*HEADER    IMMUNOGLOBULIN                          16-SEP-93   1MAJ    
*COMPND    MURINE ANTIBODY 26-10 VL DOMAIN (NMR, 15 ENERGY MINIMIZED   
*COMPND   2 STRUCTURES)                                                
*SOURCE    MOUSE (MUS MUSCULUS) RECOMBINANT FORM EXPRESSED             
*SOURCE   2 IN (ESCHERICHIA COLI)                                      
*AUTHOR    K.L.CONSTANTINE,M.S.FRIEDRICHS,W.J.METZLER,M.WITTEKIND,     
*AUTHOR   2 P.HENSLEY,L.MUELLER                                        
*REVDAT   1   31-JAN-94 1MAJ    0                                      


!  NOE tnd H-bond table for isolated 2610 VL domain - r-6 effective distances
!
!
! A.) Intraresidue constraints
!
!     vl_aro_int1
!
assign (resid 31 and name HB*) (resid 31 and name HD2) 1.8 0.0 2.68986 ! Peak 120
assign (resid 37 and name HA) (resid 37 and name HD*) 1.8 0.0 2.68986 ! Peak 4
assign (resid 37 and name HA) (resid 37 and name HE*) 1.8 0.0 3.81233 ! Peak 8
assign (resid 37 and name HB*) (resid 37 and name HD*) 1.8 0.0 1.97978 ! Peak 6
assign (resid 37 and name HB*) (resid 37 and name HE*) 1.8 0.0 3.23971 ! Peak 10
assign (resid 54 and name HA) (resid 54 and name HD*) 1.8 0.0 2.68986 ! Peak 66
assign (resid 54 and name HB*) (resid 54 and name HD*) 1.8 0.0 3.23971 ! Peak 68
assign (resid 67 and name HA) (resid 67 and name HD*) 1.8 0.0 3.81233 ! Peak 18
assign (resid 67 and name HB*) (resid 67 and name HD*) 1.8 0.0 3.23971 ! Peak 20
assign (resid 91 and name HA) (resid 91 and name HD*) 1.8 0.0 2.68986 ! Peak 109
assign (resid 91 and name HB*) (resid 91 and name HD*) 1.8 0.0 1.34982 ! Peak 84
assign (resid 98 and name HB*) (resid 98 and name HD2) 1.8 0.0 1.56739 ! Peak 124
assign (resid 103 and name HB*) (resid 103 and name HD*) 1.8 0.0 1.97978 ! Peak 93
!
!
!    vl_n15_int1.bou
!
assign (resid 2 and name HN) (resid 2 and name HG2*) 1.8 0.0 1.80282 ! Peak 402
assign (resid 3 and name HN) (resid 3 and name HB) 1.8 0.0 1.20000 ! Peak 506
assign (resid 3 and name HN) (resid 3 and name HG*) 1.8 0.0 2.24404 ! Peak 619
assign (resid 4 and name HN) (resid 4 and name HB1) 1.8 0.0 2.20000 ! Peak 301
assign (resid 4 and name HN) (resid 4 and name HG*) 1.8 0.0 2.68986 ! Peak 298
assign (resid 5 and name HN) (resid 5 and name HB) 1.8 0.0 1.20000 ! Peak 780
assign (resid 5 and name HN) (resid 5 and name HG2*) 1.8 0.0 3.00376 ! Peak 852
assign (resid 6 and name HN) (resid 6 and name HG*) 1.8 0.0 2.68986 ! Peak 287
assign (resid 7 and name HN) (resid 7 and name HB) 1.8 0.0 2.20000 ! Peak 266
assign (resid 7 and name HN) (resid 7 and name HG2*) 1.8 0.0 3.00376 ! Peak 706
assign (resid 9 and name HN) (resid 9 and name HD*) 1.8 0.0 2.24404 ! Peak 649
assign (resid 11 and name HN) (resid 11 and name HB1) 1.8 0.0 1.20000 ! Peak 303
assign (resid 11 and name HN) (resid 11 and name HB2) 1.8 0.0 1.20000 ! Peak 705
assign (resid 13 and name HN) (resid 13 and name HG1*) 1.8 0.0 1.80282 ! Peak 709
assign (resid 13 and name HN) (resid 13 and name HG2*) 1.8 0.0 1.80282 ! Peak 408
assign (resid 15 and name HN) (resid 15 and name HB1) 1.8 0.0 3.20000 ! Peak 644
assign (resid 17 and name HN) (resid 17 and name HB*) 1.8 0.0 1.56739 ! Peak 537
assign (resid 18 and name HN) (resid 18 and name HB*) 1.8 0.0 1.56739 ! Peak 715
assign (resid 18 and name HN) (resid 18 and name HG*) 1.8 0.0 2.68986 ! Peak 714
assign (resid 21 and name HN) (resid 21 and name HG1*) 1.8 0.0 2.68986 ! Peak 394
assign (resid 27 and name HN) (resid 27 and name HB1) 1.8 0.0 2.20000 ! Peak 573
assign (resid 27 and name HN) (resid 27 and name HB2) 1.8 0.0 2.20000 ! Peak 571
assign (resid 27 and name HN) (resid 27 and name HG*) 1.8 0.0 2.68986 ! Peak 572
assign (resid 29 and name HN) (resid 29 and name HB2) 1.8 0.0 1.20000 ! Peak 307
assign (resid 29 and name HN) (resid 29 and name HG) 1.8 0.0 1.20000 ! Peak 306
assign (resid 30 and name HN) (resid 30 and name HB) 1.8 0.0 0.70000 ! Peak 520
assign (resid 30 and name HN) (resid 30 and name HG2*) 1.8 0.0 1.80282 ! Peak 631
assign (resid 31 and name HN) (resid 31 and name HB1) 1.8 0.0 2.20000 ! Peak 283
assign (resid 31 and name HN) (resid 31 and name HB2) 1.8 0.0 2.20000 ! Peak 284
assign (resid 32 and name HN) (resid 32 and name HB*) 1.8 0.0 1.56739 ! Peak 702
assign (resid 35 and name HN) (resid 35 and name HB1) 1.8 0.0 2.20000 ! Peak 713
assign (resid 35 and name HN) (resid 35 and name HB2) 1.8 0.0 2.20000 ! Peak 552
assign (resid 36 and name HN) (resid 36 and name HB) 1.8 0.0 1.20000 ! Peak 472
assign (resid 37 and name HN) (resid 37 and name HB2) 1.8 0.0 1.20000 ! Peak 511
assign (resid 38 and name HN) (resid 38 and name HB*) 1.8 0.0 1.56739 ! Peak 629
assign (resid 40 and name HB2) (resid 40 and name HE1) 1.8 0.0 3.20000 ! Peak 836
assign (resid 40 and name HN) (resid 40 and name HB1) 1.8 0.0 2.20000 ! Peak 355
assign (resid 40 and name HN) (resid 40 and name HB2) 1.8 0.0 2.20000 ! Peak 356
assign (resid 42 and name HN) (resid 42 and name HB1) 1.8 0.0 1.20000 ! Peak 708
assign (resid 44 and name HN) (resid 44 and name HB1) 1.8 0.0 1.20000 ! Peak 297
assign (resid 45 and name HN) (resid 45 and name HB*) 1.8 0.0 1.20235 ! Peak 633
assign (resid 47 and name HB2) (resid 47 and name HE2*) 1.8 0.0 3.81233 ! Peak 599
assign (resid 47 and name HN) (resid 47 and name HB1) 1.8 0.0 1.20000 ! Peak 825
assign (resid 47 and name HN) (resid 47 and name HB2) 1.8 0.0 1.20000 ! Peak 824
assign (resid 50 and name HN) (resid 50 and name HB*) 1.8 0.0 1.56739 ! Peak 311
assign (resid 51 and name HN) (resid 51 and name HB1) 1.8 0.0 1.20000 ! Peak 722
assign (resid 53 and name HN) (resid 53 and name HB) 1.8 0.0 1.20000 ! Peak 564
assign (resid 53 and name HN) (resid 53 and name HG1*) 1.8 0.0 1.56739 ! Peak 661
assign (resid 57 and name HN) (resid 57 and name HA) 1.8 0.0 2.20000 ! Peak 278
