.470
  267   1HB   GLN  36          HB2       GLN  36   7.080  -5.314 -10.146
  268   2HB   GLN  36          HB1       GLN  36   5.351  -5.465 -10.462
  269   1HG   GLN  36          HG2       GLN  36   5.763  -6.964 -12.083
  270   2HG   GLN  36          HG1       GLN  36   6.753  -5.782 -12.940
  271   1HE2  GLN  36          HE2       GLN  36   7.025  -8.844 -11.983
  272   2HE2  GLN  36          HE2       GLN  36   8.644  -8.894 -11.475
  273    H    ARG  37           HN       ARG  37   4.933  -1.767 -12.074
  274    HA   ARG  37           HA       ARG  37   4.984  -0.462  -9.508
  275   1HB   ARG  37          HB2       ARG  37   3.303   1.000 -10.586
  276   2HB   ARG  37          HB1       ARG  37   4.636   0.654 -11.688
  277   1HG   ARG  37          HG2       ARG  37   3.349  -0.913 -12.925
  278   2HG   ARG  37          HG1       ARG  37   2.114  -1.009 -11.670
  279   1HD   ARG  37          HD2       ARG  37   1.182   0.389 -13.387
  280   2HD   ARG  37          HD1       ARG  37   1.709   1.503 -12.110
  281    HE   ARG  37           HE       ARG  37   3.504   0.855 -14.415
  282   1HH1  ARG  37          HH2       ARG  37   3.472   2.789 -11.786
  283   2HH1  ARG  37          HH2       ARG  37   3.567   4.303 -12.623
  284   1HH2  ARG  37          HH1       ARG  37   2.941   2.922 -15.740
  285   2HH2  ARG  37          HH1       ARG  37   3.265   4.377 -14.861
  286    H    ALA  38           HN       ALA  38   3.427  -0.457  -7.856
  287    HA   ALA  38           HA       ALA  38   0.845  -1.777  -8.101
  288   1HB   ALA  38          HB1       ALA  38   2.165  -3.341  -6.122
  289   2HB   ALA  38          HB2       ALA  38   3.211  -3.318  -7.542
  290   3HB   ALA  38          HB3       ALA  38   1.546  -3.883  -7.682
  291    H    VAL  39           HN       VAL  39  -0.424  -1.430  -6.190
  292    HA   VAL  39           HA       VAL  39   0.571   0.716  -4.441
  293    HB   VAL  39           HB       VAL  39  -2.042  -0.814  -4.647
  294   1HG1  VAL  39          HG1       VAL  39  -2.917   1.193  -3.347
  295   2HG1  VAL  39          HG1       VAL  39  -1.235   1.596  -3.002
  296   3HG1  VAL  39          HG1       VAL  39  -1.913   0.075  -2.423
  297   1HG2  VAL  39          HG2       VAL  39  -2.592   0.636  -6.291
  298   2HG2  VAL  39          HG2       VAL  39  -0.892   1.101  -6.331
  299   3HG2  VAL  39          HG2       VAL  39  -2.033   2.016  -5.345
  300    H    ILE  40           HN       ILE  40   0.409   0.508  -2.054
  301    HA   ILE  40           HA       ILE  40   0.653  -2.304  -1.069
  302    HB   ILE  40           HB       ILE  40   2.469   0.086  -0.689
  303   1HG1  ILE  40          HG1       ILE  40   3.395  -2.673  -1.321
  304   2HG1  ILE  40          HG1       ILE  40   2.574  -1.776  -2.599
  305   1HG2  ILE  40          HG2       ILE  40   2.200  -0.874   1.514
  306   2HG2  ILE  40          HG2       ILE  40   3.756  -1.408   0.876
  307   3HG2  ILE  40          HG2       ILE  40   2.377  -2.506   0.870
  308   1HD1  ILE  40          HD1       ILE  40   5.015  -1.392  -2.673
  309   2HD1  ILE  40          HD1       ILE  40   4.966  -0.790  -1.017
  310   3HD1  ILE  40          HD1       ILE  40   4.148   0.097  -2.303
  311    H    PHE  41           HN       PHE  41   0.016  -2.556   1.141
  312    HA   PHE  41           HA       PHE  41  -1.314  -0.185   2.410
  313   1HB   PHE  41          HB2       PHE  41  -2.310  -3.037   2.066
  314   2HB   PHE  41          HB1       PHE  41  -3.124  -1.814   3.046
  315    HD1  PHE  41           HD1      PHE  41  -3.234  -3.331  -0.050
  316    HD2  PHE  41           HD2      PHE  41  -3.222   0.577   1.699
  317    HE1  PHE  41           HE1      PHE  41  -4.318  -2.418  -2.087
  318    HE2  PHE  41           HE2      PHE  41  -4.310   1.499  -0.328
  319    HZ   PHE  41           HZ       PHE  41  -4.858   0.000  -2.224
  320    H    THR  42           HN       THR  42  -0.698   0.019   4.580
  321    HA   THR  42           HA       THR  42   0.951  -2.199   5.676
  322    HB   THR  42           HB       THR  42   0.790   0.424   7.051
  323    HG1  THR  42           HG1      THR  42   1.905   0.097   4.466
  324   1HG2  THR  42          HG2       THR  42   2.464  -0.983   7.872
  325   2HG2  THR  42          HG2       THR  42   3.358   0.039   6.745
  326   3HG2  THR  42          HG2       THR  42   2.875  -1.589   6.267
  327    H    THR  43           HN       THR  43   0.584  -3.009   7.785
  328    HA   THR  43           HA       THR  43  -2.192  -2.586   8.789
  329    HB   THR  43           HB       THR  43  -1.745  -4.820   9.865
  330    HG1  THR  43           HG1      THR  43   0.325  -5.162  10.036
  331   1HG2  THR  43          HG2       THR  43  -2.630  -4.378   7.439
  332   2HG2  THR  43          HG2       THR  43  -2.159  -6.013   7.900
  333   3HG2  THR  43          HG2       THR  43  -1.061  -5.016   6.946
  334    H    LYS  44           HN       LYS  44  -2.311  -3.029  11.278
  335    HA   LYS  44           HA       LYS  44  -0.783  -0.988  12.632
  336   1HB   LYS  44          HB2       LYS  44  -2.891  -2.999  13.218
  337   2HB   LYS  44          HB1       LYS  44  -1.973  -2.405  14.602
  338   1HG   LYS  44          HG2       LYS  44  -2.748  -0.261  12.768
  339   2HG   LYS  44          HG1       LYS  44  -4.138  -1.120  13.433
  340   1HD   LYS  44          HD2       LYS  44  -3.455  -0.679  15.681
  341   2HD   LYS  44          HD1       LYS  44  -1.863  -0.126  15.161
  342   1HE   LYS  44          HE2       LYS  44  -2.830   1.953  15.351
  343   2HE   LYS  44          HE1       LYS  44  -3.482   1.570  13.744
  344   1HZ   LYS  44          HZ1       LYS  44  -5.443   0.691  14.695
  345   2HZ   LYS  44          HZ2       LYS  44  -5.187   2.184  15.463
  346   3HZ   LYS  44          HZ3       LYS  44  -4.804   0.737  16.265
  347    H    ARG  45           HN       ARG  45  -0.236  -4.362  12.031
  348    HA   ARG  45           HA       ARG  45   1.638  -4.649  14.303
  349   1HB   ARG  45          HB2       ARG  45   0.084  -6.455  13.650
  350   2HB   ARG  45          HB1       ARG  45   0.816  -6.504  12.046
  351   1HG   ARG  45          HG2       ARG  45   2.629  -7.661  12.775
  352   2HG   ARG  45          HG1       ARG  45   2.753  -6.710  14.255
  353   1HD   ARG  45          HD2       ARG  45   0.479  -8.066  14.810
  354   2HD   ARG  45          HD1       ARG  45   1.289  -9.254  13.769
  355    HE   ARG  45           HE       ARG  45   3.167  -9.271  15.311
  356   1HH1  ARG  45          HH1       ARG  45   2.061  -6.318  16.061
  357   2HH1  ARG  45          HH1       ARG  45   1.895  -6.558  17.768
  358   1HH2  ARG  45          HH2       ARG  45   2.295  -9.998  17.593
  359   2HH2  ARG  45          HH2       ARG  45   2.027  -8.641  18.635
  360    H    GLY  46           HN       GLY  46   2.047  -2.876  11.753
  361   1HA   GLY  46          HA2       GLY  46   3.946  -2.198  10.548
  362   2HA   GLY  46          HA1       GLY  46   4.889  -3.300  11.552
  363    H    LYS  47           HN       LYS  47   2.151  -4.518   9.774
  364    HA   LYS  47           HA       LYS  47   4.015  -6.135   8.120
  365   1HB   LYS  47          HB2       LYS  47   1.772  -6.704   9.641
  366   2HB   LYS  47          HB1       LYS  47   1.136  -6.688   7.995
  367   1HG   LYS  47          HG2       LYS  47   1.911  -8.817   7.877
  368   2HG   LYS  47          HG1       LYS  47   3.496  -8.070   7.683
  369   1HD   LYS  47          HD2       LYS  47   4.063  -9.254   9.535
  370   2HD   LYS  47          HD1       LYS  47   3.176  -8.007  10.412
  371   1HE   LYS  47          HE2       LYS  47   1.322  -9.366  10.745
  372   2HE   LYS  47          HE1       LYS  47   1.625 -10.310   9.273
  373   1HZ   LYS  47          HZ1       LYS  47   2.291 -11.665  11.077
  374   2HZ   LYS  47          HZ2       LYS  47   3.138 -10.395  11.824
  375   3HZ   LYS  47          HZ3       LYS  47   3.722 -11.079  10.382
  376    H    LYS  48           HN       LYS  48   4.504  -4.711   6.386
  377    HA   LYS  48           HA       LYS  48   2.406  -3.221   4.995
  378   1HB   LYS  48          HB2       LYS  48   4.806  -2.528   5.304
  379   2HB   LYS  48          HB1       LYS  48   5.268  -3.826   4.202
  380   1HG   LYS  48          HG2       LYS  48   4.833  -2.490   2.448
  381   2HG   LYS  48          HG1       LYS  48   3.155  -2.353   2.975
  382   1HD   LYS  48          HD2       LYS  48   4.099  -0.121   2.861
  383   2HD   LYS  48          HD1       LYS  48   3.862  -0.539   4.558
  384   1HE   LYS  48          HE2       LYS  48   6.367  -1.456   4.296
  385   2HE   LYS  48          HE1       LYS  48   6.410  -0.209   3.033
  386   1HZ   LYS  48          HZ1       LYS  48   6.898   0.515   5.426
  387   2HZ   LYS  48          HZ2       LYS  48   5.228   0.340   5.685
  388   3HZ   LYS  48          HZ3       LYS  48   5.801   1.446   4.528
  389    H    VAL  49           HN       VAL  49   1.215  -3.965   3.272
  390    HA   VAL  49           HA       VAL  49   2.100  -6.543   1.996
  391    HB   VAL  49           HB       VAL  49  -0.685  -5.461   2.521
  392   1HG1  VAL  49          HG1       VAL  49  -1.115  -6.878   0.774
  393   2HG1  VAL  49          HG1       VAL  49  -0.985  -8.108   2.030
  394   3HG1  VAL  49          HG1       VAL  49   0.395  -7.763   0.988
  395   1HG2  VAL  49          HG2       VAL  49  -0.386  -6.302   4.594
  396   2HG2  VAL  49          HG2       VAL  49   1.204  -6.928   4.159
  397   3HG2  VAL  49          HG2       VAL  49  -0.237  -7.900   3.862
  398    H    CYS  50           HN       CYS  50   2.077  -6.632  -0.247
  399    HA   CYS  50           HA       CYS  50   1.733  -4.086  -1.722
  400   1HB   CYS  50          HB2       CYS  50   2.851  -6.842  -2.231
  401   2HB   CYS  50          HB1       CYS  50   2.552  -5.753  -3.584
  402    H    THR  51           HN       THR  51   0.258  -3.898  -3.518
  403    HA   THR  51           HA       THR  51  -1.668  -6.109  -4.001
  404    HB   THR  51           HB       THR  51  -3.571  -4.555  -3.581
  405    HG1  THR  51           HG1      THR  51  -2.682  -2.584  -3.904
  406   1HG2  THR  51          HG2       THR  51  -2.364  -6.004  -1.769
  407   2HG2  THR  51          HG2       THR  51  -3.550  -4.803  -1.263
  408   3HG2  THR  51          HG2       THR  51  -1.827  -4.447  -1.139
  409    H    HIS  52           HN       HIS  52  -2.767  -5.849  -6.060
  410    HA   HIS  52           HA       HIS  52  -1.219  -4.387  -8.049
  411   1HB   HIS  52          HB2       HIS  52  -2.789  -6.632  -7.963
  412   2HB   HIS  52          HB1       HIS  52  -3.871  -5.485  -8.755
  413    HD1  HIS  52           HD1      HIS  52  -0.088  -5.834  -9.085
  414    HD2  HIS  52           HD2      HIS  52  -3.518  -6.041 -11.446
  415    HE1  HIS  52           HE1      HIS  52   0.703  -6.130 -11.472
  416    HA   PRO  53           HA       PRO  53  -3.645  -0.696  -8.060
  417   1HB   PRO  53          HB2       PRO  53  -2.966   0.264 -10.524
  418   2HB   PRO  53          HB1       PRO  53  -1.855   0.293  -9.141
  419   1HG   PRO  53          HG2       PRO  53  -1.923  -1.535 -11.473
  420   2HG   PRO  53          HG1       PRO  53  -0.541  -0.915 -10.560
  421   1HD   PRO  53          HD2       PRO  53  -1.616  -3.447 -10.289
  422   2HD   PRO  53          HD1       PRO  53  -0.608  -2.630  -9.075
  423    H    ARG  54           HN       ARG  54  -3.882  -2.995 -10.737
  424    HA   ARG  54           HA       ARG  54  -6.111  -1.909 -12.129
  425   1HB   ARG  54          HB2       ARG  54  -4.821  -4.573 -11.723
  426   2HB   ARG  54          HB1       ARG  54  -6.420  -4.557 -12.468
  427   1HG   ARG  54          HG2       ARG  54  -4.846  -2.475 -13.654
  428   2HG   ARG  54          HG1       ARG  54  -3.915  -3.974 -13.694
  429   1HD   ARG  54          HD2       ARG  54  -5.792  -5.145 -14.769
  430   2HD   ARG  54          HD1       ARG  54  -6.772  -3.667 -14.689
  431    HE   ARG  54           HE       ARG  54  -4.677  -4.173 -16.616
  432   1HH1  ARG  54          HH1       ARG  54  -6.926  -2.284 -17.100
  433   2HH1  ARG  54          HH1       ARG  54  -6.139  -0.742 -17.039
  434   1HH2  ARG  54          HH2       ARG  54  -3.298  -1.957 -15.466
  435   2HH2  ARG  54          HH2       ARG  54  -4.085  -0.558 -16.114
  436    H    LYS  55           HN       LYS  55  -6.102  -4.440  -9.590
  437    HA   LYS  55           HA       LYS  55  -8.845  -4.839  -9.227
  438   1HB   LYS  55          HB2       LYS  55  -6.594  -4.619  -7.208
  439   2HB   LYS  55          HB1       LYS  55  -8.160  -5.361  -6.876
  440   1HG   LYS  55          HG2       LYS  55  -7.712  -6.866  -8.897
  441   2HG   LYS  55          HG1       LYS  55  -6.049  -6.276  -8.834
  442   1HD   LYS  55          HD2       LYS  55  -7.287  -7.269  -6.300
  443   2HD   LYS  55          HD1       LYS  55  -6.775  -8.459  -7.498
  444   1HE   LYS  55          HE2       LYS  55  -4.503  -7.510  -7.507
  445   2HE   LYS  55          HE1       LYS  55  -5.008  -6.272  -6.340
  446   1HZ   LYS  55          HZ1       LYS  55  -4.154  -7.988  -5.023
  447   2HZ   LYS  55          HZ2       LYS  55  -4.875  -9.204  -5.963
  448   3HZ   LYS  55          HZ3       LYS  55  -5.833  -8.224  -4.959
  449    H    LYS  56           HN       LYS  56 -10.329  -3.123  -9.158
  450    HA   LYS  56           HA       LYS  56  -9.930  -0.497  -8.213
  451   1HB   LYS  56          HB2       LYS  56 -12.074  -2.244  -8.970
  452   2HB   LYS  56          HB1       LYS  56 -12.550  -1.413  -7.489
  453   1HG   LYS  56          HG2       LYS  56 -11.229   0.347  -9.433
  454   2HG   LYS  56          HG1       LYS  56 -12.735  -0.351 -10.032
  455   1HD   LYS  56          HD2       LYS  56 -13.109   0.457  -7.301
  456   2HD   LYS  56          HD1       LYS  56 -12.429   1.807  -8.209
  457   1HE   LYS  56          HE2       LYS  56 -14.592   2.176  -8.861
  458   2HE   LYS  56          HE1       LYS  56 -14.321   0.815  -9.968
  459   1HZ   LYS  56          HZ1       LYS  56 -15.491   0.758  -7.248
  460   2HZ   LYS  56          HZ2       LYS  56 -14.869  -0.642  -7.984
  461   3HZ   LYS  56          HZ3       LYS  56 -16.171   0.188  -8.694
  462    H    TRP  57           HN       TRP  57 -10.391  -3.488  -6.498
  463    HA   TRP  57           HA       TRP  57 -11.178  -2.812  -3.919
  464   1HB   TRP  57          HB2       TRP  57 -10.639  -5.051  -4.877
  465   2HB   TRP  57          HB1       TRP  57  -8.929  -4.635  -4.848
  466    HD1  TRP  57           HD1      TRP  57 -11.645  -6.052  -2.789
  467    HE1  TRP  57           HE1      TRP  57 -10.805  -6.504  -0.387
  468    HE3  TRP  57           HE3      TRP  57  -7.213  -3.545  -2.929
  469    HZ2  TRP  57           HZ2      TRP  57  -8.528  -5.882   1.243
  470    HZ3  TRP  57           HZ3      TRP  57  -5.729  -3.492  -0.949
  471    HH2  TRP  57           HH2      TRP  57  -6.380  -4.654   1.137
  472    H    VAL  58           HN       VAL  58  -7.906  -2.565  -5.323
  473    HA   VAL  58           HA       VAL  58  -6.642  -1.531  -2.942
  474    HB   VAL  58           HB       VAL  58  -5.984  -1.396  -5.901
  475   1HG1  VAL  58          HG1       VAL  58  -4.838   0.281  -4.246
  476   2HG1  VAL  58          HG1       VAL  58  -3.833  -0.638  -5.365
  477   3HG1  VAL  58          HG1       VAL  58  -3.971  -1.146  -3.681
  478   1HG2  VAL  58          HG2       VAL  58  -5.458  -3.354  -3.688
  479   2HG2  VAL  58          HG2       VAL  58  -4.276  -3.188  -4.984
  480   3HG2  VAL  58          HG2       VAL  58  -5.933  -3.665  -5.358
  481    H    GLN  59           HN       GLN  59  -8.220  -0.046  -5.759
  482    HA   GLN  59           HA       GLN  59  -7.467   2.667  -5.231
  483   1HB   GLN  59          HB2       GLN  59  -9.931   1.464  -6.544
  484   2HB   GLN  59          HB1       GLN  59  -9.397   3.135  -6.727
  485   1HG   GLN  59          HG2       GLN  59  -7.343   1.073  -7.285
  486   2HG   GLN  59          HG1       GLN  59  -8.682   1.146  -8.433
  487   1HE2  GLN  59          HE2       GLN  59  -6.279   3.289  -6.815
  488   2HE2  GLN  59          HE2       GLN  59  -6.178   4.393  -8.100
  489    H    LYS  60           HN       LYS  60 -10.096   0.596  -4.056
  490    HA   LYS  60           HA       LYS  60 -11.475   2.745  -2.669
  491   1HB   LYS  60          HB2       LYS  60 -12.036   0.183  -3.488
  492   2HB   LYS  60          HB1       LYS  60 -11.819  -0.040  -1.752
  493   1HG   LYS  60          HG2       LYS  60 -13.806   0.929  -1.321
  494   2HG   LYS  60          HG1       LYS  60 -13.362   2.352  -2.263
  495   1HD   LYS  60          HD2       LYS  60 -14.996   1.682  -3.688
  496   2HD   LYS  60          HD1       LYS  60 -13.821   0.485  -4.232
  497   1HE   LYS  60          HE2       LYS  60 -15.582  -0.933  -3.688
  498   2HE   LYS  60          HE1       LYS  60 -14.791  -0.846  -2.101
  499   1HZ   LYS  60          HZ1       LYS  60 -16.176   1.231  -1.750
  500   2HZ   LYS  60          HZ2       LYS  60 -17.009  -0.249  -1.697
  501   3HZ   LYS  60          HZ3       LYS  60 -17.098   0.730  -3.083
  502    H    TYR  61           HN       TYR  61  -8.831   0.570  -1.953
  503    HA   TYR  61           HA       TYR  61  -8.955   0.965   0.943
  504   1HB   TYR  61          HB2       TYR  61  -7.482  -0.593  -1.044
  505   2HB   TYR  61          HB1       TYR  61  -6.445  -0.015   0.260
  506    HD1  TYR  61           HD1      TYR  61  -6.200  -1.528   2.010
  507    HD2  TYR  61           HD2      TYR  61  -9.974  -1.278  -0.026
  508    HE1  TYR  61           HE1      TYR  61  -7.132  -3.257   3.525
  509    HE2  TYR  61           HE2      TYR  61 -10.906  -3.007   1.489
  510    HH   TYR  61           HH       TYR  61 -10.013  -4.881   2.907
  511    H    ILE  62           HN       ILE  62  -7.079   2.312  -1.765
  512    HA   ILE  62           HA       ILE  62  -5.256   3.838  -0.131
  513    HB   ILE  62           HB       ILE  62  -6.305   4.282  -2.950
  514   1HG1  ILE  62          HG1       ILE  62  -3.722   2.983  -2.034
  515   2HG1  ILE  62          HG1       ILE  62  -5.167   2.067  -2.454
  516   1HG2  ILE  62          HG2       ILE  62  -3.676   5.223  -2.716
  517   2HG2  ILE  62          HG2       ILE  62  -4.478   5.791  -1.252
  518   3HG2  ILE  62          HG2       ILE  62  -5.131   6.212  -2.836
  519   1HD1  ILE  62          HD1       ILE  62  -4.975   3.702  -4.621
  520   2HD1  ILE  62          HD1       ILE  62  -4.259   2.093  -4.551
  521   3HD1  ILE  62          HD1       ILE  62  -3.272   3.512  -4.210
  522    H    SER  63           HN       SER  63  -8.383   4.611  -1.681
  523    HA   SER  63           HA       SER  63  -8.544   7.343  -0.866
  524   1HB   SER  63          HB2       SER  63 -10.248   5.216  -1.932
  525   2HB   SER  63          HB1       SER  63 -11.136   6.297  -0.862
  526    HG   SER  63           HG       SER  63 -10.514   8.020  -2.124
  527    H    LEU  64           HN       LEU  64  -9.713   4.352   0.715
  528    HA   LEU  64           HA       LEU  64 -10.749   5.671   3.064
  529   1HB   LEU  64          HB2       LEU  64 -10.281   2.984   2.007
  530   2HB   LEU  64          HB1       LEU  64 -10.002   3.065   3.747
  531    HG   LEU  64           HG       LEU  64 -12.439   4.412   2.659
  532   1HD1  LEU  64          HD1       LEU  64 -11.902   1.477   2.632
  533   2HD1  LEU  64          HD1       LEU  64 -12.936   2.438   1.577
  534   3HD1  LEU  64          HD1       LEU  64 -13.488   2.004   3.195
  535   1HD2  LEU  64          HD2       LEU  64 -12.533   4.657   4.921
  536   2HD2  LEU  64          HD2       LEU  64 -11.392   3.343   5.202
  537   3HD2  LEU  64          HD2       LEU  64 -13.095   2.985   4.915
  538    H    LEU  65           HN       LEU  65  -7.683   3.915   2.434
  539    HA   LEU  65           HA       LEU  65  -6.533   4.663   5.008
  540   1HB   LEU  65          HB2       LEU  65  -5.500   3.433   2.436
  541   2HB   LEU  65          HB1       LEU  65  -4.440   3.743   3.807
  542    HG   LEU  65           HG       LEU  65  -6.858   1.914   3.734
  543   1HD1  LEU  65          HD1       LEU  65  -5.360   0.186   3.727
  544   2HD1  LEU  65          HD1       LEU  65  -4.224   1.037   4.773
  545   3HD1  LEU  65          HD1       LEU  65  -4.274   1.394   3.051
  546   1HD2  LEU  65          HD2       LEU  65  -5.865   1.471   6.172
  547   2HD2  LEU  65          HD2       LEU  65  -7.076   2.721   5.894
  548   3HD2  LEU  65          HD2       LEU  65  -5.370   3.155   6.013
  549    H    LYS  66           HN       LYS  66  -7.298   7.060   4.218
  550    HA   LYS  66           HA       LYS  66  -6.541   9.248   3.765
  551   1HB   LYS  66          HB2       LYS  66  -4.303   7.651   4.679
  552   2HB   LYS  66          HB1       LYS  66  -3.749   8.855   3.515
  553   1HG   LYS  66          HG2       LYS  66  -5.429  10.385   4.985
  554   2HG   LYS  66          HG1       LYS  66  -4.915   9.234   6.220
  555   1HD   LYS  66          HD2       LYS  66  -2.712   9.925   6.147
  556   2HD   LYS  66          HD1       LYS  66  -2.812  10.415   4.455
  557   1HE   LYS  66          HE2       LYS  66  -2.957  12.542   5.264
  558   2HE   LYS  66          HE1       LYS  66  -4.620  12.117   5.716
  559   1HZ   LYS  66          HZ1       LYS  66  -3.587  12.774   7.710
  560   2HZ   LYS  66          HZ2       LYS  66  -2.168  11.905   7.367
  561   3HZ   LYS  66          HZ3       LYS  66  -3.599  11.079   7.764
  562    H    THR  67           HN       THR  67  -7.119   9.855   1.707
  563    HA   THR  67           HA       THR  67  -6.122   8.496  -0.668
  564    HB   THR  67           HB       THR  67  -8.386   9.485  -0.423
  565    HG1  THR  67           HG1      THR  67  -6.927  10.926  -2.366
  566   1HG2  THR  67          HG2       THR  67  -7.091  11.575   0.771
  567   2HG2  THR  67          HG2       THR  67  -8.746  11.649   0.166
  568   3HG2  THR  67          HG2       THR  67  -7.416  12.241  -0.830
  569    HA   PRO  68           HA       PRO  68  -2.536  11.063  -1.142
  570   1HB   PRO  68          HB2       PRO  68  -1.926  10.424  -3.728
  571   2HB   PRO  68          HB1       PRO  68  -1.621   9.327  -2.366
  572   1HG   PRO  68          HG2       PRO  68  -3.789   9.276  -4.389
  573   2HG   PRO  68          HG1       PRO  68  -2.955   7.936  -3.589
  574   1HD   PRO  68          HD2       PRO  68  -5.471   8.852  -2.920
  575   2HD   PRO  68          HD1       PRO  68  -4.408   7.920  -1.843
  576    H    LYS  69           HN       LYS  69  -2.185  13.172  -1.899
  577    HA   LYS  69           HA       LYS  69  -3.401  14.248  -4.294
  578   1HB   LYS  69          HB2       LYS  69  -5.098  15.641  -3.175
  579   2HB   LYS  69          HB1       LYS  69  -5.388  13.936  -2.833
  580   1HG   LYS  69          HG2       LYS  69  -5.370  14.491  -0.645
  581   2HG   LYS  69          HG1       LYS  69  -3.633  14.741  -0.818
  582   1HD   LYS  69          HD2       LYS  69  -3.825  17.022  -0.874
  583   2HD   LYS  69          HD1       LYS  69  -5.375  16.973  -1.716
  584   1HE   LYS  69          HE2       LYS  69  -6.240  15.953   0.572
  585   2HE   LYS  69          HE1       LYS  69  -4.819  16.791   1.227
  586   1HZ   LYS  69          HZ1       LYS  69  -5.530  18.790   0.011
  587   2HZ   LYS  69          HZ2       LYS  69  -6.674  18.307   1.170
  588   3HZ   LYS  69          HZ3       LYS  69  -6.941  17.987  -0.477
  589    H    GLN  70           HN       GLN  70  -2.245  16.076  -4.838
  590    HA   GLN  70           HA       GLN  70  -0.512  17.287  -2.716
  591   1HB   GLN  70          HB2       GLN  70   0.136  16.138  -5.093
  592   2HB   GLN  70          HB1       GLN  70  -0.061  17.815  -5.605
  593   1HG   GLN  70          HG2       GLN  70   2.007  18.223  -4.812
  594   2HG   GLN  70          HG1       GLN  70   1.374  17.943  -3.190
  595   1HE2  GLN  70          HE2       GLN  70   2.116  15.748  -5.966
  596   2HE2  GLN  70          HE2       GLN  70   3.062  14.677  -5.050
  597    H    LEU  71           HN       LEU  71   0.054  19.711  -3.543
  598    HA   LEU  71           HA       LEU  71  -2.404  21.223  -3.297
  599   1HB   LEU  71          HB2       LEU  71  -0.852  23.129  -3.453
  600   2HB   LEU  71          HB1       LEU  71  -0.180  21.882  -2.403
  601    HG   LEU  71           HG       LEU  71   0.620  21.284  -5.075
  602   1HD1  LEU  71          HD1       LEU  71   0.553  24.166  -4.402
  603   2HD1  LEU  71          HD1       LEU  71   0.621  23.378  -5.979
  604   3HD1  LEU  71          HD1       LEU  71   2.094  23.576  -5.027
  605   1HD2  LEU  71          HD2       LEU  71   2.628  22.519  -3.329
  606   2HD2  LEU  71          HD2       LEU  71   2.559  20.878  -3.971
  607   3HD2  LEU  71          HD2       LEU  71   1.670  21.289  -2.505
  Start of MODEL   19
    1   1H    THR   1          HT1       THR   1   7.222 -16.556  -0.410
    2   2H    THR   1          HT2       THR   1   8.273 -17.122   0.800
    3   3H    THR   1          HT3       THR   1   7.203 -15.845   1.130
    4    HA   THR   1           HA       THR   1   5.352 -17.518   0.560
    5    HB   THR   1           HB       THR   1   7.798 -19.248   1.054
    6    HG1  THR   1           HG1      THR   1   7.680 -19.685  -1.033
    7   1HG2  THR   1          HG2       THR   1   4.908 -20.034   0.595
    8   2HG2  THR   1          HG2       THR   1   5.758 -20.141   2.136
    9   3HG2  THR   1          HG2       THR   1   6.266 -21.144   0.778
   10    H    ARG   2           HN       ARG   2   8.092 -17.725   2.861
   11    HA   ARG   2           HA       ARG   2   6.147 -17.275   5.086
   12   1HB   ARG   2          HB2       ARG   2   6.903 -19.750   4.493
   13   2HB   ARG   2          HB1       ARG   2   8.358 -19.283   5.373
   14   1HG   ARG   2          HG2       ARG   2   6.827 -20.275   6.960
   15   2HG   ARG   2          HG1       ARG   2   6.876 -18.539   7.273
   16   1HD   ARG   2          HD2       ARG   2   4.613 -18.554   7.071
   17   2HD   ARG   2          HD1       ARG   2   4.852 -18.872   5.340
   18    HE   ARG   2           HE       ARG   2   5.058 -21.229   7.099
   19   1HH1  ARG   2          HH2       ARG   2   2.246 -20.134   7.219
   20   2HH1  ARG   2          HH2       ARG   2   1.485 -20.982   5.915
   21   1HH2  ARG   2          HH1       ARG   2   4.472 -21.961   4.455
   22   2HH2  ARG   2          HH1       ARG   2   2.744 -22.016   4.351
   23    H    GLY   3           HN       GLY   3   7.584 -15.164   4.333
   24   1HA   GLY   3          HA2       GLY   3   9.746 -15.005   6.378
   25   2HA   GLY   3          HA1       GLY   3  10.068 -14.440   4.738
   26    H    SER   4           HN       SER   4   9.451 -13.238   7.657
   27    HA   SER   4           HA       SER   4   7.456 -11.196   6.801
   28   1HB   SER   4          HB2       SER   4   8.250 -12.541   9.237
   29   2HB   SER   4          HB1       SER   4   8.332 -10.796   9.462
   30    HG   SER   4           HG       SER   4   6.181 -10.736   8.547
   31    H    ASP   5           HN       ASP   5   9.802 -10.844   5.411
   32    HA   ASP   5           HA       ASP   5  10.803  -8.298   6.525
   33   1HB   ASP   5          HB2       ASP   5  12.235 -10.069   7.482
   34   2HB   ASP   5          HB1       ASP   5  12.570 -10.674   5.859
   35    H    ILE   6           HN       ILE   6   9.191  -8.898   4.204
   36    HA   ILE   6           HA       ILE   6  11.080  -8.009   2.057
   37    HB   ILE   6           HB       ILE   6   8.863 -10.079   1.872
   38   1HG1  ILE   6          HG1       ILE   6  10.897 -10.878   3.044
   39   2HG1  ILE   6          HG1       ILE   6  10.714 -11.659   1.473
   40   1HG2  ILE   6          HG2       ILE   6   8.880  -9.270  -0.280
   41   2HG2  ILE   6          HG2       ILE   6  10.271 -10.347  -0.408
   42   3HG2  ILE   6          HG2       ILE   6  10.514  -8.622  -0.134
   43   1HD1  ILE   6          HD1       ILE   6  12.166  -9.261   1.033
   44   2HD1  ILE   6          HD1       ILE   6  12.756 -10.916   0.897
   45   3HD1  ILE   6          HD1       ILE   6  12.899 -10.052   2.427
   46    H    SER   7           HN       SER   7   9.341  -6.343   3.659
   47    HA   SER   7           HA       SER   7   7.050  -5.749   1.864
   48   1HB   SER   7          HB2       SER   7   6.599  -4.147   3.875