assign (resid 60 and name HN) (resid 60 and name HB1) 1.8 0.0 1.20000 ! Peak 512
assign (resid 60 and name HN) (resid 60 and name HB2) 1.8 0.0 1.20000 ! Peak 513
assign (resid 61 and name HN) (resid 61 and name HB*) 1.8 0.0 1.56739 ! Peak 545
assign (resid 63 and name HN) (resid 63 and name HB) 1.8 0.0 1.20000 ! Peak 518
assign (resid 63 and name HN) (resid 63 and name HG2*) 1.8 0.0 1.80282 ! Peak 628
assign (resid 66 and name HN) (resid 66 and name HA) 1.8 0.0 1.20000 ! Peak 484
assign (resid 66 and name HN) (resid 66 and name HB*) 1.8 0.0 1.56739 ! Peak 591
assign (resid 66 and name HN) (resid 66 and name HD*) 1.8 0.0 2.68986 ! Peak 587
assign (resid 67 and name HN) (resid 67 and name HB2) 1.8 0.0 1.20000 ! Peak 547
assign (resid 74 and name HN) (resid 74 and name HG2*) 1.8 0.0 3.00376 ! Peak 711
assign (resid 75 and name HN) (resid 75 and name HB*) 1.8 0.0 1.56739 ! Peak 534
assign (resid 76 and name HN) (resid 76 and name HB1) 1.8 0.0 3.20000 ! Peak 332
assign (resid 77 and name HN) (resid 77 and name HA) 1.8 0.0 2.20000 ! Peak 260
assign (resid 77 and name HN) (resid 77 and name HG2*) 1.8 0.0 4.20470 ! Peak 411
assign (resid 78 and name HN) (resid 78 and name HB2) 1.8 0.0 2.20000 ! Peak 385
assign (resid 79 and name HN) (resid 79 and name HG*) 1.8 0.0 3.81233 ! Peak 388
assign (resid 80 and name HN) (resid 80 and name HD1*) 1.8 0.0 4.20470 ! Peak 635
assign (resid 80 and name HN) (resid 80 and name HG1*) 1.8 0.0 1.56739 ! Peak 637
assign (resid 80 and name HN) (resid 80 and name HG2*) 1.8 0.0 4.20470 ! Peak 634
assign (resid 81 and name HN) (resid 81 and name HB*) 1.8 0.0 1.56739 ! Peak 333
assign (resid 82 and name HN) (resid 82 and name HG*) 1.8 0.0 3.81233 ! Peak 655
assign (resid 83 and name HN) (resid 83 and name HB) 1.8 0.0 0.70000 ! Peak 523
assign (resid 84 and name HN) (resid 84 and name HA) 1.8 0.0 2.20000 ! Peak 768
assign (resid 84 and name HN) (resid 84 and name HG*) 1.8 0.0 2.68986 ! Peak 293
assign (resid 85 and name HN) (resid 85 and name HB*) 1.8 0.0 1.20235 ! Peak 318
assign (resid 86 and name HN) (resid 86 and name HB*) 1.8 0.0 1.56739 ! Peak 716
assign (resid 86 and name HN) (resid 86 and name HG*) 1.8 0.0 1.56739 ! Peak 583
assign (resid 90 and name HN) (resid 90 and name HB) 1.8 0.0 1.20000 ! Peak 723
assign (resid 90 and name HN) (resid 90 and name HD1*) 1.8 0.0 3.00376 ! Peak 650
assign (resid 90 and name HN) (resid 90 and name HG2*) 1.8 0.0 4.20470 ! Peak 651
assign (resid 91 and name HN) (resid 91 and name HB*) 1.8 0.0 1.56739 ! Peak 304
assign (resid 92 and name HN) (resid 92 and name HB1) 1.8 0.0 2.20000 ! Peak 349
assign (resid 96 and name HN) (resid 96 and name HG2*) 1.8 0.0 3.00376 ! Peak 677
assign (resid 98 and name HN) (resid 98 and name HB1) 1.8 0.0 2.20000 ! Peak 334
assign (resid 98 and name HN) (resid 98 and name HB2) 1.8 0.0 2.20000 ! Peak 335
assign (resid 99 and name HN) (resid 99 and name HB) 1.8 0.0 1.20000 ! Peak 327
assign (resid 102 and name HN) (resid 102 and name HG2*) 1.8 0.0 3.00376 ! Peak 672
assign (resid 107 and name HN) (resid 107 and name HB) 1.8 0.0 2.20000 ! Peak 556
assign (resid 108 and name HN) (resid 108 and name HB*) 1.8 0.0 1.56739 ! Peak 724
assign (resid 111 and name HN) (resid 111 and name HG1*) 1.8 0.0 2.68986 ! Peak 539
assign (resid 112 and name HN) (resid 112 and name HB*) 1.8 0.0 1.56739 ! Peak 507
!
!
!    vl_c13_int1.bou
!
assign (resid 2 and name HA) (resid 2 and name HG1*) 1.8 0.0 1.20235 ! Peak 374
assign (resid 2 and name HA) (resid 2 and name HG2*) 1.8 0.0 1.20235 ! Peak 389
assign (resid 4 and name HA) (resid 4 and name HE*) 1.8 0.0 3.00376 ! Peak 104
assign (resid 5 and name HA) (resid 5 and name HG2*) 1.8 0.0 1.20235 ! Peak 600
assign (resid 6 and name HA) (resid 6 and name HG*) 1.8 0.0 1.56739 ! Peak 1012
assign (resid 9 and name HA) (resid 9 and name HD*) 1.8 0.0 1.57003 ! Peak 659
assign (resid 11 and name HA) (resid 11 and name HG) 1.8 0.0 2.20000 ! Peak 107
assign (resid 11 and name HD1*) (resid 11 and name HA) 1.8 0.0 1.57003 ! Peak 106
assign (resid 13 and name HA) (resid 13 and name HG1*) 1.8 0.0 1.20235 ! Peak 401
assign (resid 13 and name HA) (resid 13 and name HG2*) 1.8 0.0 3.00376 ! Peak 1337
assign (resid 15 and name HA) (resid 15 and name HB1) 1.8 0.0 0.70000 ! Peak 480
assign (resid 15 and name HD2*) (resid 15 and name HA) 1.8 0.0 1.80000 ! Peak 1137
assign (resid 21 and name HA) (resid 21 and name HD1*) 1.8 0.0 3.00376 ! Peak 604
assign (resid 21 and name HA) (resid 21 and name HG1*) 1.8 0.0 1.56739 ! Peak 605
assign (resid 21 and name HA) (resid 21 and name HG2*) 1.8 0.0 1.80282 ! Peak 432
assign (resid 21 and name HB) (resid 21 and name HD1*) 1.8 0.0 1.20235 ! Peak 1060
assign (resid 21 and name HB) (resid 21 and name HG1*) 1.8 0.0 2.68986 ! Peak 242
assign (resid 24 and name HA) (resid 24 and name HG*) 1.8 0.0 1.56739 ! Peak 1244
assign (resid 27 and name HA) (resid 27 and name HG*) 1.8 0.0 1.00616 ! Peak 26
assign (resid 29 and name HA) (resid 29 and name HB1) 1.8 0.0 0.70000 ! Peak 30
assign (resid 29 and name HA) (resid 29 and name HG) 1.8 0.0 1.20000 ! Peak 24
assign (resid 30 and name HA) (resid 30 and name HG1*) 1.8 0.0 1.20235 ! Peak 590
assign (resid 30 and name HA) (resid 30 and name HG2*) 1.8 0.0 2.24235 ! Peak 407
assign (resid 38 and name HA) (resid 38 and name HD*) 1.8 0.0 2.24404 ! Peak 381
assign (resid 42 and name HA) (resid 42 and name HG) 1.8 0.0 2.20000 ! Peak 55
assign (resid 42 and name HB1) (resid 42 and name HG) 1.8 0.0 0.70000 ! Peak 1046
assign (resid 42 and name HD*) (resid 42 and name HA) 1.8 0.0 2.24404 ! Peak 19
assign (resid 44 and name HA) (resid 44 and name HG*) 1.8 0.0 1.56739 ! Peak 1017
assign (resid 50 and name HA) (resid 50 and name HG*) 1.8 0.0 1.56739 ! Peak 1249