   49   2HB   SER   7          HB1       SER   7   6.401  -5.880   4.122
   50    HG   SER   7           HG       SER   7   8.263  -4.128   5.145
   51    H    LYS   8           HN       LYS   8   9.651  -5.113   0.838
   52    HA   LYS   8           HA       LYS   8  10.527  -2.449   1.332
   53   1HB   LYS   8          HB2       LYS   8  10.770  -4.539  -0.754
   54   2HB   LYS   8          HB1       LYS   8  11.088  -2.894  -1.306
   55   1HG   LYS   8          HG2       LYS   8  12.971  -2.677  -0.018
   56   2HG   LYS   8          HG1       LYS   8  12.322  -3.676   1.283
   57   1HD   LYS   8          HD2       LYS   8  12.612  -5.323  -1.038
   58   2HD   LYS   8          HD1       LYS   8  14.124  -4.448  -0.794
   59   1HE   LYS   8          HE2       LYS   8  13.286  -5.279   1.784
   60   2HE   LYS   8          HE1       LYS   8  13.092  -6.682   0.713
   61   1HZ   LYS   8          HZ1       LYS   8  15.309  -6.322  -0.138
   62   2HZ   LYS   8          HZ2       LYS   8  15.374  -6.485   1.551
   63   3HZ   LYS   8          HZ3       LYS   8  15.504  -4.949   0.837
   64    H    THR   9           HN       THR   9  10.365  -0.791  -0.656
   65    HA   THR   9           HA       THR   9   7.595   0.052  -0.800
   66    HB   THR   9           HB       THR   9   9.585   1.544  -0.710
   67    HG1  THR   9           HG1      THR   9   7.953   1.699  -3.018
   68   1HG2  THR   9          HG2       THR   9  10.099   0.326  -3.430
   69   2HG2  THR   9          HG2       THR   9  11.170   0.324  -2.029
   70   3HG2  THR   9          HG2       THR   9  10.850   1.829  -2.891
   71    H    CYS  10           HN       CYS  10   9.648  -1.930  -2.803
   72    HA   CYS  10           HA       CYS  10   8.126  -1.599  -5.269
   73   1HB   CYS  10          HB2       CYS  10  10.086  -3.711  -4.309
   74   2HB   CYS  10          HB1       CYS  10   9.574  -3.482  -5.979
   75    H    CYS  11           HN       CYS  11   7.330  -3.883  -6.243
   76    HA   CYS  11           HA       CYS  11   5.919  -5.497  -4.182
   77   1HB   CYS  11          HB2       CYS  11   4.660  -3.786  -6.337
   78   2HB   CYS  11          HB1       CYS  11   3.787  -5.097  -5.547
   79    H    PHE  12           HN       PHE  12   4.925  -7.454  -5.171
   80    HA   PHE  12           HA       PHE  12   5.632  -8.133  -7.938
   81   1HB   PHE  12          HB2       PHE  12   7.007 -10.123  -7.098
   82   2HB   PHE  12          HB1       PHE  12   7.761  -8.541  -6.908
   83    HD1  PHE  12           HD1      PHE  12   6.515 -11.485  -5.210
   84    HD2  PHE  12           HD2      PHE  12   7.614  -7.370  -4.663
   85    HE1  PHE  12           HE1      PHE  12   6.690 -11.858  -2.764
   86    HE2  PHE  12           HE2      PHE  12   7.789  -7.741  -2.217
   87    HZ   PHE  12           HZ       PHE  12   7.327  -9.985  -1.268
   88    H    GLN  13           HN       GLN  13   4.571  -9.370  -4.760
   89    HA   GLN  13           HA       GLN  13   2.630 -11.132  -6.196
   90   1HB   GLN  13          HB2       GLN  13   4.618 -11.719  -4.344
   91   2HB   GLN  13          HB1       GLN  13   3.149 -11.693  -3.370
   92   1HG   GLN  13          HG2       GLN  13   2.272 -13.071  -5.544
   93   2HG   GLN  13          HG1       GLN  13   3.963 -13.571  -5.510
   94   1HE2  GLN  13          HE2       GLN  13   2.231 -15.594  -4.949
   95   2HE2  GLN  13          HE2       GLN  13   2.186 -15.934  -3.285
   96    H    TYR  14           HN       TYR  14   0.590 -10.289  -6.088
   97    HA   TYR  14           HA       TYR  14  -0.128  -8.366  -3.972
   98   1HB   TYR  14          HB2       TYR  14  -1.721  -9.515  -6.286
   99   2HB   TYR  14          HB1       TYR  14  -2.115  -8.064  -5.367
  100    HD1  TYR  14           HD1      TYR  14  -0.882  -9.053  -8.403
  101    HD2  TYR  14           HD2      TYR  14   0.180  -6.481  -5.130
  102    HE1  TYR  14           HE1      TYR  14   0.542  -7.706  -9.924
  103    HE2  TYR  14           HE2      TYR  14   1.603  -5.134  -6.651
  104    HH   TYR  14           HH       TYR  14   2.858  -5.909  -9.159
  105    H    SER  15           HN       SER  15  -1.770  -8.754  -2.415
  106    HA   SER  15           HA       SER  15  -2.256 -11.594  -1.779
  107   1HB   SER  15          HB2       SER  15  -2.987  -9.003  -0.380
  108   2HB   SER  15          HB1       SER  15  -3.115 -10.614   0.323
  109    HG   SER  15           HG       SER  15  -0.747  -9.353  -0.622
  110    H    HIS  16           HN       HIS  16  -4.064  -8.733  -2.828
  111    HA   HIS  16           HA       HIS  16  -6.310  -8.501  -3.532
  112   1HB   HIS  16          HB2       HIS  16  -5.363 -10.116  -5.167
  113   2HB   HIS  16          HB1       HIS  16  -5.834 -11.445  -4.108
  114    HD1  HIS  16           HD1      HIS  16  -7.999 -12.467  -4.764
  115    HD2  HIS  16           HD2      HIS  16  -7.886  -8.410  -5.720
  116    HE1  HIS  16           HE1      HIS  16 -10.216 -11.927  -5.864
  117    H    LYS  17           HN       LYS  17  -6.769  -8.315  -1.078
  118    HA   LYS  17           HA       LYS  17  -9.024 -10.025  -0.407
  119   1HB   LYS  17          HB2       LYS  17  -7.907 -11.004   1.621
  120   2HB   LYS  17          HB1       LYS  17  -7.196 -11.555   0.103
  121   1HG   LYS  17          HG2       LYS  17  -5.210 -10.875   0.936
  122   2HG   LYS  17          HG1       LYS  17  -5.783  -9.226   0.685
  123   1HD   LYS  17          HD2       LYS  17  -5.028  -9.543   3.011
  124   2HD   LYS  17          HD1       LYS  17  -6.762  -9.222   2.952
  125   1HE   LYS  17          HE2       LYS  17  -7.107 -11.154   4.083
  126   2HE   LYS  17          HE1       LYS  17  -6.440 -12.041   2.696
  127   1HZ   LYS  17          HZ1       LYS  17  -4.661 -10.664   4.606
  128   2HZ   LYS  17          HZ2       LYS  17  -4.300 -11.941   3.546
  129   3HZ   LYS  17          HZ3       LYS  17  -5.230 -12.226   4.940
  130    HA   PRO  18           HA       PRO  18  -9.765  -6.371   1.971
  131   1HB   PRO  18          HB2       PRO  18 -11.842  -7.240   3.514
  132   2HB   PRO  18          HB1       PRO  18 -12.013  -6.879   1.786
  133   1HG   PRO  18          HG2       PRO  18 -11.801  -9.495   3.159
  134   2HG   PRO  18          HG1       PRO  18 -12.714  -9.047   1.711
  135   1HD   PRO  18          HD2       PRO  18 -10.303 -10.408   1.715
  136   2HD   PRO  18          HD1       PRO  18 -10.970  -9.517   0.331
  137    H    LEU  19           HN       LEU  19  -7.982  -6.101   3.371
  138    HA   LEU  19           HA       LEU  19  -7.372  -7.871   5.574
  139   1HB   LEU  19          HB2       LEU  19  -6.196  -5.769   4.189
  140   2HB   LEU  19          HB1       LEU  19  -6.488  -5.083   5.787
  141    HG   LEU  19           HG       LEU  19  -5.435  -7.815   5.898
  142   1HD1  LEU  19          HD1       LEU  19  -4.267  -7.062   3.859
  143   2HD1  LEU  19          HD1       LEU  19  -3.143  -7.189   5.212
  144   3HD1  LEU  19          HD1       LEU  19  -3.730  -5.607   4.699
  145   1HD2  LEU  19          HD2       LEU  19  -4.080  -5.379   7.002
  146   2HD2  LEU  19          HD2       LEU  19  -4.310  -6.962   7.745
  147   3HD2  LEU  19          HD2       LEU  19  -5.658  -5.828   7.651
  148    HA   PRO  20           HA       PRO  20 -10.299  -6.387   8.529
  149   1HB   PRO  20          HB2       PRO  20  -8.909  -6.883  10.847
  150   2HB   PRO  20          HB1       PRO  20  -9.703  -8.156   9.898
  151   1HG   PRO  20          HG2       PRO  20  -6.832  -7.345   9.946
  152   2HG   PRO  20          HG1       PRO  20  -7.546  -8.967   9.898
  153   1HD   PRO  20          HD2       PRO  20  -6.535  -7.773   7.698
  154   2HD   PRO  20          HD1       PRO  20  -7.922  -8.883   7.625
  155    H    TRP  21           HN       TRP  21 -10.485  -4.173   8.424
  156    HA   TRP  21           HA       TRP  21  -8.594  -2.166   8.484
  157   1HB   TRP  21          HB2       TRP  21 -11.374  -2.307   9.676
  158   2HB   TRP  21          HB1       TRP  21 -10.491  -0.792   9.467
  159    HD1  TRP  21           HD1      TRP  21 -12.561  -3.288   7.625
  160    HE1  TRP  21           HE1      TRP  21 -12.701  -2.647   5.129
  161    HE3  TRP  21           HE3      TRP  21  -8.997   0.361   7.453
  162    HZ2  TRP  21           HZ2      TRP  21 -11.458  -0.829   3.302
  163    HZ3  TRP  21           HZ3      TRP  21  -8.492   1.531   5.327
  164    HH2  TRP  21           HH2      TRP  21  -9.717   0.942   3.253
  165    H    THR  22           HN       THR  22  -9.699  -4.041  11.242
  166    HA   THR  22           HA       THR  22  -8.871  -2.350  13.367
  167    HB   THR  22           HB       THR  22  -8.491  -4.741  14.413
  168    HG1  THR  22           HG1      THR  22  -9.583  -6.308  13.122
  169   1HG2  THR  22          HG2       THR  22 -11.260  -4.604  13.440
  170   2HG2  THR  22          HG2       THR  22 -10.667  -3.079  14.100
  171   3HG2  THR  22          HG2       THR  22 -10.645  -4.538  15.092
  172    H    TRP  23           HN       TRP  23  -7.053  -4.450  11.212
  173    HA   TRP  23           HA       TRP  23  -4.532  -3.816  12.669
  174   1HB   TRP  23          HB2       TRP  23  -5.697  -6.116  11.338
  175   2HB   TRP  23          HB1       TRP  23  -4.108  -5.750  10.673
  176    HD1  TRP  23           HD1      TRP  23  -5.004  -5.065  14.333
  177    HE1  TRP  23           HE1      TRP  23  -3.544  -6.573  15.833
  178    HE3  TRP  23           HE3      TRP  23  -2.762  -7.951  10.768
  179    HZ2  TRP  23           HZ2      TRP  23  -1.673  -8.720  15.554
  180    HZ3  TRP  23           HZ3      TRP  23  -1.148  -9.718  11.410
  181    HH2  TRP  23           HH2      TRP  23  -0.600 -10.106  13.797
  182    H    VAL  24           HN       VAL  24  -6.286  -2.586  10.124
  183    HA   VAL  24           HA       VAL  24  -4.022  -2.274   8.251
  184    HB   VAL  24           HB       VAL  24  -6.844  -1.165   8.190
  185   1HG1  VAL  24          HG1       VAL  24  -5.091  -1.681   5.803
  186   2HG1  VAL  24          HG1       VAL  24  -4.865  -0.200   6.731
  187   3HG1  VAL  24          HG1       VAL  24  -6.422  -0.537   5.977
  188   1HG2  VAL  24          HG2       VAL  24  -6.913  -3.107   6.377
  189   2HG2  VAL  24          HG2       VAL  24  -7.209  -3.459   8.078
  190   3HG2  VAL  24          HG2       VAL  24  -5.624  -3.781   7.375
  191    H    ARG  25           HN       ARG  25  -3.109  -0.189   7.737
  192    HA   ARG  25           HA       ARG  25  -3.686   1.948   9.763
  193   1HB   ARG  25          HB2       ARG  25  -1.542   0.447   9.883
  194   2HB   ARG  25          HB1       ARG  25  -0.979   1.455   8.550
  195   1HG   ARG  25          HG2       ARG  25  -1.656   3.459  10.037
  196   2HG   ARG  25          HG1       ARG  25  -1.692   2.291  11.358
  197   1HD   ARG  25          HD2       ARG  25   0.709   2.540   9.531
  198   2HD   ARG  25          HD1       ARG  25   0.543   3.509  11.008
  199    HE   ARG  25           HE       ARG  25   0.316   0.527  11.094
  200   1HH1  ARG  25          HH2       ARG  25  -0.080   2.224  13.559
  201   2HH1  ARG  25          HH2       ARG  25   1.483   2.135  14.300
  202   1HH2  ARG  25          HH1       ARG  25   3.064   0.971  11.441
  203   2HH2  ARG  25          HH1       ARG  25   3.264   1.425  13.101
  204    H    SER  26           HN       SER  26  -1.806   1.581   6.706
  205    HA   SER  26           HA       SER  26  -3.386   3.775   5.486
  206   1HB   SER  26          HB2       SER  26  -1.304   5.122   5.175
  207   2HB   SER  26          HB1       SER  26  -1.716   4.903   6.872
  208    HG   SER  26           HG       SER  26   0.485   4.465   6.490
  209    H    TYR  27           HN       TYR  27  -1.537   4.370   3.416
  210    HA   TYR  27           HA       TYR  27  -0.820   1.771   2.187
  211   1HB   TYR  27          HB2       TYR  27  -2.556   1.769   0.720
  212   2HB   TYR  27          HB1       TYR  27  -3.303   2.932   1.803
  213    HD1  TYR  27           HD1      TYR  27  -1.862   2.365  -1.464
  214    HD2  TYR  27           HD2      TYR  27  -3.003   5.407   1.342
  215    HE1  TYR  27           HE1      TYR  27  -1.815   4.050  -3.277
  216    HE2  TYR  27           HE2      TYR  27  -2.958   7.095  -0.469
  217    HH   TYR  27           HH       TYR  27  -1.449   6.905  -3.125
  218    H    GLU  28           HN       GLU  28  -0.020   2.414  -0.234
  219    HA   GLU  28           HA       GLU  28   1.149   4.979  -0.710
  220   1HB   GLU  28          HB2       GLU  28   3.524   4.355  -0.150
  221   2HB   GLU  28          HB1       GLU  28   2.485   4.470   1.268
  222   1HG   GLU  28          HG2       GLU  28   2.095   1.919   0.907
  223   2HG   GLU  28          HG1       GLU  28   3.549   2.003  -0.089
  224    H    PHE  29           HN       PHE  29   2.026   5.004  -2.815
  225    HA   PHE  29           HA       PHE  29   1.686   2.553  -4.403
  226   1HB   PHE  29          HB2       PHE  29   1.619   5.364  -4.768
  227   2HB   PHE  29          HB1       PHE  29   2.929   4.764  -5.784
  228    HD1  PHE  29           HD1      PHE  29  -0.545   5.323  -5.634
  229    HD2  PHE  29           HD2      PHE  29   2.352   2.519  -7.113
  230    HE1  PHE  29           HE1      PHE  29  -2.203   4.469  -7.270
  231    HE2  PHE  29           HE2      PHE  29   0.695   1.664  -8.745
  232    HZ   PHE  29           HZ       PHE  29  -1.583   2.640  -8.825
  233    H    THR  30           HN       THR  30   3.441   1.691  -5.761
  234    HA   THR  30           HA       THR  30   5.876   1.176  -4.387
  235    HB   THR  30           HB       THR  30   6.516   0.562  -6.889
  236    HG1  THR  30           HG1      THR  30   5.015   1.546  -8.055
  237   1HG2  THR  30          HG2       THR  30   5.853  -1.018  -5.066
  238   2HG2  THR  30          HG2       THR  30   5.274  -1.514  -6.655
  239   3HG2  THR  30          HG2       THR  30   4.166  -0.761  -5.507
  240    H    SER  31           HN       SER  31   8.070   1.892  -5.000
  241    HA   SER  31           HA       SER  31   8.233   4.772  -5.415
  242   1HB   SER  31          HB2       SER  31   9.701   3.446  -3.908