assign (resid 51 and name HA) (resid 51 and name HD1*) 1.8 0.0 2.24404 ! Peak 716
assign (resid 52 and name HA) (resid 52 and name HD*) 1.8 0.0 1.57003 ! Peak 388
assign (resid 53 and name HA) (resid 53 and name HD1*) 1.8 0.0 1.80282 ! Peak 687
assign (resid 53 and name HA) (resid 53 and name HG1*) 1.8 0.0 1.56739 ! Peak 689
assign (resid 53 and name HA) (resid 53 and name HG2*) 1.8 0.0 1.80282 ! Peak 442
assign (resid 53 and name HB) (resid 53 and name HD1*) 1.8 0.0 1.80282 ! Peak 293
assign (resid 55 and name HA) (resid 55 and name HD*) 1.8 0.0 2.68986 ! Peak 664
assign (resid 55 and name HA) (resid 55 and name HE*) 1.8 0.0 3.59000 ! Peak 645
assign (resid 55 and name HA) (resid 55 and name HG*) 1.8 0.0 1.56739 ! Peak 661
assign (resid 59 and name HA) (resid 59 and name HD*) 1.8 0.0 2.68986 ! Peak 1096
assign (resid 63 and name HA) (resid 63 and name HG1*) 1.8 0.0 1.20235 ! Peak 427
assign (resid 63 and name HA) (resid 63 and name HG2*) 1.8 0.0 1.20235 ! Peak 354
assign (resid 66 and name HA) (resid 66 and name HD*) 1.8 0.0 3.81233 ! Peak 1382
assign (resid 74 and name HA) (resid 74 and name HB) 1.8 0.0 0.70000 ! Peak 761
assign (resid 74 and name HA) (resid 74 and name HG2*) 1.8 0.0 1.20235 ! Peak 420
assign (resid 77 and name HA) (resid 77 and name HG2*) 1.8 0.0 1.20235 ! Peak 409
assign (resid 78 and name HA) (resid 78 and name HG) 1.8 0.0 0.70000 ! Peak 22
assign (resid 78 and name HD*) (resid 78 and name HA) 1.8 0.0 2.24404 ! Peak 53
assign (resid 79 and name HA) (resid 79 and name HD*) 1.8 0.0 2.68986 ! Peak 517
assign (resid 79 and name HA) (resid 79 and name HG*) 1.8 0.0 2.68986 ! Peak 102
assign (resid 80 and name HA) (resid 80 and name HG1*) 1.8 0.0 1.56739 ! Peak 626
assign (resid 80 and name HA) (resid 80 and name HG2*) 1.8 0.0 1.20235 ! Peak 446
assign (resid 80 and name HB) (resid 80 and name HD1*) 1.8 0.0 1.20235 ! Peak 252
assign (resid 80 and name HB) (resid 80 and name HG1*) 1.8 0.0 1.56739 ! Peak 1069
assign (resid 82 and name HA) (resid 82 and name HG*) 1.8 0.0 2.68986 ! Peak 11
assign (resid 84 and name HA) (resid 84 and name HG*) 1.8 0.0 1.56739 ! Peak 1107
assign (resid 86 and name HA) (resid 86 and name HG*) 1.8 0.0 2.68986 ! Peak 495
assign (resid 88 and name HA) (resid 88 and name HB1) 1.8 0.0 0.70000 ! Peak 473
assign (resid 88 and name HD2*) (resid 88 and name HA) 1.8 0.0 2.69000 ! Peak 711
assign (resid 90 and name HA) (resid 90 and name HD1*) 1.8 0.0 3.00376 ! Peak 483
assign (resid 90 and name HA) (resid 90 and name HG1*) 1.8 0.0 2.68986 ! Peak 1132
assign (resid 90 and name HA) (resid 90 and name HG2*) 1.8 0.0 3.00376 ! Peak 621
assign (resid 96 and name HA) (resid 96 and name HG2*) 1.8 0.0 1.80282 ! Peak 628
assign (resid 97 and name HA) (resid 97 and name HG2*) 1.8 0.0 1.80282 ! Peak 572
assign (resid 107 and name HA) (resid 107 and name HG2*) 1.8 0.0 1.20235 ! Peak 413
assign (resid 108 and name HA) (resid 108 and name HD*) 1.8 0.0 2.68986 ! Peak 706
assign (resid 108 and name HA) (resid 108 and name HE*) 1.8 0.0 3.59000 ! Peak 1431
assign (resid 108 and name HA) (resid 108 and name HG*) 1.8 0.0 1.56739 ! Peak 708
assign (resid 109 and name HA) (resid 109 and name HD*) 1.8 0.0 2.24404 ! Peak 90
assign (resid 109 and name HA) (resid 109 and name HG) 1.8 0.0 1.20000 ! Peak 1023
assign (resid 111 and name HA) (resid 111 and name HD1*) 1.8 0.0 3.00282 ! Peak 484
assign (resid 111 and name HA) (resid 111 and name HG2*) 1.8 0.0 1.80282 ! Peak 449
assign (resid 111 and name HB) (resid 111 and name HD1*) 1.8 0.0 1.80282 ! Peak 286
assign (resid 111 and name HB) (resid 111 and name HG1*) 1.8 0.0 1.00616 ! Peak 1469
assign (resid 112 and name HA) (resid 112 and name HG*) 1.8 0.0 1.56739 ! Peak 352
!
!
!
! B.) Sequential constraints
!
!     vl_aro_seq3
!
assign (resid 54 and name HE*) (resid 55 and name HB*) 1.8 0.0 3.23971 ! Peak 56
assign (resid 54 and name HD*) (resid 55 and name HB*) 1.8 0.0 1.97978 ! Peak 71
assign (resid 66 and name HN) (resid 67 and name HD*) 1.8 0.0 2.68986 ! Peak 81
assign (resid 97 and name HB) (resid 98 and name HD2) 1.8 0.0 2.20000 ! Peak 117
!
!
!     vl_n15_seq3.bou
!
assign (resid 1 and name HA) (resid 2 and name HN) 1.8 0.0 1.20000 ! Peak 234
assign (resid 1 and name HB*) (resid 2 and name HN) 1.8 0.0 2.68986 ! Peak 321
assign (resid 2 and name HA) (resid 3 and name HN) 1.8 0.0 1.20000 ! Peak 505
assign (resid 2 and name HG1*) (resid 3 and name HN) 1.8 0.0 3.00376 ! Peak 620
assign (resid 3 and name HA) (resid 4 and name HN) 1.8 0.0 0.70000 ! Peak 210
assign (resid 3 and name HG*) (resid 4 and name HN) 1.8 0.0 2.24404 ! Peak 386
assign (resid 4 and name HA) (resid 5 and name HN) 1.8 0.0 1.20000 ! Peak 779
assign (resid 4 and name HN) (resid 5 and name HN) 1.8 0.0 2.20000 ! Peak 31
assign (resid 5 and name HA) (resid 6 and name HN) 1.8 0.0 1.20000 ! Peak 203
assign (resid 5 and name HG2*) (resid 6 and name HN) 1.8 0.0 3.00376 ! Peak 380
assign (resid 6 and name HA) (resid 7 and name HN) 1.8 0.0 0.70000 ! Peak 263
assign (resid 6 and name HB*) (resid 7 and name HN) 1.8 0.0 2.68986 ! Peak 359
assign (resid 6 and name HG*) (resid 7 and name HN) 1.8 0.0 2.68986 ! Peak 360
assign (resid 8 and name HA) (resid 9 and name HN) 1.8 0.0 0.70000 ! Peak 245
assign (resid 8 and name HB2) (resid 9 and name HN) 1.8 0.0 1.20000 ! Peak 791
assign (resid 8 and name HG*) (resid 9 and name HN) 1.8 0.0 3.00376 ! Peak 337
assign (resid 10 and name HA) (resid 11 and name HN) 1.8 0.0 0.70000 ! Peak 211
assign (resid 12 and name HA) (resid 13 and name HN) 1.8 0.0 0.70000 ! Peak 250
assign (resid 12 and name HB2) (resid 13 and name HN) 1.8 0.0 2.20000 ! Peak 342
assign (resid 12 and name HG*) (resid 13 and name HN) 1.8 0.0 3.81233 ! Peak 343