  243   2HB   SER  31          HB1       SER  31  10.350   2.597  -5.308
  244    HG   SER  31           HG       SER  31  11.559   4.266  -5.724
  245    H    ASN  32           HN       ASN  32   9.901   5.586  -7.114
  246    HA   ASN  32           HA       ASN  32   9.098   4.530  -9.753
  247   1HB   ASN  32          HB2       ASN  32  10.616   6.920  -8.698
  248   2HB   ASN  32          HB1       ASN  32  10.525   6.582 -10.427
  249   1HD2  ASN  32          HD2       ASN  32   8.799   7.917  -7.735
  250   2HD2  ASN  32          HD2       ASN  32   7.336   8.207  -8.544
  251    H    SER  33           HN       SER  33  10.628   2.597  -8.533
  252    HA   SER  33           HA       SER  33  12.902   2.360 -10.335
  253   1HB   SER  33          HB2       SER  33  14.646   2.707  -8.782
  254   2HB   SER  33          HB1       SER  33  13.500   3.981  -8.374
  255    HG   SER  33           HG       SER  33  14.120   2.879  -6.509
  256    H    CYS  34           HN       CYS  34  10.525   0.820  -9.522
  257    HA   CYS  34           HA       CYS  34  11.820  -1.565  -8.250
  258   1HB   CYS  34          HB2       CYS  34   8.951  -0.600  -8.435
  259   2HB   CYS  34          HB1       CYS  34   9.421  -2.145  -7.724
  260    H    SER  35           HN       SER  35   9.973  -3.480  -9.052
  261    HA   SER  35           HA       SER  35  10.794  -3.972 -11.807
  262   1HB   SER  35          HB2       SER  35   9.557  -5.353  -9.538
  263   2HB   SER  35          HB1       SER  35   8.876  -5.846 -11.085
  264    HG   SER  35           HG       SER  35  11.034  -6.752 -10.093
  265    H    GLN  36           HN       GLN  36   7.619  -3.515 -10.201
  266    HA   GLN  36           HA       GLN  36   6.569  -2.369 -12.748
  267   1HB   GLN  36          HB2       GLN  36   6.096  -4.996 -11.700
  268   2HB   GLN  36          HB1       GLN  36   4.592  -4.081 -11.600
  269   1HG   GLN  36          HG2       GLN  36   6.288  -4.179 -14.104
  270   2HG   GLN  36          HG1       GLN  36   4.967  -5.306 -13.796
  271   1HE2  GLN  36          HE2       GLN  36   4.638  -3.697 -16.008
  272   2HE2  GLN  36          HE2       GLN  36   3.500  -2.476 -15.701
  273    H    ARG  37           HN       ARG  37   4.758  -0.955 -12.400
  274    HA   ARG  37           HA       ARG  37   4.684   0.432  -9.883
  275   1HB   ARG  37          HB2       ARG  37   2.999   0.356 -12.388
  276   2HB   ARG  37          HB1       ARG  37   2.571   1.406 -11.037
  277   1HG   ARG  37          HG2       ARG  37   5.071   2.171 -11.176
  278   2HG   ARG  37          HG1       ARG  37   5.002   1.500 -12.807
  279   1HD   ARG  37          HD2       ARG  37   3.932   3.357 -13.533
  280   2HD   ARG  37          HD1       ARG  37   2.638   3.086 -12.350
  281    HE   ARG  37           HE       ARG  37   5.203   4.435 -11.593
  282   1HH1  ARG  37          HH1       ARG  37   2.971   3.624  -9.624
  283   2HH1  ARG  37          HH1       ARG  37   2.183   5.149  -9.396
  284   1HH2  ARG  37          HH2       ARG  37   3.674   6.634 -12.152
  285   2HH2  ARG  37          HH2       ARG  37   2.580   6.852 -10.827
  286    H    ALA  38           HN       ALA  38   3.336   0.123  -8.109
  287    HA   ALA  38           HA       ALA  38   0.876  -1.469  -8.333
  288   1HB   ALA  38          HB1       ALA  38   2.309  -2.735  -6.255
  289   2HB   ALA  38          HB2       ALA  38   3.441  -2.594  -7.601
  290   3HB   ALA  38          HB3       ALA  38   1.900  -3.420  -7.828
  291    H    VAL  39           HN       VAL  39  -0.217  -1.594  -6.132
  292    HA   VAL  39           HA       VAL  39   0.396   0.880  -4.561
  293    HB   VAL  39           HB       VAL  39  -2.093  -0.841  -4.827
  294   1HG1  VAL  39          HG1       VAL  39  -3.092   1.317  -3.758
  295   2HG1  VAL  39          HG1       VAL  39  -1.440   1.626  -3.227
  296   3HG1  VAL  39          HG1       VAL  39  -2.274   0.161  -2.708
  297   1HG2  VAL  39          HG2       VAL  39  -1.049   0.907  -6.667
  298   2HG2  VAL  39          HG2       VAL  39  -2.093   1.972  -5.725
  299   3HG2  VAL  39          HG2       VAL  39  -2.767   0.541  -6.508
  300    H    ILE  40           HN       ILE  40   0.087   0.665  -2.154
  301    HA   ILE  40           HA       ILE  40   0.483  -2.127  -1.166
  302    HB   ILE  40           HB       ILE  40   2.128   0.366  -0.665
  303   1HG1  ILE  40          HG1       ILE  40   3.077  -2.378  -1.488
  304   2HG1  ILE  40          HG1       ILE  40   2.517  -1.206  -2.681
  305   1HG2  ILE  40          HG2       ILE  40   2.391  -2.315   0.714
  306   2HG2  ILE  40          HG2       ILE  40   1.679  -0.884   1.458
  307   3HG2  ILE  40          HG2       ILE  40   3.379  -0.883   0.993
  308   1HD1  ILE  40          HD1       ILE  40   5.093  -1.356  -1.741
  309   2HD1  ILE  40          HD1       ILE  40   4.406  -0.098  -0.714
  310   3HD1  ILE  40          HD1       ILE  40   4.375   0.081  -2.468
  311    H    PHE  41           HN       PHE  41  -0.048  -2.355   1.127
  312    HA   PHE  41           HA       PHE  41  -1.656  -0.119   2.304
  313   1HB   PHE  41          HB2       PHE  41  -2.378  -3.061   1.993
  314   2HB   PHE  41          HB1       PHE  41  -3.293  -1.928   2.986
  315    HD1  PHE  41           HD1      PHE  41  -3.339  -3.480  -0.084
  316    HD2  PHE  41           HD2      PHE  41  -3.654   0.447   1.615
  317    HE1  PHE  41           HE1      PHE  41  -4.586  -2.714  -2.085
  318    HE2  PHE  41           HE2      PHE  41  -4.898   1.218  -0.386
  319    HZ   PHE  41           HZ       PHE  41  -5.365  -0.362  -2.237
  320    H    THR  42           HN       THR  42  -0.653   0.295   4.278
  321    HA   THR  42           HA       THR  42   0.965  -1.838   5.528
  322    HB   THR  42           HB       THR  42   0.631   0.891   6.694
  323    HG1  THR  42           HG1      THR  42   1.926   0.286   4.249
  324   1HG2  THR  42          HG2       THR  42   2.300  -0.204   7.823
  325   2HG2  THR  42          HG2       THR  42   3.269   0.440   6.498
  326   3HG2  THR  42          HG2       THR  42   2.701  -1.229   6.446
  327    H    THR  43           HN       THR  43   0.618  -2.640   7.605
  328    HA   THR  43           HA       THR  43  -2.165  -2.367   8.623
  329    HB   THR  43           HB       THR  43  -1.491  -4.448   9.865
  330    HG1  THR  43           HG1      THR  43   0.793  -3.756   9.792
  331   1HG2  THR  43          HG2       THR  43  -2.378  -4.321   7.414
  332   2HG2  THR  43          HG2       THR  43  -1.694  -5.841   7.991
  333   3HG2  THR  43          HG2       THR  43  -0.731  -4.770   6.973
  334    H    LYS  44           HN       LYS  44  -1.902  -2.989  11.245
  335    HA   LYS  44           HA       LYS  44  -0.795  -0.535  12.401
  336   1HB   LYS  44          HB2       LYS  44  -2.224  -2.989  13.457
  337   2HB   LYS  44          HB1       LYS  44  -1.748  -1.640  14.490
  338   1HG   LYS  44          HG2       LYS  44  -3.109  -0.729  12.079
  339   2HG   LYS  44          HG1       LYS  44  -4.114  -1.828  13.027
  340   1HD   LYS  44          HD2       LYS  44  -3.477  -0.436  15.068
  341   2HD   LYS  44          HD1       LYS  44  -2.816   0.746  13.939
  342   1HE   LYS  44          HE2       LYS  44  -4.886   1.558  13.518
  343   2HE   LYS  44          HE1       LYS  44  -5.471  -0.063  13.093
  344   1HZ   LYS  44          HZ1       LYS  44  -6.656   0.496  15.017
  345   2HZ   LYS  44          HZ2       LYS  44  -5.297   1.178  15.774
  346   3HZ   LYS  44          HZ3       LYS  44  -5.408  -0.506  15.578
  347    H    ARG  45           HN       ARG  45   0.449  -3.665  11.753
  348    HA   ARG  45           HA       ARG  45   2.247  -3.791  14.069
  349   1HB   ARG  45          HB2       ARG  45   1.595  -5.368  11.615
  350   2HB   ARG  45          HB1       ARG  45   3.167  -5.649  12.368
  351   1HG   ARG  45          HG2       ARG  45   1.014  -5.504  14.335
  352   2HG   ARG  45          HG1       ARG  45   0.757  -6.794  13.160
  353   1HD   ARG  45          HD2       ARG  45   2.312  -8.052  14.217
  354   2HD   ARG  45          HD1       ARG  45   3.531  -6.797  13.912
  355    HE   ARG  45           HE       ARG  45   2.166  -7.211  16.424
  356   1HH1  ARG  45          HH2       ARG  45   4.827  -5.805  15.966
  357   2HH1  ARG  45          HH2       ARG  45   4.437  -4.184  16.435
  358   1HH2  ARG  45          HH1       ARG  45   1.009  -4.688  16.299
  359   2HH2  ARG  45          HH1       ARG  45   2.275  -3.552  16.625
  360    H    GLY  46           HN       GLY  46   2.306  -2.517  10.814
  361   1HA   GLY  46          HA2       GLY  46   3.987  -0.748  10.360
  362   2HA   GLY  46          HA1       GLY  46   5.154  -1.722  11.251
  363    H    LYS  47           HN       LYS  47   3.470  -3.979   9.573
  364    HA   LYS  47           HA       LYS  47   5.563  -4.120   7.500
  365   1HB   LYS  47          HB2       LYS  47   4.644  -6.366   7.165
  366   2HB   LYS  47          HB1       LYS  47   4.846  -6.068   8.890
  367   1HG   LYS  47          HG2       LYS  47   2.675  -6.615   9.141
  368   2HG   LYS  47          HG1       LYS  47   2.280  -5.116   8.303
  369   1HD   LYS  47          HD2       LYS  47   2.146  -6.204   6.191
  370   2HD   LYS  47          HD1       LYS  47   2.938  -7.655   6.807
  371   1HE   LYS  47          HE2       LYS  47   0.899  -7.787   8.444
  372   2HE   LYS  47          HE1       LYS  47   0.113  -6.715   7.268
  373   1HZ   LYS  47          HZ1       LYS  47   1.319  -9.379   6.777
  374   2HZ   LYS  47          HZ2       LYS  47   0.958  -8.295   5.520
  375   3HZ   LYS  47          HZ3       LYS  47  -0.286  -8.899   6.508
  376    H    LYS  48           HN       LYS  48   5.201  -3.633   5.346
  377    HA   LYS  48           HA       LYS  48   2.528  -2.540   4.643
  378   1HB   LYS  48          HB2       LYS  48   5.097  -2.518   3.037
  379   2HB   LYS  48          HB1       LYS  48   3.718  -1.435   2.870
  380   1HG   LYS  48          HG2       LYS  48   4.490  -1.189   5.555
  381   2HG   LYS  48          HG1       LYS  48   6.005  -1.227   4.651
  382   1HD   LYS  48          HD2       LYS  48   4.612   0.419   3.055
  383   2HD   LYS  48          HD1       LYS  48   3.809   0.780   4.583
  384   1HE   LYS  48          HE2       LYS  48   6.829   0.767   4.340
  385   2HE   LYS  48          HE1       LYS  48   5.861   2.224   4.036
  386   1HZ   LYS  48          HZ1       LYS  48   6.633   1.776   6.428
  387   2HZ   LYS  48          HZ2       LYS  48   5.422   0.585   6.453
  388   3HZ   LYS  48          HZ3       LYS  48   5.013   2.212   6.181
  389    H    VAL  49           HN       VAL  49   1.184  -3.540   3.184
  390    HA   VAL  49           HA       VAL  49   2.123  -6.104   1.956
  391    HB   VAL  49           HB       VAL  49  -0.656  -4.976   2.442
  392   1HG1  VAL  49          HG1       VAL  49  -0.947  -6.562   0.759
  393   2HG1  VAL  49          HG1       VAL  49  -1.111  -7.560   2.203
  394   3HG1  VAL  49          HG1       VAL  49   0.409  -7.545   1.311
  395   1HG2  VAL  49          HG2       VAL  49   1.150  -6.789   4.040
  396   2HG2  VAL  49          HG2       VAL  49  -0.602  -6.901   4.195
  397   3HG2  VAL  49          HG2       VAL  49   0.222  -5.393   4.591
  398    H    CYS  50           HN       CYS  50   2.180  -6.255  -0.293
  399    HA   CYS  50           HA       CYS  50   1.729  -3.793  -1.842
  400   1HB   CYS  50          HB2       CYS  50   2.927  -6.510  -2.231
  401   2HB   CYS  50          HB1       CYS  50   2.484  -5.580  -3.662
  402    H    THR  51           HN       THR  51   0.391  -3.793  -3.795
  403    HA   THR  51           HA       THR  51  -1.653  -5.897  -4.124
  404    HB   THR  51           HB       THR  51  -3.436  -4.042  -3.836
  405    HG1  THR  51           HG1      THR  51  -1.335  -2.883  -2.336
  406   1HG2  THR  51          HG2       THR  51  -2.624  -5.940  -2.169
  407   2HG2  THR  51          HG2       THR  51  -3.759  -4.698  -1.639
  408   3HG2  THR  51          HG2       THR  51  -2.048  -4.558  -1.236
  409    H    HIS  52           HN       HIS  52  -3.406  -4.573  -5.776
  410    HA   HIS  52           HA       HIS  52  -1.660  -3.374  -7.883
  411   1HB   HIS  52          HB2       HIS  52  -3.012  -5.831  -7.856
  412   2HB   HIS  52          HB1       HIS  52  -4.008  -4.783  -8.865
  413    HD1  HIS  52           HD1      HIS  52  -3.139  -6.350 -10.887
  414    HD2  HIS  52           HD2      HIS  52  -0.247  -3.942  -9.092
  415    HE1  HIS  52           HE1      HIS  52  -1.175  -6.278 -12.483
  416    HA   PRO  53           HA       PRO  53  -4.635  -0.094  -7.675
  417   1HB   PRO  53          HB2       PRO  53  -4.020   1.159 -10.037
  418   2HB   PRO  53          HB1       PRO  53  -3.010   1.290  -8.583
  419   1HG   PRO  53          HG2       PRO  53  -2.653  -0.439 -10.985
  420   2HG   PRO  53          HG1       PRO  53  -1.445   0.460 -10.054
  421   1HD   PRO  53          HD2       PRO  53  -1.824  -2.211  -9.779
  422   2HD   PRO  53          HD1       PRO  53  -1.276  -1.170  -8.445
  423    H    ARG  54           HN       ARG  54  -4.330  -2.194 -10.497
  424    HA   ARG  54           HA       ARG  54  -6.728  -1.436 -11.869
  425   1HB   ARG  54          HB2       ARG  54  -4.838  -2.824 -12.742
  426   2HB   ARG  54          HB1       ARG  54  -5.345  -4.133 -11.674
  427   1HG   ARG  54          HG2       ARG  54  -6.384  -4.679 -13.714
  428   2HG   ARG  54          HG1       ARG  54  -7.667  -3.865 -12.820
  429   1HD   ARG  54          HD2       ARG  54  -7.678  -2.872 -15.007
  430   2HD   ARG  54          HD1       ARG  54  -6.851  -1.696 -13.969
  431    HE   ARG  54           HE       ARG  54  -4.886  -2.136 -15.194
  432   1HH1  ARG  54          HH1       ARG  54  -7.299  -4.302 -16.188
  433   2HH1  ARG  54          HH1       ARG  54  -6.205  -5.459 -16.865
  434   1HH2  ARG  54          HH2       ARG  54  -3.359  -3.855 -15.715
  435   2HH2  ARG  54          HH2       ARG  54  -3.982  -5.205 -16.601
  436    H    LYS  55           HN       LYS  55  -6.094  -3.835  -9.307
  437    HA   LYS  55           HA       LYS  55  -8.659  -5.053  -9.208
  438   1HB   LYS  55          HB2       LYS  55  -6.251  -4.747  -7.551
  439   2HB   LYS  55          HB1       LYS  55  -7.719  -4.968  -6.597
  440   1HG   LYS  55          HG2       LYS  55  -7.014  -7.177  -7.011
  441   2HG   LYS  55          HG1       LYS  55  -8.239  -6.906  -8.251
  442   1HD   LYS  55          HD2       LYS  55  -6.608  -7.647  -9.664
  443   2HD   LYS  55          HD1       LYS  55  -6.025  -5.987  -9.537
  444   1HE   LYS  55          HE2       LYS  55  -4.118  -7.360  -9.066
  445   2HE   LYS  55          HE1       LYS  55  -4.685  -6.809  -7.476
  446   1HZ   LYS  55          HZ1       LYS  55  -4.333  -9.260  -7.635
  447   2HZ   LYS  55          HZ2       LYS  55  -5.597  -9.322  -8.769
  448   3HZ   LYS  55          HZ3       LYS  55  -5.903  -8.814  -7.178
  449    H    LYS  56           HN       LYS  56 -10.552  -3.909  -9.008
  450    HA   LYS  56           HA       LYS  56 -10.902  -1.269  -8.156
  451   1HB   LYS  56          HB2       LYS  56 -12.461  -3.501  -8.907
  452   2HB   LYS  56          HB1       LYS  56 -13.140  -2.925  -7.384
  453   1HG   LYS  56          HG2       LYS  56 -13.698  -0.851  -8.253
  454   2HG   LYS  56          HG1       LYS  56 -12.431  -0.907  -9.478
  455   1HD   LYS  56          HD2       LYS  56 -14.101  -1.451 -10.911
  456   2HD   LYS  56          HD1       LYS  56 -14.006  -3.054 -10.180
  457   1HE   LYS  56          HE2       LYS  56 -15.827  -2.619  -8.715
  458   2HE   LYS  56          HE1       LYS  56 -15.736  -0.869  -8.994
  459   1HZ   LYS  56          HZ1       LYS  56 -17.487  -2.119 -10.306
  460   2HZ   LYS  56          HZ2       LYS  56 -16.206  -2.796 -11.193
  461   3HZ   LYS  56          HZ3       LYS  56 -16.451  -1.115 -11.200
  462    H    TRP  57           HN       TRP  57 -11.132  -4.226  -6.137
  463    HA   TRP  57           HA       TRP  57 -11.938  -3.014  -3.729
  464   1HB   TRP  57          HB2       TRP  57 -11.436  -5.097  -2.832
  465   2HB   TRP  57          HB1       TRP  57 -11.443  -5.505  -4.541
  466    HD1  TRP  57           HD1      TRP  57  -9.306  -6.570  -5.473
  467    HE1  TRP  57           HE1      TRP  57  -6.904  -6.914  -4.595
  468    HE3  TRP  57           HE3      TRP  57  -9.549  -3.850  -1.162
  469    HZ2  TRP  57           HZ2      TRP  57  -5.300  -6.127  -2.356
  470    HZ3  TRP  57           HZ3      TRP  57  -7.574  -3.668   0.323
  471    HH2  TRP  57           HH2      TRP  57  -5.453  -4.800  -0.267
  472    H    VAL  58           HN       VAL  58  -8.697  -3.187  -5.169
  473    HA   VAL  58           HA       VAL  58  -7.220  -2.182  -2.918
  474    HB   VAL  58           HB       VAL  58  -6.765  -1.995  -5.913
  475   1HG1  VAL  58          HG1       VAL  58  -4.587  -1.332  -5.508
  476   2HG1  VAL  58          HG1       VAL  58  -4.551  -2.066  -3.906
  477   3HG1  VAL  58          HG1       VAL  58  -5.395  -0.540  -4.159
  478   1HG2  VAL  58          HG2       VAL  58  -7.108  -4.290  -4.879
  479   2HG2  VAL  58          HG2       VAL  58  -5.662  -3.990  -3.917
  480   3HG2  VAL  58          HG2       VAL  58  -5.553  -4.066  -5.675
  481    H    GLN  59           HN       GLN  59  -8.557  -0.524  -5.801
  482    HA   GLN  59           HA       GLN  59  -7.795   2.125  -5.130
  483   1HB   GLN  59          HB2       GLN  59 -10.184   0.944  -6.585
  484   2HB   GLN  59          HB1       GLN  59  -9.813   2.669  -6.583
  485   1HG   GLN  59          HG2       GLN  59  -7.385   1.434  -7.227
  486   2HG   GLN  59          HG1       GLN  59  -8.596   0.530  -8.137
  487   1HE2  GLN  59          HE2       GLN  59  -8.218   1.446 -10.222
  488   2HE2  GLN  59          HE2       GLN  59  -8.442   3.094 -10.565
  489    H    LYS  60           HN       LYS  60 -10.260   0.014  -3.854
  490    HA   LYS  60           HA       LYS  60 -11.845   2.084  -2.581
  491   1HB   LYS  60          HB2       LYS  60 -12.164  -0.545  -3.244
  492   2HB   LYS  60          HB1       LYS  60 -11.828  -0.684  -1.518
  493   1HG   LYS  60          HG2       LYS  60 -13.639   1.501  -1.918
  494   2HG   LYS  60          HG1       LYS  60 -14.270   0.087  -2.762
  495   1HD   LYS  60          HD2       LYS  60 -13.921  -1.254  -0.677
  496   2HD   LYS  60          HD1       LYS  60 -13.444   0.229   0.151
  497   1HE   LYS  60          HE2       LYS  60 -15.615   1.171  -0.037
  498   2HE   LYS  60          HE1       LYS  60 -16.095   0.015  -1.295
  499   1HZ   LYS  60          HZ1       LYS  60 -15.605  -0.504   1.578
  500   2HZ   LYS  60          HZ2       LYS  60 -15.584  -1.755   0.430
  501   3HZ   LYS  60          HZ3       LYS  60 -16.998  -0.846   0.673
  502    H    TYR  61           HN       TYR  61  -9.147  -0.032  -1.635
  503    HA   TYR  61           HA       TYR  61  -9.209   0.760   1.170
  504   1HB   TYR  61          HB2       TYR  61  -7.574  -0.881  -0.682
  505   2HB   TYR  61          HB1       TYR  61  -6.711  -0.225   0.709
  506    HD1  TYR  61           HD1      TYR  61  -6.563  -1.734   2.469
  507    HD2  TYR  61           HD2      TYR  61 -10.166  -1.590   0.133
  508    HE1  TYR  61           HE1      TYR  61  -7.573  -3.475   3.917
  509    HE2  TYR  61           HE2      TYR  61 -11.175  -3.330   1.584
  510    HH   TYR  61           HH       TYR  61  -9.563  -4.449   4.504
  511    H    ILE  62           HN       ILE  62  -7.565   1.873  -1.753
  512    HA   ILE  62           HA       ILE  62  -5.655   3.607  -0.466
  513    HB   ILE  62           HB       ILE  62  -6.985   3.767  -3.195
  514   1HG1  ILE  62          HG1       ILE  62  -4.327   2.503  -2.487
  515   2HG1  ILE  62          HG1       ILE  62  -5.825   1.574  -2.550
  516   1HG2  ILE  62          HG2       ILE  62  -5.824   5.736  -3.202
  517   2HG2  ILE  62          HG2       ILE  62  -4.436   4.688  -3.493
  518   3HG2  ILE  62          HG2       ILE  62  -4.793   5.245  -1.858
  519   1HD1  ILE  62          HD1       ILE  62  -5.992   2.890  -4.915
  520   2HD1  ILE  62          HD1       ILE  62  -5.242   1.303  -4.744
  521   3HD1  ILE  62          HD1       ILE  62  -4.240   2.754  -4.761
  522    H    SER  63           HN       SER  63  -8.815   4.302  -2.023
  523    HA   SER  63           HA       SER  63  -8.985   7.048  -1.329
  524   1HB   SER  63          HB2       SER  63 -10.707   4.863  -2.233
  525   2HB   SER  63          HB1       SER  63 -11.574   5.999  -1.203
  526    HG   SER  63           HG       SER  63 -10.857   6.286  -3.739
  527    H    LEU  64           HN       LEU  64  -9.748   4.117   0.511
  528    HA   LEU  64           HA       LEU  64 -10.951   5.491   2.769
  529   1HB   LEU  64          HB2       LEU  64 -10.089   2.775   1.957
  530   2HB   LEU  64          HB1       LEU  64 -10.064   3.071   3.697
  531    HG   LEU  64           HG       LEU  64 -12.455   3.883   2.060
  532   1HD1  LEU  64          HD1       LEU  64 -13.381   1.756   2.086
  533   2HD1  LEU  64          HD1       LEU  64 -12.384   1.225   3.439
  534   3HD1  LEU  64          HD1       LEU  64 -11.683   1.357   1.825
  535   1HD2  LEU  64          HD2       LEU  64 -12.286   4.675   4.376
  536   2HD2  LEU  64          HD2       LEU  64 -12.025   3.025   4.940
  537   3HD2  LEU  64          HD2       LEU  64 -13.579   3.484   4.246
  538    H    LEU  65           HN       LEU  65  -7.861   3.659   2.616
  539    HA   LEU  65           HA       LEU  65  -6.727   4.757   4.968
  540   1HB   LEU  65          HB2       LEU  65  -5.523   3.690   2.393
  541   2HB   LEU  65          HB1       LEU  65  -4.567   4.023   3.837
  542    HG   LEU  65           HG       LEU  65  -6.865   2.053   3.604
  543   1HD1  LEU  65          HD1       LEU  65  -5.293   0.414   3.466
  544   2HD1  LEU  65          HD1       LEU  65  -4.233   1.207   4.630
  545   3HD1  LEU  65          HD1       LEU  65  -4.224   1.713   2.943
  546   1HD2  LEU  65          HD2       LEU  65  -7.066   2.933   5.789
  547   2HD2  LEU  65          HD2       LEU  65  -5.320   3.100   5.975
  548   3HD2  LEU  65          HD2       LEU  65  -6.061   1.500   6.004
  549    H    LYS  66           HN       LYS  66  -5.452   5.584   1.749
  550    HA   LYS  66           HA       LYS  66  -4.522   7.624   0.973
  551   1HB   LYS  66          HB2       LYS  66  -7.256   7.803   1.689
  552   2HB   LYS  66          HB1       LYS  66  -6.511   9.312   2.215
  553   1HG   LYS  66          HG2       LYS  66  -5.396   9.334  -0.129
  554   2HG   LYS  66          HG1       LYS  66  -6.625   8.144  -0.561
  555   1HD   LYS  66          HD2       LYS  66  -7.920   9.953  -1.024
  556   2HD   LYS  66          HD1       LYS  66  -8.130  10.044   0.725
  557   1HE   LYS  66          HE2       LYS  66  -7.218  12.123   0.598
  558   2HE   LYS  66          HE1       LYS  66  -5.673  11.322   0.249
  559   1HZ   LYS  66          HZ1       LYS  66  -6.211  11.285  -2.077
  560   2HZ   LYS  66          HZ2       LYS  66  -6.359  12.883  -1.520
  561   3HZ   LYS  66          HZ3       LYS  66  -7.748  11.942  -1.788
  562    H    THR  67           HN       THR  67  -2.829   7.144   2.873
  563    HA   THR  67           HA       THR  67  -2.801   9.571   4.615
  564    HB   THR  67           HB       THR  67  -1.557   7.005   5.503
  565    HG1  THR  67           HG1      THR  67  -3.422   6.066   5.246
  566   1HG2  THR  67          HG2       THR  67  -1.317   8.328   7.307
  567   2HG2  THR  67          HG2       THR  67  -3.062   8.205   7.533
  568   3HG2  THR  67          HG2       THR  67  -2.384   9.553   6.620
  569    HA   PRO  68           HA       PRO  68   1.054   9.482   2.159
  570   1HB   PRO  68          HB2       PRO  68   1.337  12.200   2.040
  571   2HB   PRO  68          HB1       PRO  68   0.307  11.289   0.917
  572   1HG   PRO  68          HG2       PRO  68  -0.450  12.881   3.311
  573   2HG   PRO  68          HG1       PRO  68  -1.281  12.712   1.757
  574   1HD   PRO  68          HD2       PRO  68  -2.029  11.406   4.040
  575   2HD   PRO  68          HD1       PRO  68  -2.367  10.813   2.399
  576    H    LYS  69           HN       LYS  69   1.830   8.618   4.349
  577    HA   LYS  69           HA       LYS  69   3.215  10.761   5.908
  578   1HB   LYS  69          HB2       LYS  69   1.795   8.213   6.628
  579   2HB   LYS  69          HB1       LYS  69   3.060   8.825   7.694
  580   1HG   LYS  69          HG2       LYS  69   1.256  10.952   6.857
  581   2HG   LYS  69          HG1       LYS  69   0.384   9.644   7.658
  582   1HD   LYS  69          HD2       LYS  69   1.050  10.594   9.600
  583   2HD   LYS  69          HD1       LYS  69   2.647   9.940   9.232
  584   1HE   LYS  69          HE2       LYS  69   3.429  12.063   9.120
  585   2HE   LYS  69          HE1       LYS  69   2.375  12.336   7.717
  586   1HZ   LYS  69          HZ1       LYS  69   1.293  12.367  10.464
  587   2HZ   LYS  69          HZ2       LYS  69   0.634  13.048   9.054
  588   3HZ   LYS  69          HZ3       LYS  69   1.985  13.763   9.795
  589    H    GLN  70           HN       GLN  70   5.341  10.704   5.190
  590    HA   GLN  70           HA       GLN  70   6.706   8.035   5.194
  591   1HB   GLN  70          HB2       GLN  70   6.216   9.923   3.031
  592   2HB   GLN  70          HB1       GLN  70   7.943   9.634   3.245
  593   1HG   GLN  70          HG2       GLN  70   7.788   7.421   2.654
  594   2HG   GLN  70          HG1       GLN  70   6.172   7.244   3.339
  595   1HE2  GLN  70          HE2       GLN  70   4.648   9.106   2.018
  596   2HE2  GLN  70          HE2       GLN  70   4.688   8.848   0.341
  597    H    LEU  71           HN       LEU  71   9.240   8.536   5.043
  598    HA   LEU  71           HA       LEU  71   9.836  10.408   7.265
  599   1HB   LEU  71          HB2       LEU  71  10.712   7.883   6.427
  600   2HB   LEU  71          HB1       LEU  71  12.066   8.956   6.068
  601    HG   LEU  71           HG       LEU  71  10.648   9.014   8.736
  602   1HD1  LEU  71          HD1       LEU  71  12.261   6.900   7.678
  603   2HD1  LEU  71          HD1       LEU  71  11.619   7.068   9.313
  604   3HD1  LEU  71          HD1       LEU  71  13.200   7.739   8.913
  605   1HD2  LEU  71          HD2       LEU  71  13.227   9.728   9.164
  606   2HD2  LEU  71          HD2       LEU  71  11.969  10.889   8.736
  607   3HD2  LEU  71          HD2       LEU  71  13.046  10.255   7.490
  Start of MODEL   20
    1   1H    THR   1          HT1       THR   1  21.692   2.358  11.992
    2   2H    THR   1          HT2       THR   1  22.559   3.733  11.497
    3   3H    THR   1          HT3       THR   1  23.333   2.223  11.582
    4    HA   THR   1           HA       THR   1  22.753   2.920   9.270
    5    HB   THR   1           HB       THR   1  21.299   0.454  10.241
    6    HG1  THR   1           HG1      THR   1  23.157  -0.413  10.804
    7   1HG2  THR   1          HG2       THR   1  21.730   1.325   7.729
    8   2HG2  THR   1          HG2       THR   1  21.713  -0.387   8.150
    9   3HG2  THR   1          HG2       THR   1  23.248   0.466   7.996
   10    H    ARG   2           HN       ARG   2  21.032   4.737  10.346
   11    HA   ARG   2           HA       ARG   2  18.459   4.068   8.998
   12   1HB   ARG   2          HB2       ARG   2  18.937   4.115  11.809
   13   2HB   ARG   2          HB1       ARG   2  17.951   5.526  11.421
   14   1HG   ARG   2          HG2       ARG   2  16.134   4.240  11.091
   15   2HG   ARG   2          HG1       ARG   2  17.009   3.214   9.955
   16   1HD   ARG   2          HD2       ARG   2  16.493   1.686  11.659
   17   2HD   ARG   2          HD1       ARG   2  18.100   2.238  12.173
   18    HE   ARG   2           HE       ARG   2  15.692   3.698  13.152
   19   1HH1  ARG   2          HH2       ARG   2  18.857   3.507  13.815
   20   2HH1  ARG   2          HH2       ARG   2  18.721   2.969  15.456
   21   1HH2  ARG   2          HH1       ARG   2  15.338   2.244  15.215
   22   2HH2  ARG   2          HH1       ARG   2  16.728   2.255  16.249
   23    H    GLY   3           HN       GLY   3  20.421   5.745   7.930
   24   1HA   GLY   3          HA2       GLY   3  20.196   8.495   8.683