assign (resid 13 and name HG2*) (resid 14 and name HN) 1.8 0.0 3.00376 ! Peak 657
assign (resid 14 and name HA) (resid 15 and name HN) 1.8 0.0 1.20000 ! Peak 235
assign (resid 14 and name HB*) (resid 15 and name HN) 1.8 0.0 3.81233 ! Peak 529
assign (resid 15 and name HA) (resid 16 and name HN) 1.8 0.0 0.70000 ! Peak 369
assign (resid 15 and name HB1) (resid 16 and name HN) 1.8 0.0 2.20000 ! Peak 417
assign (resid 15 and name HD2*) (resid 16 and name HN) 1.8 0.0 3.00376 ! Peak 418
assign (resid 15 and name HN) (resid 16 and name HN) 1.8 0.0 2.20000 ! Peak 44
assign (resid 16 and name HA*) (resid 17 and name HN) 1.8 0.0 2.68986 ! Peak 453
assign (resid 16 and name HN) (resid 17 and name HN) 1.8 0.0 1.20000 ! Peak 197
assign (resid 17 and name HB*) (resid 18 and name HN) 1.8 0.0 1.56739 ! Peak 567
assign (resid 18 and name HA) (resid 19 and name HN) 1.8 0.0 1.20000 ! Peak 444
assign (resid 18 and name HB*) (resid 19 and name HN) 1.8 0.0 1.56739 ! Peak 527
assign (resid 18 and name HG*) (resid 19 and name HN) 1.8 0.0 2.68986 ! Peak 526
assign (resid 19 and name HA) (resid 20 and name HN) 1.8 0.0 1.20000 ! Peak 479
assign (resid 19 and name HB*) (resid 20 and name HN) 1.8 0.0 1.80282 ! Peak 665
assign (resid 19 and name HN) (resid 20 and name HN) 1.8 0.0 3.20000 ! Peak 153
assign (resid 20 and name HA) (resid 21 and name HN) 1.8 0.0 0.70000 ! Peak 221
assign (resid 20 and name HB*) (resid 21 and name HN) 1.8 0.0 2.68986 ! Peak 308
assign (resid 21 and name HA) (resid 22 and name HN) 1.8 0.0 0.70000 ! Peak 253
assign (resid 21 and name HB) (resid 22 and name HN) 1.8 0.0 2.20000 ! Peak 340
assign (resid 21 and name HG2*) (resid 22 and name HN) 1.8 0.0 1.80282 ! Peak 410
assign (resid 22 and name HA) (resid 23 and name HN) 1.8 0.0 1.20000 ! Peak 225
assign (resid 23 and name HA) (resid 24 and name HN) 1.8 0.0 0.70000 ! Peak 214
assign (resid 24 and name HA) (resid 25 and name HN) 1.8 0.0 0.70000 ! Peak 256
assign (resid 24 and name HB*) (resid 25 and name HN) 1.8 0.0 2.68986 ! Peak 352
assign (resid 24 and name HG*) (resid 25 and name HN) 1.8 0.0 2.68986 ! Peak 351
assign (resid 25 and name HB*) (resid 26 and name HN) 1.8 0.0 2.68986 ! Peak 580
assign (resid 26 and name HB*) (resid 27 and name HN) 1.8 0.0 2.68986 ! Peak 475
assign (resid 26 and name HN) (resid 27 and name HN) 1.8 0.0 2.20000 ! Peak 116
assign (resid 28 and name HA) (resid 29 and name HN) 1.8 0.0 1.20000 ! Peak 220
assign (resid 29 and name HN) (resid 30 and name HN) 1.8 0.0 1.20000 ! Peak 63
assign (resid 30 and name HA) (resid 31 and name HN) 1.8 0.0 1.20000 ! Peak 790
assign (resid 30 and name HG1*) (resid 31 and name HN) 1.8 0.0 1.80282 ! Peak 800
assign (resid 32 and name HN) (resid 33 and name HN) 1.8 0.0 2.20000 ! Peak 695
assign (resid 33 and name HN) (resid 34 and name HN) 1.8 0.0 3.20000 ! Peak 696
assign (resid 35 and name HB1) (resid 36 and name HN) 1.8 0.0 2.20000 ! Peak 718
assign (resid 35 and name HB2) (resid 36 and name HN) 1.8 0.0 3.20000 ! Peak 570
assign (resid 36 and name HA) (resid 37 and name HN) 1.8 0.0 1.20000 ! Peak 432
assign (resid 36 and name HG2*) (resid 37 and name HN) 1.8 0.0 3.00376 ! Peak 624
assign (resid 37 and name HA) (resid 38 and name HN) 1.8 0.0 1.20000 ! Peak 439
assign (resid 38 and name HD*) (resid 39 and name HN) 1.8 0.0 3.59206 ! Peak 401
assign (resid 39 and name HA) (resid 40 and name HN) 1.8 0.0 1.20000 ! Peak 262
assign (resid 39 and name HB*) (resid 40 and name HN) 1.8 0.0 2.68986 ! Peak 357
assign (resid 40 and name HA) (resid 41 and name HN) 1.8 0.0 1.20000 ! Peak 249
assign (resid 40 and name HB1) (resid 41 and name HN) 1.8 0.0 2.20000 ! Peak 347
assign (resid 40 and name HB2) (resid 41 and name HN) 1.8 0.0 2.20000 ! Peak 346
assign (resid 40 and name HZ3) (resid 41 and name HN) 1.8 0.0 3.20000 ! Peak 192
assign (resid 41 and name HA) (resid 42 and name HN) 1.8 0.0 0.70000 ! Peak 242
assign (resid 42 and name HA) (resid 43 and name HN) 1.8 0.0 2.20000 ! Peak 204
assign (resid 42 and name HD*) (resid 43 and name HN) 1.8 0.0 3.59206 ! Peak 381
assign (resid 43 and name HA) (resid 44 and name HN) 1.8 0.0 1.20000 ! Peak 208
assign (resid 44 and name HB2) (resid 45 and name HN) 1.8 0.0 2.20000 ! Peak 521
assign (resid 46 and name HA*) (resid 47 and name HN) 1.8 0.0 2.68986 ! Peak 822
assign (resid 46 and name HN) (resid 47 and name HN) 1.8 0.0 2.20000 ! Peak 99
assign (resid 47 and name HB2) (resid 48 and name HN) 1.8 0.0 2.20000 ! Peak 575
assign (resid 49 and name HA) (resid 50 and name HN) 1.8 0.0 1.20000 ! Peak 224
assign (resid 50 and name HA) (resid 51 and name HN) 1.8 0.0 1.20000 ! Peak 770
assign (resid 50 and name HB*) (resid 51 and name HN) 1.8 0.0 2.68986 ! Peak 804
assign (resid 50 and name HG*) (resid 51 and name HN) 1.8 0.0 2.68986 ! Peak 805
assign (resid 52 and name HB*) (resid 53 and name HN) 1.8 0.0 1.56739 ! Peak 563
assign (resid 52 and name HD*) (resid 53 and name HN) 1.8 0.0 3.59206 ! Peak 831
assign (resid 52 and name HN) (resid 53 and name HN) 1.8 0.0 1.20000 ! Peak 66
assign (resid 53 and name HB) (resid 54 and name HN) 1.8 0.0 2.20000 ! Peak 323
assign (resid 53 and name HG2*) (resid 54 and name HN) 1.8 0.0 1.80282 ! Peak 404
assign (resid 57 and name HN) (resid 58 and name HD2*) 1.8 0.0 3.81233 ! Peak 146
assign (resid 57 and name HN) (resid 58 and name HN) 1.8 0.0 1.20000 ! Peak 71
assign (resid 59 and name HB*) (resid 60 and name HN) 1.8 0.0 2.68986 ! Peak 516
assign (resid 59 and name HG*) (resid 60 and name HN) 1.8 0.0 3.81233 ! Peak 515
assign (resid 60 and name HA) (resid 61 and name HN) 1.8 0.0 1.20000 ! Peak 461
assign (resid 60 and name HD*) (resid 61 and name HN) 1.8 0.0 2.68986 ! Peak 86
assign (resid 62 and name HA*) (resid 63 and name HN) 1.8 0.0 3.81233 ! Peak 438