   25   2HA   GLY   3          HA1       GLY   3  20.721   7.921   7.099
   26    H    SER   4           HN       SER   4  18.564   6.675   6.063
   27    HA   SER   4           HA       SER   4  16.309   8.638   6.264
   28   1HB   SER   4          HB2       SER   4  16.226   8.490   3.748
   29   2HB   SER   4          HB1       SER   4  17.703   9.230   4.361
   30    HG   SER   4           HG       SER   4  17.368   6.963   2.922
   31    H    ASP   5           HN       ASP   5  14.297   7.693   5.156
   32    HA   ASP   5           HA       ASP   5  13.763   5.042   6.187
   33   1HB   ASP   5          HB2       ASP   5  11.564   5.449   5.146
   34   2HB   ASP   5          HB1       ASP   5  12.118   6.893   5.994
   35    H    ILE   6           HN       ILE   6  13.414   3.108   4.977
   36    HA   ILE   6           HA       ILE   6  14.454   3.155   2.160
   37    HB   ILE   6           HB       ILE   6  14.733   1.005   4.286
   38   1HG1  ILE   6          HG1       ILE   6  16.003   3.069   4.837
   39   2HG1  ILE   6          HG1       ILE   6  17.076   1.729   4.440
   40   1HG2  ILE   6          HG2       ILE   6  15.337   1.173   1.409
   41   2HG2  ILE   6          HG2       ILE   6  15.157  -0.247   2.441
   42   3HG2  ILE   6          HG2       ILE   6  16.692   0.621   2.394
   43   1HD1  ILE   6          HD1       ILE   6  17.978   2.910   2.753
   44   2HD1  ILE   6          HD1       ILE   6  16.974   4.286   3.210
   45   3HD1  ILE   6          HD1       ILE   6  16.387   3.122   2.021
   46    H    SER   7           HN       SER   7  11.727   3.473   2.515
   47    HA   SER   7           HA       SER   7  10.516   0.766   2.258
   48   1HB   SER   7          HB2       SER   7   8.441   1.954   2.712
   49   2HB   SER   7          HB1       SER   7   9.653   2.486   3.874
   50    HG   SER   7           HG       SER   7   8.748   4.318   3.064
   51    H    LYS   8           HN       LYS   8  12.102   2.405   0.139
   52    HA   LYS   8           HA       LYS   8   9.990   2.720  -1.924
   53   1HB   LYS   8          HB2       LYS   8  12.776   3.683  -1.440
   54   2HB   LYS   8          HB1       LYS   8  12.236   3.559  -3.116
   55   1HG   LYS   8          HG2       LYS   8  10.225   4.911  -2.535
   56   2HG   LYS   8          HG1       LYS   8  10.858   5.102  -0.901
   57   1HD   LYS   8          HD2       LYS   8  12.402   6.642  -1.543
   58   2HD   LYS   8          HD1       LYS   8  12.771   5.785  -3.042
   59   1HE   LYS   8          HE2       LYS   8  10.394   6.588  -3.799
   60   2HE   LYS   8          HE1       LYS   8  10.588   7.792  -2.509
   61   1HZ   LYS   8          HZ1       LYS   8  12.428   7.276  -4.781
   62   2HZ   LYS   8          HZ2       LYS   8  12.837   8.244  -3.445
   63   3HZ   LYS   8          HZ3       LYS   8  11.559   8.698  -4.468
   64    H    THR   9           HN       THR   9   9.904   0.191  -1.745
   65    HA   THR   9           HA       THR   9  11.916  -0.958  -3.648
   66    HB   THR   9           HB       THR   9  12.109  -1.666  -1.246
   67    HG1  THR   9           HG1      THR   9  12.253  -3.831  -1.762
   68   1HG2  THR   9          HG2       THR   9   9.451  -1.576  -1.106
   69   2HG2  THR   9          HG2       THR   9  10.384  -2.674  -0.089
   70   3HG2  THR   9          HG2       THR   9   9.610  -3.274  -1.557
   71    H    CYS  10           HN       CYS  10  10.948  -3.047  -4.687
   72    HA   CYS  10           HA       CYS  10   8.342  -2.340  -5.859
   73   1HB   CYS  10          HB2       CYS  10  10.221  -4.686  -6.297
   74   2HB   CYS  10          HB1       CYS  10   8.905  -4.202  -7.361
   75    H    CYS  11           HN       CYS  11   6.810  -4.347  -6.183
   76    HA   CYS  11           HA       CYS  11   6.621  -5.857  -3.594
   77   1HB   CYS  11          HB2       CYS  11   4.717  -4.145  -5.117
   78   2HB   CYS  11          HB1       CYS  11   4.047  -5.589  -4.360
   79    H    PHE  12           HN       PHE  12   6.300  -8.047  -3.841
   80    HA   PHE  12           HA       PHE  12   5.466  -9.060  -6.521
   81   1HB   PHE  12          HB2       PHE  12   7.180 -10.894  -6.116
   82   2HB   PHE  12          HB1       PHE  12   7.863  -9.292  -6.384
   83    HD1  PHE  12           HD1      PHE  12   8.600  -7.909  -4.412
   84    HD2  PHE  12           HD2      PHE  12   7.484 -12.040  -4.039
   85    HE1  PHE  12           HE1      PHE  12   9.743  -8.018  -2.215
   86    HE2  PHE  12           HE2      PHE  12   8.628 -12.150  -1.841
   87    HZ   PHE  12           HZ       PHE  12   9.757 -10.138  -0.929
   88    H    GLN  13           HN       GLN  13   3.734  -8.709  -4.322
   89    HA   GLN  13           HA       GLN  13   2.828 -11.472  -3.904
   90   1HB   GLN  13          HB2       GLN  13   4.490 -11.216  -2.140
   91   2HB   GLN  13          HB1       GLN  13   3.793  -9.669  -1.660
   92   1HG   GLN  13          HG2       GLN  13   1.666 -10.840  -1.094
   93   2HG   GLN  13          HG1       GLN  13   2.441 -12.377  -1.481
   94   1HE2  GLN  13          HE2       GLN  13   1.814 -10.251   1.077
   95   2HE2  GLN  13          HE2       GLN  13   3.001 -10.804   2.159
   96    H    TYR  14           HN       TYR  14   0.876 -10.771  -4.921
   97    HA   TYR  14           HA       TYR  14  -0.569  -8.476  -3.718
   98   1HB   TYR  14          HB2       TYR  14  -1.160 -10.199  -6.144
   99   2HB   TYR  14          HB1       TYR  14  -1.944  -8.672  -5.739
  100    HD1  TYR  14           HD1      TYR  14   0.191  -6.925  -4.899
  101    HD2  TYR  14           HD2      TYR  14   0.192  -9.876  -8.022
  102    HE1  TYR  14           HE1      TYR  14   2.000  -5.693  -6.065
  103    HE2  TYR  14           HE2      TYR  14   2.001  -8.643  -9.186
  104    HH   TYR  14           HH       TYR  14   3.931  -6.507  -7.837
  105    H    SER  15           HN       SER  15  -2.179  -8.849  -2.254
  106    HA   SER  15           HA       SER  15  -3.147 -11.620  -1.843
  107   1HB   SER  15          HB2       SER  15  -3.653  -9.072  -0.277
  108   2HB   SER  15          HB1       SER  15  -3.932 -10.721   0.278
  109    HG   SER  15           HG       SER  15  -1.793  -9.384   0.660
  110    H    HIS  16           HN       HIS  16  -5.369 -12.155  -2.058
  111    HA   HIS  16           HA       HIS  16  -7.059 -10.065  -3.392
  112   1HB   HIS  16          HB2       HIS  16  -8.150 -12.115  -4.445
  113   2HB   HIS  16          HB1       HIS  16  -6.483 -11.814  -4.930
  114    HD1  HIS  16           HD1      HIS  16  -5.574 -14.131  -5.254
  115    HD2  HIS  16           HD2      HIS  16  -7.613 -13.759  -1.636
  116    HE1  HIS  16           HE1      HIS  16  -5.202 -16.296  -3.996
  117    H    LYS  17           HN       LYS  17  -7.283  -9.873  -0.740
  118    HA   LYS  17           HA       LYS  17  -9.950 -11.031  -0.184
  119   1HB   LYS  17          HB2       LYS  17  -7.434 -11.983   0.880
  120   2HB   LYS  17          HB1       LYS  17  -8.449 -11.373   2.186
  121   1HG   LYS  17          HG2       LYS  17 -10.343 -12.753   1.246
  122   2HG   LYS  17          HG1       LYS  17  -9.179 -13.479   0.136
  123   1HD   LYS  17          HD2       LYS  17  -8.087 -13.536   2.792
  124   2HD   LYS  17          HD1       LYS  17  -9.708 -14.229   2.825
  125   1HE   LYS  17          HE2       LYS  17  -9.152 -15.881   1.197
  126   2HE   LYS  17          HE1       LYS  17  -7.660 -15.035   0.743
  127   1HZ   LYS  17          HZ1       LYS  17  -7.430 -16.961   2.367
  128   2HZ   LYS  17          HZ2       LYS  17  -8.160 -15.943   3.515
  129   3HZ   LYS  17          HZ3       LYS  17  -6.683 -15.502   2.801
  130    HA   PRO  18           HA       PRO  18 -10.423  -7.054   1.662
  131   1HB   PRO  18          HB2       PRO  18 -12.512  -7.543   3.357
  132   2HB   PRO  18          HB1       PRO  18 -12.704  -7.415   1.597
  133   1HG   PRO  18          HG2       PRO  18 -12.580  -9.835   3.317
  134   2HG   PRO  18          HG1       PRO  18 -13.566  -9.517   1.882
  135   1HD   PRO  18          HD2       PRO  18 -11.295 -11.046   1.864
  136   2HD   PRO  18          HD1       PRO  18 -11.917 -10.175   0.445
  137    H    LEU  19           HN       LEU  19  -8.716  -6.538   3.017
  138    HA   LEU  19           HA       LEU  19  -7.979  -8.051   5.365
  139   1HB   LEU  19          HB2       LEU  19  -6.885  -6.125   3.728
  140   2HB   LEU  19          HB1       LEU  19  -7.216  -5.205   5.195
  141    HG   LEU  19           HG       LEU  19  -6.041  -7.845   5.718
  142   1HD1  LEU  19          HD1       LEU  19  -4.054  -7.669   4.606
  143   2HD1  LEU  19          HD1       LEU  19  -4.022  -5.911   4.737
  144   3HD1  LEU  19          HD1       LEU  19  -4.997  -6.685   3.488
  145   1HD2  LEU  19          HD2       LEU  19  -4.633  -5.399   6.545
  146   2HD2  LEU  19          HD2       LEU  19  -5.255  -6.723   7.530
  147   3HD2  LEU  19          HD2       LEU  19  -6.332  -5.424   7.016
  148    HA   PRO  20           HA       PRO  20 -10.886  -6.342   8.218
  149   1HB   PRO  20          HB2       PRO  20  -9.494  -6.683  10.554
  150   2HB   PRO  20          HB1       PRO  20 -10.278  -8.021   9.691
  151   1HG   PRO  20          HG2       PRO  20  -7.414  -7.202   9.710
  152   2HG   PRO  20          HG1       PRO  20  -8.123  -8.824   9.733
  153   1HD   PRO  20          HD2       PRO  20  -7.088  -7.697   7.491
  154   2HD   PRO  20          HD1       PRO  20  -8.420  -8.874   7.458
  155    H    TRP  21           HN       TRP  21 -11.054  -4.124   7.980
  156    HA   TRP  21           HA       TRP  21  -9.096  -2.154   7.975
  157   1HB   TRP  21          HB2       TRP  21 -11.926  -2.141   9.060
  158   2HB   TRP  21          HB1       TRP  21 -10.994  -0.676   8.737
  159    HD1  TRP  21           HD1      TRP  21 -12.996  -3.363   7.045
  160    HE1  TRP  21           HE1      TRP  21 -13.053  -2.935   4.505
  161    HE3  TRP  21           HE3      TRP  21  -9.510   0.351   6.701
  162    HZ2  TRP  21           HZ2      TRP  21 -11.782  -1.246   2.585
  163    HZ3  TRP  21           HZ3      TRP  21  -8.953   1.351   4.503
  164    HH2  TRP  21           HH2      TRP  21 -10.087   0.559   2.445
  165    H    THR  22           HN       THR  22 -10.365  -3.870  10.761
  166    HA   THR  22           HA       THR  22  -9.570  -2.091  12.840
  167    HB   THR  22           HB       THR  22  -9.448  -4.305  14.118
  168    HG1  THR  22           HG1      THR  22  -9.472  -6.079  13.007
  169   1HG2  THR  22          HG2       THR  22 -11.677  -3.011  12.809
  170   2HG2  THR  22          HG2       THR  22 -11.616  -3.770  14.400
  171   3HG2  THR  22          HG2       THR  22 -11.985  -4.740  12.973
  172    H    TRP  23           HN       TRP  23  -7.775  -4.500  10.964
  173    HA   TRP  23           HA       TRP  23  -5.296  -3.925  12.494
  174   1HB   TRP  23          HB2       TRP  23  -5.886  -5.912  10.280
  175   2HB   TRP  23          HB1       TRP  23  -4.461  -5.900  11.314
  176    HD1  TRP  23           HD1      TRP  23  -6.742  -5.070  13.808
  177    HE1  TRP  23           HE1      TRP  23  -7.809  -7.114  14.965
  178    HE3  TRP  23           HE3      TRP  23  -5.688  -8.678  10.358
  179    HZ2  TRP  23           HZ2      TRP  23  -8.167  -9.914  14.487
  180    HZ3  TRP  23           HZ3      TRP  23  -6.401 -11.025  10.731
  181    HH2  TRP  23           HH2      TRP  23  -7.638 -11.647  12.789
  182    H    VAL  24           HN       VAL  24  -6.843  -2.548   9.886
  183    HA   VAL  24           HA       VAL  24  -4.446  -2.285   8.180
  184    HB   VAL  24           HB       VAL  24  -7.210  -1.038   7.972
  185   1HG1  VAL  24          HG1       VAL  24  -5.487  -1.586   5.611
  186   2HG1  VAL  24          HG1       VAL  24  -4.971  -0.266   6.660
  187   3HG1  VAL  24          HG1       VAL  24  -6.572  -0.231   5.921
  188   1HG2  VAL  24          HG2       VAL  24  -6.935  -3.638   7.980
  189   2HG2  VAL  24          HG2       VAL  24  -6.196  -3.400   6.397
  190   3HG2  VAL  24          HG2       VAL  24  -7.861  -2.894   6.678
  191    H    ARG  25           HN       ARG  25  -3.354  -0.240   7.858
  192    HA   ARG  25           HA       ARG  25  -4.076   1.892   9.838
  193   1HB   ARG  25          HB2       ARG  25  -2.243   0.335  10.579
  194   2HB   ARG  25          HB1       ARG  25  -1.294   0.880   9.194
  195   1HG   ARG  25          HG2       ARG  25  -1.918   3.280  10.185
  196   2HG   ARG  25          HG1       ARG  25  -2.037   2.355  11.682
  197   1HD   ARG  25          HD2       ARG  25   0.232   1.749  11.644
  198   2HD   ARG  25          HD1       ARG  25   0.372   2.024   9.896
  199    HE   ARG  25           HE       ARG  25   0.181   4.460  10.355
  200   1HH1  ARG  25          HH1       ARG  25  -0.339   2.869  13.263
  201   2HH1  ARG  25          HH1       ARG  25   0.745   3.846  14.196
  202   1HH2  ARG  25          HH2       ARG  25   2.045   5.504  11.443
  203   2HH2  ARG  25          HH2       ARG  25   2.094   5.338  13.167
  204    H    SER  26           HN       SER  26  -1.833   1.261   7.081
  205    HA   SER  26           HA       SER  26  -2.739   3.821   5.855
  206   1HB   SER  26          HB2       SER  26  -0.432   4.642   5.775
  207   2HB   SER  26          HB1       SER  26  -0.898   4.314   7.440
  208    HG   SER  26           HG       SER  26   0.415   2.624   7.487
  209    H    TYR  27           HN       TYR  27  -0.733   4.026   3.939
  210    HA   TYR  27           HA       TYR  27  -0.355   1.449   2.586
  211   1HB   TYR  27          HB2       TYR  27  -1.945   1.778   0.871
  212   2HB   TYR  27          HB1       TYR  27  -2.794   2.362   2.297
  213    HD1  TYR  27           HD1      TYR  27  -3.096   4.787   2.681
  214    HD2  TYR  27           HD2      TYR  27  -1.193   3.286  -0.864
  215    HE1  TYR  27           HE1      TYR  27  -3.357   7.003   1.600
  216    HE2  TYR  27           HE2      TYR  27  -1.453   5.499  -1.946
  217    HH   TYR  27           HH       TYR  27  -1.719   7.880  -1.214
  218    H    GLU  28           HN       GLU  28   0.458   2.092   0.169
  219    HA   GLU  28           HA       GLU  28   1.719   4.646  -0.211
  220   1HB   GLU  28          HB2       GLU  28   4.070   3.863   0.252
  221   2HB   GLU  28          HB1       GLU  28   3.064   3.946   1.697
  222   1HG   GLU  28          HG2       GLU  28   2.623   1.533   1.552
  223   2HG   GLU  28          HG1       GLU  28   3.592   1.436   0.081
  224    H    PHE  29           HN       PHE  29   2.495   4.771  -2.324
  225    HA   PHE  29           HA       PHE  29   2.043   2.430  -4.049
  226   1HB   PHE  29          HB2       PHE  29   2.220   5.333  -4.223
  227   2HB   PHE  29          HB1       PHE  29   3.137   4.559  -5.515
  228    HD1  PHE  29           HD1      PHE  29   2.045   3.155  -7.180
  229    HD2  PHE  29           HD2      PHE  29  -0.204   5.004  -4.022
  230    HE1  PHE  29           HE1      PHE  29  -0.063   2.636  -8.379
  231    HE2  PHE  29           HE2      PHE  29  -2.314   4.484  -5.222
  232    HZ   PHE  29           HZ       PHE  29  -2.242   3.301  -7.400
  233    H    THR  30           HN       THR  30   3.690   1.263  -5.093
  234    HA   THR  30           HA       THR  30   6.272   1.074  -3.949
  235    HB   THR  30           HB       THR  30   6.687   0.044  -6.362
  236    HG1  THR  30           HG1      THR  30   4.963  -0.048  -7.582
  237   1HG2  THR  30          HG2       THR  30   5.491  -1.980  -5.639
  238   2HG2  THR  30          HG2       THR  30   4.592  -1.033  -4.454
  239   3HG2  THR  30          HG2       THR  30   6.336  -1.239  -4.280
  240    H    SER  31           HN       SER  31   8.319   1.406  -5.487
  241    HA   SER  31           HA       SER  31   8.558   4.277  -5.936
  242   1HB   SER  31          HB2       SER  31  10.863   3.322  -6.821
  243   2HB   SER  31          HB1       SER  31  10.488   3.267  -5.102
  244    HG   SER  31           HG       SER  31  11.092   1.229  -5.633
  245    H    ASN  32           HN       ASN  32   9.636   4.988  -8.097
  246    HA   ASN  32           HA       ASN  32   7.897   4.094 -10.309
  247   1HB   ASN  32          HB2       ASN  32  10.046   6.229 -10.089
  248   2HB   ASN  32          HB1       ASN  32   8.896   6.066 -11.417
  249   1HD2  ASN  32          HD2       ASN  32   9.384   7.847  -8.674
  250   2HD2  ASN  32          HD2       ASN  32   7.774   8.186  -8.259
  251    H    SER  33           HN       SER  33  11.062   3.394  -9.143
  252    HA   SER  33           HA       SER  33  12.126   2.649 -11.796
  253   1HB   SER  33          HB2       SER  33  13.149   3.543  -9.347
  254   2HB   SER  33          HB1       SER  33  13.661   1.861  -9.451
  255    HG   SER  33           HG       SER  33  14.495   4.036 -10.854
  256    H    CYS  34           HN       CYS  34   9.798   1.207 -10.358
  257    HA   CYS  34           HA       CYS  34  10.987  -1.479  -9.919
  258   1HB   CYS  34          HB2       CYS  34   8.385  -0.079  -9.385
  259   2HB   CYS  34          HB1       CYS  34   8.417  -1.843  -9.409
  260    H    SER  35           HN       SER  35  10.116  -3.337 -11.093
  261    HA   SER  35           HA       SER  35   9.537  -2.720 -13.918
  262   1HB   SER  35          HB2       SER  35   9.656  -5.439 -12.621
  263   2HB   SER  35          HB1       SER  35  10.133  -4.980 -14.253
  264    HG   SER  35           HG       SER  35  11.810  -3.712 -13.249
  265    H    GLN  36           HN       GLN  36   7.768  -3.562 -11.058
  266    HA   GLN  36           HA       GLN  36   5.304  -3.921 -12.719
  267   1HB   GLN  36          HB2       GLN  36   6.701  -5.907 -11.312
  268   2HB   GLN  36          HB1       GLN  36   5.332  -5.503 -10.274
  269   1HG   GLN  36          HG2       GLN  36   3.752  -6.027 -11.962
  270   2HG   GLN  36          HG1       GLN  36   4.980  -6.008 -13.229
  271   1HE2  GLN  36          HE2       GLN  36   4.201  -8.277 -13.729
  272   2HE2  GLN  36          HE2       GLN  36   4.785  -9.565 -12.792
  273    H    ARG  37           HN       ARG  37   4.248  -2.012 -12.151
  274    HA   ARG  37           HA       ARG  37   4.437  -0.579  -9.729
  275   1HB   ARG  37          HB2       ARG  37   2.752  -0.731 -12.098
  276   2HB   ARG  37          HB1       ARG  37   1.807  -0.298 -10.673
  277   1HG   ARG  37          HG2       ARG  37   4.318   1.132 -10.664
  278   2HG   ARG  37          HG1       ARG  37   3.475   1.403 -12.189
  279   1HD   ARG  37          HD2       ARG  37   1.463   1.561 -10.230
  280   2HD   ARG  37          HD1       ARG  37   2.840   2.454  -9.556
  281    HE   ARG  37           HE       ARG  37   2.833   3.874 -11.536
  282   1HH1  ARG  37          HH2       ARG  37  -0.127   3.541 -10.594
  283   2HH1  ARG  37          HH2       ARG  37  -0.912   3.409 -12.132
  284   1HH2  ARG  37          HH1       ARG  37   2.027   2.836 -13.881
  285   2HH2  ARG  37          HH1       ARG  37   0.307   3.009 -13.993
  286    H    ALA  38           HN       ALA  38   3.116  -0.605  -7.808
  287    HA   ALA  38           HA       ALA  38   0.999  -2.560  -7.431
  288   1HB   ALA  38          HB1       ALA  38   2.431  -3.833  -5.695
  289   2HB   ALA  38          HB2       ALA  38   3.817  -3.076  -6.480
  290   3HB   ALA  38          HB3       ALA  38   2.760  -4.149  -7.398
  291    H    VAL  39           HN       VAL  39  -0.297  -1.701  -5.869
  292    HA   VAL  39           HA       VAL  39   0.691   0.498  -4.170
  293    HB   VAL  39           HB       VAL  39  -2.002  -0.891  -4.377
  294   1HG1  VAL  39          HG1       VAL  39  -2.838   1.259  -3.425
  295   2HG1  VAL  39          HG1       VAL  39  -1.167   1.786  -3.221
  296   3HG1  VAL  39          HG1       VAL  39  -1.773   0.398  -2.314
  297   1HG2  VAL  39          HG2       VAL  39  -2.467   1.306  -5.712
  298   2HG2  VAL  39          HG2       VAL  39  -1.616  -0.010  -6.524
  299   3HG2  VAL  39          HG2       VAL  39  -0.714   1.369  -5.896
  300    H    ILE  40           HN       ILE  40   0.744   0.370  -1.841
  301    HA   ILE  40           HA       ILE  40   0.588  -2.422  -0.760
  302    HB   ILE  40           HB       ILE  40   2.509  -0.138  -0.244
  303   1HG1  ILE  40          HG1       ILE  40   3.440  -2.877  -0.851
  304   2HG1  ILE  40          HG1       ILE  40   2.560  -2.086  -2.159
  305   1HG2  ILE  40          HG2       ILE  40   3.380  -2.448   1.107
  306   2HG2  ILE  40          HG2       ILE  40   1.674  -2.279   1.520
  307   3HG2  ILE  40          HG2       ILE  40   2.794  -0.954   1.837
  308   1HD1  ILE  40          HD1       ILE  40   4.787  -1.412  -2.523
  309   2HD1  ILE  40          HD1       ILE  40   5.101  -1.206  -0.800
  310   3HD1  ILE  40          HD1       ILE  40   4.086  -0.045  -1.656
  311    H    PHE  41           HN       PHE  41  -0.401  -2.665   1.247
  312    HA   PHE  41           HA       PHE  41  -1.622  -0.217   2.479
  313   1HB   PHE  41          HB2       PHE  41  -2.669  -3.046   2.096
  314   2HB   PHE  41          HB1       PHE  41  -3.479  -1.832   3.086
  315    HD1  PHE  41           HD1      PHE  41  -3.417   0.612   1.716
  316    HD2  PHE  41           HD2      PHE  41  -3.694  -3.322   0.024
  317    HE1  PHE  41           HE1      PHE  41  -4.491   1.560  -0.308
  318    HE2  PHE  41           HE2      PHE  41  -4.772  -2.378  -2.001
  319    HZ   PHE  41           HZ       PHE  41  -5.171   0.063  -2.164
  320    H    THR  42           HN       THR  42  -0.728   0.081   4.501
  321    HA   THR  42           HA       THR  42   0.673  -2.171   5.780
  322    HB   THR  42           HB       THR  42   0.487   0.443   7.138
  323    HG1  THR  42           HG1      THR  42   1.569   1.548   5.581
  324   1HG2  THR  42          HG2       THR  42   3.099  -0.369   6.279
  325   2HG2  THR  42          HG2       THR  42   2.242  -1.764   6.933
  326   3HG2  THR  42          HG2       THR  42   2.447  -0.314   7.915
  327    H    THR  43           HN       THR  43   0.223  -2.901   7.912
  328    HA   THR  43           HA       THR  43  -2.622  -2.544   8.723
  329    HB   THR  43           HB       THR  43  -1.994  -4.659  10.062
  330    HG1  THR  43           HG1      THR  43   0.062  -5.026  10.031
  331   1HG2  THR  43          HG2       THR  43  -3.273  -5.199   8.230
  332   2HG2  THR  43          HG2       THR  43  -1.753  -5.934   7.717
  333   3HG2  THR  43          HG2       THR  43  -2.216  -4.344   7.108
  334    H    LYS  44           HN       LYS  44  -2.649  -3.142  11.324
  335    HA   LYS  44           HA       LYS  44  -1.274  -0.859  12.593
  336   1HB   LYS  44          HB2       LYS  44  -3.470  -2.799  13.265
  337   2HB   LYS  44          HB1       LYS  44  -2.744  -1.827  14.544
  338   1HG   LYS  44          HG2       LYS  44  -3.186  -0.013  12.460
  339   2HG   LYS  44          HG1       LYS  44  -4.629  -1.028  12.476
  340   1HD   LYS  44          HD2       LYS  44  -4.711  -0.663  14.996
  341   2HD   LYS  44          HD1       LYS  44  -3.474   0.575  14.767
  342   1HE   LYS  44          HE2       LYS  44  -5.730   0.843  12.895
  343   2HE   LYS  44          HE1       LYS  44  -6.190   1.040  14.597
  344   1HZ   LYS  44          HZ1       LYS  44  -5.314   3.102  13.503
  345   2HZ   LYS  44          HZ2       LYS  44  -3.803   2.332  13.400
  346   3HZ   LYS  44          HZ3       LYS  44  -4.499   2.644  14.918
  347    H    ARG  45           HN       ARG  45  -0.120  -3.767  11.839
  348    HA   ARG  45           HA       ARG  45   1.058  -4.340  14.532
  349   1HB   ARG  45          HB2       ARG  45   0.690  -5.988  12.011
  350   2HB   ARG  45          HB1       ARG  45   1.530  -6.569  13.448
  351   1HG   ARG  45          HG2       ARG  45  -0.825  -5.579  14.495
  352   2HG   ARG  45          HG1       ARG  45  -1.350  -6.275  12.963
  353   1HD   ARG  45          HD2       ARG  45   0.500  -8.111  14.129
  354   2HD   ARG  45          HD1       ARG  45  -0.678  -7.663  15.379
  355    HE   ARG  45           HE       ARG  45  -1.712  -8.327  12.673
  356   1HH1  ARG  45          HH1       ARG  45  -2.860  -8.108  15.673
  357   2HH1  ARG  45          HH1       ARG  45  -3.391  -9.746  15.852
  358   1HH2  ARG  45          HH2       ARG  45  -1.713 -10.877  13.035
  359   2HH2  ARG  45          HH2       ARG  45  -2.742 -11.314  14.358
  360    H    GLY  46           HN       GLY  46   1.775  -3.237  11.319
  361   1HA   GLY  46          HA2       GLY  46   3.933  -2.025  11.050
  362   2HA   GLY  46          HA1       GLY  46   4.688  -3.312  11.990
  363    H    LYS  47           HN       LYS  47   2.407  -4.719   9.976
  364    HA   LYS  47           HA       LYS  47   4.541  -5.569   8.096
  365   1HB   LYS  47          HB2       LYS  47   1.767  -6.606   8.759
  366   2HB   LYS  47          HB1       LYS  47   2.864  -7.372   7.610
  367   1HG   LYS  47          HG2       LYS  47   4.572  -7.476   9.495
  368   2HG   LYS  47          HG1       LYS  47   3.267  -7.008  10.586
  369   1HD   LYS  47          HD2       LYS  47   2.988  -9.356   8.707
  370   2HD   LYS  47          HD1       LYS  47   3.708  -9.532  10.307
  371   1HE   LYS  47          HE2       LYS  47   1.704  -9.105  11.407
  372   2HE   LYS  47          HE1       LYS  47   1.064  -8.124  10.074
  373   1HZ   LYS  47          HZ1       LYS  47   1.175 -10.237   8.718
  374   2HZ   LYS  47          HZ2       LYS  47  -0.035 -10.181   9.908
  375   3HZ   LYS  47          HZ3       LYS  47   1.388 -11.068  10.182
  376    H    LYS  48           HN       LYS  48   4.518  -4.827   5.999
  377    HA   LYS  48           HA       LYS  48   2.156  -3.234   5.102
  378   1HB   LYS  48          HB2       LYS  48   4.867  -3.468   3.774
  379   2HB   LYS  48          HB1       LYS  48   3.701  -2.156   3.633
  380   1HG   LYS  48          HG2       LYS  48   4.139  -2.132   6.318
  381   2HG   LYS  48          HG1       LYS  48   5.714  -2.677   5.745
  382   1HD   LYS  48          HD2       LYS  48   4.318  -0.294   4.521
  383   2HD   LYS  48          HD1       LYS  48   5.368  -0.133   5.929
  384   1HE   LYS  48          HE2       LYS  48   6.825  -1.728   4.122
  385   2HE   LYS  48          HE1       LYS  48   6.117  -0.427   3.142
  386   1HZ   LYS  48          HZ1       LYS  48   7.598  -0.085   5.698
  387   2HZ   LYS  48          HZ2       LYS  48   6.858   1.168   4.820
  388   3HZ   LYS  48          HZ3       LYS  48   8.173   0.322   4.154
  389    H    VAL  49           HN       VAL  49   0.790  -4.150   3.610
  390    HA   VAL  49           HA       VAL  49   1.704  -6.625   2.197
  391    HB   VAL  49           HB       VAL  49  -1.041  -5.457   2.763
  392   1HG1  VAL  49          HG1       VAL  49  -0.100  -7.655   1.049
  393   2HG1  VAL  49          HG1       VAL  49  -1.659  -6.829   1.064
  394   3HG1  VAL  49          HG1       VAL  49  -1.345  -8.139   2.201
  395   1HG2  VAL  49          HG2       VAL  49   0.312  -6.323   4.729
  396   2HG2  VAL  49          HG2       VAL  49   0.300  -7.904   3.948
  397   3HG2  VAL  49          HG2       VAL  49  -1.217  -7.162   4.458
  398    H    CYS  50           HN       CYS  50   1.698  -6.697  -0.060
  399    HA   CYS  50           HA       CYS  50   1.370  -4.122  -1.485
  400   1HB   CYS  50          HB2       CYS  50   2.349  -6.875  -2.308
  401   2HB   CYS  50          HB1       CYS  50   2.455  -5.425  -3.298
  402    H    THR  51           HN       THR  51   0.133  -4.088  -3.527
  403    HA   THR  51           HA       THR  51  -1.866  -6.218  -3.984
  404    HB   THR  51           HB       THR  51  -3.733  -4.578  -3.714
  405    HG1  THR  51           HG1      THR  51  -1.641  -2.936  -2.729
  406   1HG2  THR  51          HG2       THR  51  -3.813  -4.685  -1.346
  407   2HG2  THR  51          HG2       THR  51  -2.057  -4.609  -1.203
  408   3HG2  THR  51          HG2       THR  51  -2.830  -6.066  -1.826
  409    H    HIS  52           HN       HIS  52  -3.311  -5.444  -5.947
  410    HA   HIS  52           HA       HIS  52  -1.463  -4.275  -7.949
  411   1HB   HIS  52          HB2       HIS  52  -3.244  -6.427  -7.856
  412   2HB   HIS  52          HB1       HIS  52  -4.044  -5.242  -8.890
  413    HD1  HIS  52           HD1      HIS  52  -2.514  -4.283 -10.917