assign (resid 62 and name HN) (resid 63 and name HN) 1.8 0.0 2.20000 ! Peak 59
assign (resid 64 and name HA) (resid 65 and name HN) 1.8 0.0 1.20000 ! Peak 465
assign (resid 65 and name HB*) (resid 66 and name HN) 1.8 0.0 3.81233 ! Peak 588
assign (resid 65 and name HN) (resid 66 and name HN) 1.8 0.0 2.20000 ! Peak 95
assign (resid 66 and name HB*) (resid 67 and name HN) 1.8 0.0 3.81233 ! Peak 549
assign (resid 66 and name HN) (resid 67 and name HN) 1.8 0.0 1.20000 ! Peak 87
assign (resid 69 and name HA*) (resid 70 and name HN) 1.8 0.0 1.56739 ! Peak 267
assign (resid 71 and name HA*) (resid 72 and name HN) 1.8 0.0 1.56739 ! Peak 488
assign (resid 73 and name HA*) (resid 74 and name HN) 1.8 0.0 1.56739 ! Peak 471
assign (resid 74 and name HN) (resid 75 and name HB*) 1.8 0.0 3.81233 ! Peak 796
assign (resid 74 and name HN) (resid 75 and name HN) 1.8 0.0 1.20000 ! Peak 77
assign (resid 75 and name HA) (resid 76 and name HN) 1.8 0.0 0.70000 ! Peak 239
assign (resid 75 and name HB*) (resid 76 and name HN) 1.8 0.0 2.68986 ! Peak 328
assign (resid 76 and name HA) (resid 77 and name HN) 1.8 0.0 1.20000 ! Peak 261
assign (resid 77 and name HA) (resid 78 and name HN) 1.8 0.0 0.70000 ! Peak 205
assign (resid 77 and name HG2*) (resid 78 and name HN) 1.8 0.0 1.80282 ! Peak 383
assign (resid 78 and name HA) (resid 79 and name HN) 1.8 0.0 1.20000 ! Peak 217
assign (resid 78 and name HD*) (resid 79 and name HN) 1.8 0.0 3.59206 ! Peak 390
assign (resid 79 and name HA) (resid 80 and name HN) 1.8 0.0 0.70000 ! Peak 229
assign (resid 80 and name HA) (resid 81 and name HN) 1.8 0.0 0.70000 ! Peak 236
assign (resid 80 and name HG2*) (resid 81 and name HN) 1.8 0.0 3.00376 ! Peak 405
assign (resid 80 and name HN) (resid 81 and name HN) 1.8 0.0 3.20000 ! Peak 25
assign (resid 81 and name HN) (resid 82 and name HN) 1.8 0.0 2.20000 ! Peak 175
assign (resid 82 and name HA) (resid 83 and name HN) 1.8 0.0 0.70000 ! Peak 522
assign (resid 82 and name HN) (resid 83 and name HN) 1.8 0.0 2.20000 ! Peak 68
assign (resid 83 and name HA) (resid 84 and name HN) 1.8 0.0 0.70000 ! Peak 291
assign (resid 83 and name HG*) (resid 84 and name HN) 1.8 0.0 2.24404 ! Peak 382
assign (resid 84 and name HB*) (resid 85 and name HN) 1.8 0.0 1.56739 ! Peak 314
assign (resid 85 and name HB*) (resid 86 and name HN) 1.8 0.0 1.80282 ! Peak 584
assign (resid 85 and name HN) (resid 86 and name HN) 1.8 0.0 1.20000 ! Peak 177
assign (resid 86 and name HG*) (resid 87 and name HN) 1.8 0.0 2.68986 ! Peak 543
assign (resid 86 and name HN) (resid 87 and name HN) 1.8 0.0 1.20000 ! Peak 118
assign (resid 87 and name HB*) (resid 88 and name HN) 1.8 0.0 2.68986 ! Peak 562
assign (resid 87 and name HN) (resid 88 and name HN) 1.8 0.0 1.20000 ! Peak 103
assign (resid 88 and name HB1) (resid 89 and name HN) 1.8 0.0 2.20000 ! Peak 674
assign (resid 88 and name HB2) (resid 89 and name HN) 1.8 0.0 2.20000 ! Peak 614
assign (resid 88 and name HD2*) (resid 89 and name HN) 1.8 0.0 4.20470 ! Peak 676
assign (resid 89 and name HA*) (resid 90 and name HN) 1.8 0.0 1.56739 ! Peak 457
assign (resid 90 and name HA) (resid 91 and name HN) 1.8 0.0 1.20000 ! Peak 219
assign (resid 90 and name HG2*) (resid 91 and name HN) 1.8 0.0 3.00376 ! Peak 392
assign (resid 91 and name HA) (resid 92 and name HN) 1.8 0.0 0.70000 ! Peak 255
assign (resid 92 and name HA) (resid 93 and name HN) 1.8 0.0 0.70000 ! Peak 477
assign (resid 92 and name HB1) (resid 93 and name HN) 1.8 0.0 2.20000 ! Peak 576
assign (resid 92 and name HB2) (resid 93 and name HN) 1.8 0.0 2.20000 ! Peak 577
assign (resid 92 and name HD*) (resid 93 and name HN) 1.8 0.0 3.81233 ! Peak 113
assign (resid 93 and name HA) (resid 94 and name HN) 1.8 0.0 1.20000 ! Peak 704
assign (resid 93 and name HB*) (resid 94 and name HN) 1.8 0.0 2.68986 ! Peak 362
assign (resid 95 and name HA) (resid 96 and name HN) 1.8 0.0 1.20000 ! Peak 496
assign (resid 96 and name HN) (resid 97 and name HN) 1.8 0.0 2.20000 ! Peak 74
assign (resid 97 and name HG2*) (resid 98 and name HN) 1.8 0.0 4.20470 ! Peak 407
assign (resid 97 and name HN) (resid 98 and name HN) 1.8 0.0 2.20000 ! Peak 173
assign (resid 98 and name HB1) (resid 99 and name HN) 1.8 0.0 2.20000 ! Peak 330
assign (resid 101 and name HA) (resid 102 and name HN) 1.8 0.0 1.20000 ! Peak 489
assign (resid 101 and name HB*) (resid 102 and name HN) 1.8 0.0 3.81233 ! Peak 608
assign (resid 102 and name HB) (resid 103 and name HN) 1.8 0.0 2.20000 ! Peak 248
assign (resid 105 and name HN) (resid 106 and name HN) 1.8 0.0 3.20000 ! Peak 167
assign (resid 106 and name HA*) (resid 107 and name HN) 1.8 0.0 1.56739 ! Peak 462
assign (resid 106 and name HN) (resid 107 and name HB) 1.8 0.0 3.20000 ! Peak 688
assign (resid 106 and name HN) (resid 107 and name HN) 1.8 0.0 3.20000 ! Peak 166
assign (resid 107 and name HA) (resid 108 and name HN) 1.8 0.0 1.20000 ! Peak 431
assign (resid 107 and name HG2*) (resid 108 and name HN) 1.8 0.0 1.80282 ! Peak 622
assign (resid 108 and name HA) (resid 109 and name HN) 1.8 0.0 1.20000 ! Peak 201
assign (resid 109 and name HA) (resid 110 and name HN) 1.8 0.0 0.70000 ! Peak 775
assign (resid 109 and name HB*) (resid 110 and name HN) 1.8 0.0 3.81233 ! Peak 808
assign (resid 109 and name HG) (resid 110 and name HN) 1.8 0.0 2.20000 ! Peak 809
assign (resid 109 and name HN) (resid 110 and name HN) 1.8 0.0 2.20000 ! Peak 171
assign (resid 110 and name HA) (resid 111 and name HN) 1.8 0.0 1.20000 ! Peak 454
assign (resid 111 and name HA) (resid 112 and name HN) 1.8 0.0 0.70000 ! Peak 429
assign (resid 111 and name HB) (resid 112 and name HN) 1.8 0.0 2.20000 ! Peak 509
assign (resid 112 and name HG*) (resid 113 and name HN) 1.8 0.0 2.68986 ! Peak 621
!
!
!    vl_c13_seq3.bou
!