  414    HD2  HIS  52           HD2      HIS  52  -1.157  -7.781  -9.099
  415    HE1  HIS  52           HE1      HIS  52  -0.826  -5.306 -12.503
  416    HA   PRO  53           HA       PRO  53  -3.815  -0.493  -7.850
  417   1HB   PRO  53          HB2       PRO  53  -2.730   0.682 -10.068
  418   2HB   PRO  53          HB1       PRO  53  -1.881   0.586  -8.513
  419   1HG   PRO  53          HG2       PRO  53  -1.537  -1.061 -10.960
  420   2HG   PRO  53          HG1       PRO  53  -0.327  -0.488  -9.803
  421   1HD   PRO  53          HD2       PRO  53  -1.323  -3.043  -9.852
  422   2HD   PRO  53          HD1       PRO  53  -0.636  -2.265  -8.411
  423    H    ARG  54           HN       ARG  54  -3.591  -2.530 -10.737
  424    HA   ARG  54           HA       ARG  54  -5.577  -1.293 -12.356
  425   1HB   ARG  54          HB2       ARG  54  -4.048  -3.728 -12.200
  426   2HB   ARG  54          HB1       ARG  54  -5.717  -4.124 -12.615
  427   1HG   ARG  54          HG2       ARG  54  -5.674  -2.837 -14.573
  428   2HG   ARG  54          HG1       ARG  54  -4.307  -1.868 -14.019
  429   1HD   ARG  54          HD2       ARG  54  -2.746  -3.503 -14.576
  430   2HD   ARG  54          HD1       ARG  54  -3.918  -4.824 -14.401
  431    HE   ARG  54           HE       ARG  54  -5.032  -3.869 -16.487
  432   1HH1  ARG  54          HH1       ARG  54  -1.727  -4.350 -16.068
  433   2HH1  ARG  54          HH1       ARG  54  -1.253  -3.579 -17.545
  434   1HH2  ARG  54          HH2       ARG  54  -4.432  -2.392 -18.256
  435   2HH2  ARG  54          HH2       ARG  54  -2.783  -2.471 -18.782
  436    H    LYS  55           HN       LYS  55  -5.836  -3.438  -9.579
  437    HA   LYS  55           HA       LYS  55  -8.688  -3.986  -9.873
  438   1HB   LYS  55          HB2       LYS  55  -6.475  -4.910  -8.417
  439   2HB   LYS  55          HB1       LYS  55  -7.571  -4.237  -7.207
  440   1HG   LYS  55          HG2       LYS  55  -9.120  -5.863  -7.534
  441   2HG   LYS  55          HG1       LYS  55  -8.915  -5.832  -9.286
  442   1HD   LYS  55          HD2       LYS  55  -6.967  -7.110  -7.349
  443   2HD   LYS  55          HD1       LYS  55  -8.186  -7.991  -8.271
  444   1HE   LYS  55          HE2       LYS  55  -6.796  -6.349 -10.133
  445   2HE   LYS  55          HE1       LYS  55  -5.572  -7.164  -9.137
  446   1HZ   LYS  55          HZ1       LYS  55  -7.863  -8.436 -10.537
  447   2HZ   LYS  55          HZ2       LYS  55  -6.849  -9.243  -9.438
  448   3HZ   LYS  55          HZ3       LYS  55  -6.218  -8.640 -10.896
  449    H    LYS  56           HN       LYS  56 -10.122  -2.250  -9.638
  450    HA   LYS  56           HA       LYS  56  -9.680   0.220  -8.361
  451   1HB   LYS  56          HB2       LYS  56 -11.715  -0.974  -9.694
  452   2HB   LYS  56          HB1       LYS  56 -12.353  -1.070  -8.053
  453   1HG   LYS  56          HG2       LYS  56 -12.643   1.188  -7.893
  454   2HG   LYS  56          HG1       LYS  56 -11.168   1.540  -8.795
  455   1HD   LYS  56          HD2       LYS  56 -12.233   1.247 -10.884
  456   2HD   LYS  56          HD1       LYS  56 -13.591   0.380 -10.166
  457   1HE   LYS  56          HE2       LYS  56 -14.262   2.483  -8.982
  458   2HE   LYS  56          HE1       LYS  56 -12.969   3.337  -9.847
  459   1HZ   LYS  56          HZ1       LYS  56 -13.925   2.816 -11.918
  460   2HZ   LYS  56          HZ2       LYS  56 -15.222   3.345 -10.957
  461   3HZ   LYS  56          HZ3       LYS  56 -14.995   1.685 -11.242
  462    H    TRP  57           HN       TRP  57 -10.344  -2.922  -7.027
  463    HA   TRP  57           HA       TRP  57 -11.250  -2.517  -4.433
  464   1HB   TRP  57          HB2       TRP  57 -10.691  -4.642  -5.633
  465   2HB   TRP  57          HB1       TRP  57  -8.981  -4.282  -5.425
  466    HD1  TRP  57           HD1      TRP  57 -11.878  -5.853  -3.771
  467    HE1  TRP  57           HE1      TRP  57 -11.243  -6.612  -1.383
  468    HE3  TRP  57           HE3      TRP  57  -7.397  -3.475  -3.263
  469    HZ2  TRP  57           HZ2      TRP  57  -9.099  -6.254   0.482
  470    HZ3  TRP  57           HZ3      TRP  57  -6.077  -3.700  -1.179
  471    HH2  TRP  57           HH2      TRP  57  -6.923  -5.086   0.694
  472    H    VAL  58           HN       VAL  58  -7.882  -2.249  -5.600
  473    HA   VAL  58           HA       VAL  58  -6.757  -1.483  -3.053
  474    HB   VAL  58           HB       VAL  58  -5.881  -1.104  -5.930
  475   1HG1  VAL  58          HG1       VAL  58  -4.786   0.341  -4.043
  476   2HG1  VAL  58          HG1       VAL  58  -3.741  -0.526  -5.166
  477   3HG1  VAL  58          HG1       VAL  58  -4.036  -1.179  -3.555
  478   1HG2  VAL  58          HG2       VAL  58  -5.556  -3.279  -3.874
  479   2HG2  VAL  58          HG2       VAL  58  -4.361  -3.081  -5.155
  480   3HG2  VAL  58          HG2       VAL  58  -6.042  -3.420  -5.563
  481    H    GLN  59           HN       GLN  59  -8.105   0.313  -5.811
  482    HA   GLN  59           HA       GLN  59  -7.290   2.936  -4.990
  483   1HB   GLN  59          HB2       GLN  59  -9.644   1.859  -6.578
  484   2HB   GLN  59          HB1       GLN  59  -9.276   3.578  -6.445
  485   1HG   GLN  59          HG2       GLN  59  -7.273   1.531  -7.428
  486   2HG   GLN  59          HG1       GLN  59  -8.329   2.446  -8.506
  487   1HE2  GLN  59          HE2       GLN  59  -8.306   4.996  -7.468
  488   2HE2  GLN  59          HE2       GLN  59  -6.727   5.618  -7.425
  489    H    LYS  60           HN       LYS  60 -10.004   0.830  -4.140
  490    HA   LYS  60           HA       LYS  60 -11.490   2.786  -2.630
  491   1HB   LYS  60          HB2       LYS  60 -12.205   0.506  -3.578
  492   2HB   LYS  60          HB1       LYS  60 -11.372  -0.212  -2.200
  493   1HG   LYS  60          HG2       LYS  60 -13.082   0.281  -0.817
  494   2HG   LYS  60          HG1       LYS  60 -13.096   1.964  -1.348
  495   1HD   LYS  60          HD2       LYS  60 -15.222   1.142  -1.984
  496   2HD   LYS  60          HD1       LYS  60 -14.276   1.090  -3.471
  497   1HE   LYS  60          HE2       LYS  60 -13.779  -1.375  -2.183
  498   2HE   LYS  60          HE1       LYS  60 -15.529  -1.106  -2.067
  499   1HZ   LYS  60          HZ1       LYS  60 -15.003  -2.098  -4.192
  500   2HZ   LYS  60          HZ2       LYS  60 -13.873  -0.875  -4.526
  501   3HZ   LYS  60          HZ3       LYS  60 -15.529  -0.504  -4.430
  502    H    TYR  61           HN       TYR  61  -8.847   0.545  -1.901
  503    HA   TYR  61           HA       TYR  61  -8.909   1.026   0.978
  504   1HB   TYR  61          HB2       TYR  61  -7.211  -0.401  -1.030
  505   2HB   TYR  61          HB1       TYR  61  -6.524  -0.078   0.562
  506    HD1  TYR  61           HD1      TYR  61  -9.826  -1.202  -0.843
  507    HD2  TYR  61           HD2      TYR  61  -6.775  -1.774   2.126
  508    HE1  TYR  61           HE1      TYR  61 -11.100  -3.111   0.098
  509    HE2  TYR  61           HE2      TYR  61  -8.049  -3.682   3.067
  510    HH   TYR  61           HH       TYR  61 -11.181  -4.242   2.536
  511    H    ILE  62           HN       ILE  62  -6.879   2.159  -1.732
  512    HA   ILE  62           HA       ILE  62  -5.019   3.704  -0.258
  513    HB   ILE  62           HB       ILE  62  -6.304   4.214  -2.962
  514   1HG1  ILE  62          HG1       ILE  62  -3.605   2.974  -2.515
  515   2HG1  ILE  62          HG1       ILE  62  -5.047   1.973  -2.358
  516   1HG2  ILE  62          HG2       ILE  62  -4.921   5.981  -3.195
  517   2HG2  ILE  62          HG2       ILE  62  -3.536   5.033  -2.654
  518   3HG2  ILE  62          HG2       ILE  62  -4.564   5.845  -1.474
  519   1HD1  ILE  62          HD1       ILE  62  -4.934   3.729  -4.749
  520   2HD1  ILE  62          HD1       ILE  62  -5.531   2.077  -4.594
  521   3HD1  ILE  62          HD1       ILE  62  -3.798   2.380  -4.722
  522    H    SER  63           HN       SER  63  -8.339   4.441  -1.249
  523    HA   SER  63           HA       SER  63  -8.183   7.221  -0.318
  524   1HB   SER  63          HB2       SER  63  -9.603   5.967  -2.211
  525   2HB   SER  63          HB1       SER  63 -10.747   5.793  -0.884
  526    HG   SER  63           HG       SER  63 -10.851   7.777  -2.235
  527    H    LEU  64           HN       LEU  64  -9.198   4.108   0.961
  528    HA   LEU  64           HA       LEU  64 -10.664   5.322   3.219
  529   1HB   LEU  64          HB2       LEU  64  -9.990   2.541   2.257
  530   2HB   LEU  64          HB1       LEU  64 -10.758   2.805   3.824
  531    HG   LEU  64           HG       LEU  64 -11.886   4.072   1.336
  532   1HD1  LEU  64          HD1       LEU  64 -13.036   2.163   0.719
  533   2HD1  LEU  64          HD1       LEU  64 -12.989   1.482   2.345
  534   3HD1  LEU  64          HD1       LEU  64 -11.553   1.424   1.324
  535   1HD2  LEU  64          HD2       LEU  64 -12.958   3.254   4.051
  536   2HD2  LEU  64          HD2       LEU  64 -13.989   3.808   2.731
  537   3HD2  LEU  64          HD2       LEU  64 -12.780   4.891   3.420
  538    H    LEU  65           HN       LEU  65  -7.545   3.727   2.632
  539    HA   LEU  65           HA       LEU  65  -6.704   3.288   5.295
  540   1HB   LEU  65          HB2       LEU  65  -5.560   3.564   2.607
  541   2HB   LEU  65          HB1       LEU  65  -4.436   4.036   3.881
  542    HG   LEU  65           HG       LEU  65  -4.262   1.616   3.348
  543   1HD1  LEU  65          HD1       LEU  65  -3.863   1.111   5.529
  544   2HD1  LEU  65          HD1       LEU  65  -5.513   1.497   6.015
  545   3HD1  LEU  65          HD1       LEU  65  -4.330   2.784   5.826
  546   1HD2  LEU  65          HD2       LEU  65  -6.889   1.629   2.909
  547   2HD2  LEU  65          HD2       LEU  65  -6.937   1.153   4.606
  548   3HD2  LEU  65          HD2       LEU  65  -6.063   0.164   3.437
  549    H    LYS  66           HN       LYS  66  -5.495   5.993   3.311
  550    HA   LYS  66           HA       LYS  66  -6.120   7.978   5.370
  551   1HB   LYS  66          HB2       LYS  66  -3.751   6.415   5.524
  552   2HB   LYS  66          HB1       LYS  66  -3.259   8.035   5.028
  553   1HG   LYS  66          HG2       LYS  66  -3.590   8.810   7.112
  554   2HG   LYS  66          HG1       LYS  66  -5.262   8.248   7.083
  555   1HD   LYS  66          HD2       LYS  66  -4.725   6.182   8.040
  556   2HD   LYS  66          HD1       LYS  66  -3.035   6.284   7.544
  557   1HE   LYS  66          HE2       LYS  66  -3.799   8.497   9.305
  558   2HE   LYS  66          HE1       LYS  66  -3.991   6.911  10.076
  559   1HZ   LYS  66          HZ1       LYS  66  -1.747   6.385   9.011
  560   2HZ   LYS  66          HZ2       LYS  66  -1.745   7.399  10.373
  561   3HZ   LYS  66          HZ3       LYS  66  -1.576   8.061   8.818
  562    H    THR  67           HN       THR  67  -5.160  10.160   4.704
  563    HA   THR  67           HA       THR  67  -5.447  10.491   1.801
  564    HB   THR  67           HB       THR  67  -4.774  12.556   3.908
  565    HG1  THR  67           HG1      THR  67  -7.238  11.334   3.249
  566   1HG2  THR  67          HG2       THR  67  -4.725  13.238   1.515
  567   2HG2  THR  67          HG2       THR  67  -5.998  14.055   2.421
  568   3HG2  THR  67          HG2       THR  67  -6.400  12.708   1.356
  569    HA   PRO  68           HA       PRO  68  -1.060  10.446   1.124
  570   1HB   PRO  68          HB2       PRO  68  -1.026  11.547  -1.377
  571   2HB   PRO  68          HB1       PRO  68  -1.529   9.874  -1.066
  572   1HG   PRO  68          HG2       PRO  68  -3.192  12.288  -1.559
  573   2HG   PRO  68          HG1       PRO  68  -3.440  10.618  -2.090
  574   1HD   PRO  68          HD2       PRO  68  -4.769  11.767   0.009
  575   2HD   PRO  68          HD1       PRO  68  -4.479  10.020  -0.148
  576    H    LYS  69           HN       LYS  69   0.646  11.943   1.348
  577    HA   LYS  69           HA       LYS  69   0.034  14.837   1.082
  578   1HB   LYS  69          HB2       LYS  69  -0.213  13.547   3.467
  579   2HB   LYS  69          HB1       LYS  69   1.487  14.012   3.530
  580   1HG   LYS  69          HG2       LYS  69  -0.003  16.233   2.517
  581   2HG   LYS  69          HG1       LYS  69  -0.801  15.657   3.981
  582   1HD   LYS  69          HD2       LYS  69   2.145  15.778   4.150
  583   2HD   LYS  69          HD1       LYS  69   1.350  17.343   3.978
  584   1HE   LYS  69          HE2       LYS  69  -0.263  16.405   5.851
  585   2HE   LYS  69          HE1       LYS  69   1.114  15.343   6.206
  586   1HZ   LYS  69          HZ1       LYS  69   1.511  17.301   7.423
  587   2HZ   LYS  69          HZ2       LYS  69   1.067  18.305   6.126
  588   3HZ   LYS  69          HZ3       LYS  69   2.517  17.420   6.062
  589    H    GLN  70           HN       GLN  70   2.410  15.805   2.177
  590    HA   GLN  70           HA       GLN  70   4.573  14.380   0.672
  591   1HB   GLN  70          HB2       GLN  70   3.557  16.223  -0.661
  592   2HB   GLN  70          HB1       GLN  70   3.948  17.352   0.637
  593   1HG   GLN  70          HG2       GLN  70   6.203  17.318   0.178
  594   2HG   GLN  70          HG1       GLN  70   6.166  15.655  -0.406
  595   1HE2  GLN  70          HE2       GLN  70   4.919  18.912  -1.343
  596   2HE2  GLN  70          HE2       GLN  70   5.109  18.664  -3.011
  597    H    LEU  71           HN       LEU  71   5.493  13.700   2.700
  598    HA   LEU  71           HA       LEU  71   6.226  15.797   4.672
  599   1HB   LEU  71          HB2       LEU  71   5.494  13.070   4.717
  600   2HB   LEU  71          HB1       LEU  71   7.187  13.117   5.210
  601    HG   LEU  71           HG       LEU  71   5.697  13.370   7.161
  602   1HD1  LEU  71          HD1       LEU  71   7.673  15.349   6.285
  603   2HD1  LEU  71          HD1       LEU  71   7.501  14.553   7.850
  604   3HD1  LEU  71          HD1       LEU  71   6.548  15.990   7.483
  605   1HD2  LEU  71          HD2       LEU  71   4.086  15.070   7.332
  606   2HD2  LEU  71          HD2       LEU  71   3.930  14.570   5.648
  607   3HD2  LEU  71          HD2       LEU  71   4.828  16.032   6.054