!
assign (resid 1 and name HA) (resid 2 and name HA) 1.8 0.0 2.20000 ! Peak 59
assign (resid 1 and name HA) (resid 2 and name HG2*) 1.8 0.0 3.00376 ! Peak 1122
assign (resid 7 and name HA) (resid 8 and name HA) 1.8 0.0 0.70000 ! Peak 827
assign (resid 7 and name HB) (resid 8 and name HA) 1.8 0.0 1.20000 ! Peak 759
assign (resid 7 and name HB) (resid 8 and name HB1) 1.8 0.0 3.20000 ! Peak 548
assign (resid 7 and name HG2*) (resid 8 and name HA) 1.8 0.0 3.00376 ! Peak 403
assign (resid 8 and name HA) (resid 9 and name HD*) 1.8 0.0 3.59206 ! Peak 596
assign (resid 11 and name HA) (resid 12 and name HD*) 1.8 0.0 1.00616 ! Peak 111
assign (resid 12 and name HA) (resid 13 and name HG2*) 1.8 0.0 4.20470 ! Peak 615
assign (resid 13 and name HG2*) (resid 14 and name HA) 1.8 0.0 3.00376 ! Peak 667
assign (resid 53 and name HG2*) (resid 54 and name HA) 1.8 0.0 3.00376 ! Peak 1339
assign (resid 56 and name HG*) (resid 57 and name HB*) 1.8 0.0 2.73929 ! Peak 1086
assign (resid 63 and name HA) (resid 64 and name HD*) 1.8 0.0 1.00616 ! Peak 729
assign (resid 63 and name HG1*) (resid 64 and name HD*) 1.8 0.0 3.24404 ! Peak 1356
assign (resid 63 and name HG2*) (resid 64 and name HD*) 1.8 0.0 3.24404 ! Peak 357
assign (resid 74 and name HA) (resid 75 and name HN) 1.8 0.0 1.20000 ! Peak 972
assign (resid 80 and name HA) (resid 81 and name HA) 1.8 0.0 2.20000 ! Peak 1153
assign (resid 81 and name HB*) (resid 82 and name HB*) 1.8 0.0 3.23971 ! Peak 595
assign (resid 85 and name HA) (resid 86 and name HN) 1.8 0.0 3.20000 ! Peak 983
assign (resid 97 and name HA) (resid 98 and name HD2) 1.8 0.0 3.20000 ! Peak 1428
assign (resid 101 and name HA) (resid 102 and name HG2*) 1.8 0.0 3.00376 ! Peak 1408
!
! C.) Medium range constraints
!
!     vl_aro_med3
!
!
assign (resid 35 and name HB2) (resid 37 and name HE*) 1.8 0.0 2.68986 ! Peak 12
assign (resid 38 and name HD*) (resid 40 and name HD1) 1.8 0.0 2.24404 ! Peak 46
assign (resid 38 and name HD*) (resid 40 and name HZ2) 1.8 0.0 3.59206 ! Peak 38
assign (resid 51 and name HG) (resid 54 and name HD*) 1.8 0.0 2.68986 ! Peak 72
assign (resid 64 and name HB2) (resid 67 and name HD*) 1.8 0.0 2.68986 ! Peak 22
assign (resid 64 and name HD*) (resid 67 and name HD*) 1.8 0.0 4.49963 ! Peak 19
assign (resid 64 and name HD*) (resid 67 and name HE*) 1.8 0.0 4.49963 ! Peak 24
assign (resid 74 and name HA) (resid 76 and name HE*) 1.8 0.0 2.68986 ! Peak 97
!
!     vl_n15_med3.bou
!
!
assign (resid 8 and name HG*) (resid 10 and name HN) 1.8 0.0 3.81233 ! Peak 693
assign (resid 38 and name HD*) (resid 40 and name HE1) 1.8 0.0 3.59206 ! Peak 379
assign (resid 44 and name HN) (resid 47 and name HB1) 1.8 0.0 2.20000 ! Peak 296
assign (resid 53 and name HG2*) (resid 56 and name HN) 1.8 0.0 4.20470 ! Peak 814
assign (resid 55 and name HB*) (resid 58 and name HD2*) 1.8 0.0 3.23971 ! Peak 586
assign (resid 60 and name HN) (resid 63 and name HB) 1.8 0.0 3.20000 ! Peak 514
assign (resid 64 and name HB2) (resid 66 and name HN) 1.8 0.0 2.20000 ! Peak 589
assign (resid 72 and name HN) (resid 75 and name HN) 1.8 0.0 2.20000 ! Peak 76
assign (resid 73 and name HA*) (resid 75 and name HN) 1.8 0.0 3.81233 ! Peak 449
assign (resid 80 and name HG2*) (resid 82 and name HN) 1.8 0.0 1.80282 ! Peak 654
assign (resid 84 and name HB*) (resid 86 and name HN) 1.8 0.0 2.68986 ! Peak 585
assign (resid 84 and name HN) (resid 87 and name HB*) 1.8 0.0 2.68986 ! Peak 292
assign (resid 84 and name HN) (resid 87 and name HN) 1.8 0.0 2.20000 ! Peak 181
assign (resid 95 and name HB*) (resid 97 and name HN) 1.8 0.0 2.68986 ! Peak 531
!
!
!     vl_n15_med4.bou
!
assign (resid 31 and name HB1) (resid 33 and name HN) 1.8 0.0 3.20000 ! Peak 839
assign (resid 60 and name HB1) (resid 63 and name HN) 1.8 0.0 3.20000 ! Peak 683
!
!
!     vl_n15_120_med3.bou
!
!
assign (resid 7 and name HB) (resid 9 and name HN) 1.8 0.0 4.20000 ! Peak 387
assign (resid 8 and name HB2) (resid 10 and name HN) 1.8 0.0 2.70000 ! Peak 897
assign (resid 14 and name HN) (resid 17 and name HN) 1.8 0.0 4.20000 ! Peak 1152
assign (resid 25 and name HA) (resid 27 and name HN) 1.8 0.0 4.20000 ! Peak 719
assign (resid 25 and name HB*) (resid 27 and name HN) 1.8 0.0 3.25109 ! Peak 863
assign (resid 44 and name HG*) (resid 47 and name HE2*) 1.8 0.0 5.75956 ! Peak 901
assign (resid 44 and name HN) (resid 47 and name HB2) 1.8 0.0 2.70000 ! Peak 453
assign (resid 51 and name HA) (resid 53 and name HN) 1.8 0.0 4.20000 ! Peak 845
assign (resid 61 and name HA) (resid 63 and name HN) 1.8 0.0 4.20000 ! Peak 669
assign (resid 64 and name HB2) (resid 67 and name HN) 1.8 0.0 4.20000 ! Peak 825
assign (resid 80 and name HA) (resid 82 and name HN) 1.8 0.0 4.20000 ! Peak 703
assign (resid 85 and name HA) (resid 87 and name HN) 1.8 0.0 2.70000 ! Peak 813
assign (resid 85 and name HB*) (resid 87 and name HN) 1.8 0.0 5.40565 ! Peak 818
assign (resid 85 and name HN) (resid 87 and name HN) 1.8 0.0 4.20000 ! Peak 1142
assign (resid 85 and name HA) (resid 88 and name HN) 1.8 0.0 4.20000 ! Peak 844
assign (resid 86 and name HB*) (resid 88 and name HN) 1.8 0.0 4.93479 ! Peak 856
assign (resid 86 and name HN) (resid 88 and name HN) 1.8 0.0 4.20000 ! Peak 147
assign (resid 89 and name HN) (resid 91 and name HE*) 1.8 0.0 4.93479 ! Peak 240
assign (resid 95 and name HA) (resid 97 and name HN) 1.8 0.0 4.20000 ! Peak 682
assign (resid 108 and name HG*) (resid 110 and name HN) 1.8 0.0 4.93479 ! Peak 1185
assign (resid 109 and name HA) (resid 111 and name HN) 1.8 0.0 4.20000 ! Peak 692
!
!     vl_n15_120_med4.bou
!
assign (resid 3 and name HG*) (resid 5 and name HN) 1.8 0.0 6.28808 ! Peak 616
assign (resid 27 and name HN) (resid 29 and name HG) 1.8 0.0 4.20000 ! Peak 864
assign (resid 45 and name HB*) (resid 47 and name HN) 1.8 0.0 5.40565 ! Peak 991
assign (resid 51 and name HD*) (resid 54 and name HN) 1.8 0.0 6.28808 ! Peak 608
assign (resid 60 and name HN) (resid 63 and name HG1*) 1.8 0.0 5.40565 ! Peak 940
assign (resid 111 and name HG2*) (resid 113 and name HN) 1.8 0.0 5.40565 ! Peak 932
!
!     vl_c13_med3.bou
!
!
assign (resid 7 and name HA) (resid 9 and name HD*) 1.8 0.0 2.24404 ! Peak 640
assign (resid 8 and name HG*) (resid 11 and name HD1*) 1.8 0.0 2.24404 ! Peak 122
assign (resid 11 and name HG) (resid 13 and name HG1*) 1.8 0.0 1.80000 ! Peak 1045
assign (resid 44 and name HB1) (resid 47 and name HB2) 1.8 0.0 1.20000 ! Peak 328
assign (resid 51 and name HD1*) (resid 54 and name HA) 1.8 0.0 3.00376 ! Peak 384
assign (resid 51 and name HD1*) (resid 54 and name HB*) 1.8 0.0 2.24404 ! Peak 148
assign (resid 51 and name HD1*) (resid 54 and name HN) 1.8 0.0 4.20470 ! Peak 1402
assign (resid 51 and name HD2*) (resid 54 and name HB*) 1.8 0.0 4.94007 ! Peak 1330
assign (resid 53 and name HG2*) (resid 56 and name HA) 1.8 0.0 3.00376 ! Peak 198
assign (resid 60 and name HB1) (resid 63 and name HG2*) 1.8 0.0 1.80282 ! Peak 271
assign (resid 60 and name HB2) (resid 63 and name HG2*) 1.8 0.0 3.00376 ! Peak 1267
assign (resid 60 and name HD*) (resid 63 and name HG2*) 1.8 0.0 3.59206 ! Peak 1395
assign (resid 77 and name HB) (resid 79 and name HE*) 1.8 0.0 2.68986 ! Peak 1343
assign (resid 77 and name HG2*) (resid 79 and name HE*) 1.8 0.0 2.24404 ! Peak 164
assign (resid 80 and name HB) (resid 83 and name HG*) 1.8 0.0 3.00000 ! Peak 130
assign (resid 80 and name HG2*) (resid 83 and name HG*) 1.8 0.0 2.24721 ! Peak 133
assign (resid 82 and name HD*) (resid 84 and name HG*) 1.8 0.0 3.23971 ! Peak 316
assign (resid 85 and name HA) (resid 88 and name HD1*) 1.8 0.0 3.00282 ! Peak 721
assign (resid 85 and name HA) (resid 88 and name HD2*) 1.8 0.0 3.00000 ! Peak 393
assign (resid 85 and name HA) (resid 88 and name HG) 1.8 0.0 1.20000 ! Peak 725
!
!
!     vl_c13_med4.bou
!
assign (resid 111 and name HG2*) (resid 113 and name HD*) 1.8 0.0
3.59206 ! Peak 1298
!
!     vl_c13_120_med3.bou
!
!
assign (resid 8 and name HB2) (resid 11 and name HD1*) 1.8 0.0 5.40565 ! Peak 1415
assign (resid 8 and name HG*) (resid 11 and name HD2*) 1.8 0.0 6.28808 ! Peak 80
assign (resid 13 and name HG2*) (resid 15 and name HD1*) 1.8 0.0 6.29017 ! Peak 1375
assign (resid 42 and name HD*) (resid 44 and name HE*) 1.8 0.0 4.93479 ! Peak 1512
assign (resid 42 and name HD*) (resid 44 and name HG*) 1.8 0.0 7.27859 ! Peak 485
assign (resid 80 and name HA) (resid 83 and name HG*) 1.8 0.0 6.28808 ! Peak 518
assign (resid 80 and name HD1*) (resid 83 and name HG*) 1.8 0.0 3.05666 ! Peak 184
assign (resid 80 and name HG2*) (resid 83 and name HA) 1.8 0.0 3.60423 ! Peak 626
assign (resid 84 and name HB*) (resid 86 and name HG*) 1.8 0.0 5.75956 ! Peak 417
assign (resid 88 and name HD2*) (resid 91 and name HE*) 1.8 0.0 6.28808 ! Peak 1687
assign (resid 111 and name HG2*) (resid 113 and name HA) 1.8 0.0 3.60423 ! Peak 930
!
!     vl_c13_120_med4.bou
!
assign (resid 8 and name HD*) (resid 11 and name HD1*) 1.8 0.0 6.28808 ! Peak 1709
assign (resid 44 and name HB1) (resid 47 and name HB1) 1.8 0.0 2.70000 ! Peak 1418
!
!
! D.) Long range constraints
!
!     vl_aro_long3
!
!
assign (resid 23 and name HB*) (resid 40 and name HZ2) 1.8 0.0 2.68986 ! Peak 36
assign (resid 29 and name HB2) (resid 76 and name HZ) 1.8 0.0 3.20000 ! Peak 100
assign (resid 29 and name HA) (resid 98 and name HD2) 1.8 0.0 3.20000 ! Peak 118
assign (resid 29 and name HD2*) (resid 98 and name HD2) 1.8 0.0 1.80282 ! Peak 122
assign (resid 31 and name HB1) (resid 37 and name HE*) 1.8 0.0 2.68986 ! Peak 9
assign (resid 37 and name HE*) (resid 55 and name HE*) 1.8 0.0 3.23971 ! Peak 11
assign (resid 38 and name HD*) (resid 76 and name HE*) 1.8 0.0 2.73929 ! Peak 96
assign (resid 40 and name HZ2) (resid 76 and name HB1) 1.8 0.0 2.20000 ! Peak 35
assign (resid 40 and name HD1) (resid 78 and name HD*) 1.8 0.0 3.59206 ! Peak 45
assign (resid 40 and name HH2) (resid 78 and name HD*) 1.8 0.0 3.59206 ! Peak 31
assign (resid 40 and name HZ2) (resid 78 and name HB2) 1.8 0.0 3.20000 ! Peak 39
assign (resid 40 and name HZ3) (resid 91 and name HB*) 1.8 0.0 2.68986 ! Peak 48
assign (resid 54 and name HE*) (resid 60 and name HB2) 1.8 0.0 2.68986 ! Peak 54
assign (resid 67 and name HD*) (resid 80 and name HG1*) 1.8 0.0 3.23971 ! Peak 25
assign (resid 67 and name HE*) (resid 91 and name HE*) 1.8 0.0 1.97978 ! Peak 2
assign (resid 72 and name HA) (resid 76 and name HE*) 1.8 0.0 3.81233 ! Peak 98
!
!     vl_aro_long4.bou
!
assign (resid 37 and name HE*) (resid 55 and name HD*) 1.8 0.0 4.50000 ! Peak 15
assign (resid 37 and name HD*) (resid 97 and name HA) 1.8 0.0 2.68986 ! Peak 5
assign (resid 42 and name HB1) (resid 91 and name HE*) 1.8 0.0 2.68986 ! Peak 61
assign (resid 54 and name HD*) (resid 60 and name HA) 1.8 0.0 3.81233 ! Peak 67
!
!     vl_n15_long3.bou
!
!
assign (resid 2 and name HG1*) (resid 26 and name HN) 1.8 0.0 3.00376 ! Peak 666
assign (resid 2 and name HN) (resid 102 and name HG2*) 1.8 0.0 3.00376 ! Peak 403
assign (resid 5 and name HN) (resid 24 and name HN) 1.8 0.0 2.20000 ! Peak 12
assign (resid 6 and name HA) (resid 24 and name HN) 1.8 0.0 3.20000 ! Peak 213
assign (resid 6 and name HB*) (resid 106 and name HN) 1.8 0.0 3.81233 ! Peak 617
assign (resid 6 and name HG*) (resid 106 and name HN) 1.8 0.0 3.81233 ! Peak 616
assign (resid 7 and name HN) (resid 23 and name HA) 1.8 0.0 2.20000 ! Peak 264
assign (resid 12 and name HA) (resid 110 and name HN) 1.8 0.0 2.20000 ! Peak 773
assign (resid 13 and name HN) (resid 110 and name HN) 1.8 0.0 3.20000 ! Peak 758
assign (resid 13 and name HN) (resid 112 and name HB*) 1.8 0.0 3.81233 ! Peak 341
assign (resid 13 and name HN) (resid 112 and name HG*) 1.8 0.0 3.81233 ! Peak 409
assign (resid 13 and name HN) (resid 112 and name HN) 1.8 0.0 2.20000 ! Peak 170
assign (resid 15 and name HD1*) (resid 85 and name HN) 1.8 0.0 3.00376 ! Peak 398
assign (resid 15 and name HD2*) (resid 85 and name HN) 1.8 0.0 3.00376 ! Peak 399
assign (resid 16 and name HN) (resid 83 and name HB) 1.8 0.0 1.20000 ! Peak 371
assign (resid 16 and name HN) (resid 83 and name HG*) 1.8 0.0 3.59206 ! Peak 419
assign (resid 16 and name HN) (resid 83 and name HN) 1.8 0.0 2.20000 ! Peak 152
assign (resid 17 and name HN) (resid 83 and name HB) 1.8 0.0 2.20000 ! Peak 538
assign (resid 17 and name HN) (resid 83 and name HG*) 1.8 0.0 3.59206 ! Peak 717
assign (resid 17 and name HN) (resid 83 and name HN) 1.8 0.0 2.20000 ! Peak 67
assign (resid 18 and name HB*) (resid 80 and name HN) 1.8 0.0 3.81233 ! Peak 810
assign (resid 19 and name HN) (resid 80 and name HB) 1.8 0.0 1.20000 ! Peak 641
assign (resid 19 and name HN) (resid 81 and name HA) 1.8 0.0 3.20000 ! Peak 445
assign (resid 19 and name HN) (resid 83 and name HG*) 1.8 0.0 3.59206 ! Peak 639
assign (resid 20 and name HA) (resid 80 and name HN) 1.8 0.0 3.20000 ! Peak 228
assign (resid 21 and name HN) (resid 78 and name HN) 1.8 0.0 2.20000 ! Peak 7
assign (resid 22 and name HA) (resid 78 and name HN) 1.8 0.0 3.20000 ! Peak 206
assign (resid 23 and name HN) (resid 76 and name HN) 1.8 0.0 2.20000 ! Peak 19
assign (resid 24 and name HA) (resid 76 and name HN) 1.8 0.0 2.20000 ! Peak 241
assign (resid 25 and name HN) (resid 74 and name HB) 1.8 0.0 3.20000 ! Peak 843
assign (resid 31 and name HB1) (resid 35 and name HN) 1.8 0.0 2.20000 ! Peak 550
assign (resid 31 and name HB2) (resid 35 and name HN) 1.8 0.0 3.20000 ! Peak 551
assign (resid 37 and name HB2) (resid 97 and name HN) 1.8 0.0 3.20000 ! Peak 532
assign (resid 37 and name HN) (resid 97 and name HG2*) 1.8 0.0 4.20470 ! Peak 830
assign (resid 38 and name HD*) (resid 56 and name HN) 1.8 0.0 4.94007 ! Peak 420
assign (resid 38 and name HD*) (resid 94 and name HN) 1.8 0.0 3.59206 ! Peak 414
assign (resid 40 and name HN) (resid 51 and name HD*) 1.8 0.0 3.59206 ! Peak 412
assign (resid 40 and name HN) (resid 53 and name HB) 1.8 0.0 2.20000 ! Peak 358
assign (resid 40 and name HN) (resid 53 and name HN) 1.8 0.0 2.20000 ! Peak 194
assign (resid 40 and name HE1) (resid 76 and name HB1) 1.8 0.0 3.20000 ! Peak 835
assign (resid 40 and name HZ2) (resid 78 and name HN) 1.8 0.0 2.20000 ! Peak 50
assign (resid 40 and name HZ3) (resid 92 and name HN) 1.8 0.0 3.20000 ! Peak 680
assign (resid 41 and name HA) (resid 52 and name HN) 1.8 0.0 2.20000 ! Peak 226
assign (resid 42 and name HN) (resid 52 and name HD*) 1.8 0.0 4.94007 ! Peak 812
assign (resid 42 and name HD*) (resid 90 and name HN) 1.8 0.0 3.59206 ! Peak 652
assign (resid 43 and name HN) (resid 90 and name HN) 1.8 0.0 3.20000 ! Peak 174
assign (resid 53 and name HG2*) (resid 58 and name HN) 1.8 0.0 3.00376 ! Peak 638
assign (resid 53 and name HA) (resid 60 and name HN) 1.8 0.0 2.20000 ! Peak 434
assign (resid 53 and name HG1*) (resid 60 and name HN) 1.8 0.0 3.81233 ! Peak 626
assign (resid 53 and name HD1*) (resid 69 and name HN) 1.8 0.0 3.00376 ! Peak 815
assign (resid 54 and name HN) (resid 58 and name HN) 1.8 0.0 3.20000 ! Peak 172
assign (resid 63 and name HG1*) (resid 67 and name HN) 1.8 0.0 3.00376 ! Peak 653
assign (resid 66 and name HB*) (resid 81 and name HN) 1.8 0.0 2.68986 ! Peak 325
assign (resid 69 and name HA*) (resid 79 and name HN) 1.8 0.0 2.68986 ! Peak 215
assign (resid 88 and name HD2*) (resid 111 and name HN) 1.8 0.0 3.00376 ! Peak 647
assign (resid 89 and name HN) (resid 109 and name HB*) 1.8 0.0 1.56739 ! Peak 613
assign (resid 89 and name HN) (resid 109 and name HN) 1.8 0.0 2.20000 ! Peak 178
assign (resid 90 and name HG2*) (resid 107 and name HN) 1.8 0.0 3.00376 ! Peak 656
assign (resid 91 and name HN) (resid 107 and name HN) 1.8 0.0 2.20000 ! Peak 176
assign (resid 91 and name HN) (resid 108 and name HA) 1.8 0.0 2.20000 ! Peak 218
assign (resid 91 and name HD*) (resid 109 and name HN) 1.8 0.0 3.81233 ! Peak 761
assign (resid 92 and name HA) (resid 106 and name HN) 1.8 0.0 3.20000 ! Peak 499
assign (resid 93 and name HN) (resid 104 and name HN) 1.8 0.0 3.20000 ! Peak 682
assign (resid 95 and name HE2*) (resid 102 and name HN) 1.8 0.0 2.68986 ! Peak 701
assign (resid 95 and name HG*) (resid 102 and name HN) 1.8 0.0 2.68986 ! Peak 611
assign (resid 95 and name HN) (resid 102 and name HN) 1.8 0.0 2.20000 ! Peak 157
!
!
!     vl_n15_long4.bou
!
assign (resid 3 and name HB) (resid 26 and name HN) 1.8 0.0 2.20000 ! Peak 581
assign (resid 8 and name HD*) (resid 22 and name HN) 1.8 0.0 3.81233 ! Peak 339
assign (resid 10 and name HA) (resid 108 and name HN) 1.8 0.0 1.20000 ! Peak 430
assign (resid 16 and name HA*) (resid 83 and name HN) 1.8 0.0 3.81233 ! Peak 684
assign (resid 38 and name HN) (resid 56 and name HN) 1.8 0.0 3.20000 ! Peak 198
assign (resid 41 and name HB*) (resid 92 and name HN) 1.8 0.0 3.81233 ! Peak 353
!
!     vl_n15_120_long3.bou
!
!
assign (resid 2 and name HG1*) (resid 27 and name HN) 1.8 0.0 3.60423 ! Peak 992
assign (resid 2 and name HG2*) (resid 27 and name HE2*) 1.8 0.0 6.28808 ! Peak 1083
assign (resid 2 and name HG2*) (resid 27 and name HN) 1.8 0.0 5.40565 ! Peak 994
assign (resid 3 and name HN) (resid 26 and name HA) 1.8 0.0 4.20000 ! Peak 650
assign (resid 3 and name HN) (resid 26 and name HN) 1.8 0.0 4.20000 ! Peak 164
assign (resid 4 and name HA) (resid 26 and name HN) 1.8 0.0 4.20000 ! Peak 728
assign (resid 4 and name HE*) (resid 94 and name HN) 1.8 0.0 5.40565 ! Peak 1075
assign (resid 5 and name HB) (resid 24 and name HN) 1.8 0.0 4.20000 ! Peak 335
assign (resid 6 and name HB*) (resid 105 and name HN) 1.8 0.0 4.93479 ! Peak 1061
assign (resid 6 and name HG*) (resid 105 and name HN) 1.8 0.0 4.93479 ! Peak 1182
assign (resid 6 and name HN) (resid 105 and name HN) 1.8 0.0 4.20000 ! Peak 1018
assign (resid 7 and name HN) (resid 24 and name HN) 1.8 0.0 4.20000 ! Peak 12
assign (resid 11 and name HN) (resid 108 and name HN) 1.8 0.0 4.20000 ! Peak 1093
assign (resid 11 and name HN) (resid 110 and name HN) 1.8 0.0 4.20000 ! Peak 282
assign (resid 12 and name HA) (resid 111 and name HN) 1.8 0.0 4.20000 ! Peak 693
assign (resid 12 and name HA) (resid 112 and name HN) 1.8 0.0 4.20000 ! Peak 656
assign (resid 12 and name HB1) (resid 113 and name HN) 1.8 0.0 4.20000 ! Peak 766
assign (resid 13 and name HB) (resid 17 and name HN) 1.8 0.0 4.20000 ! Peak 1069
assign (resid 17 and name HB*) (resid 83 and name HN) 1.8 0.0 4.93479 ! Peak 1043
assign (resid 18 and name HN) (resid 83 and name HG*) 1.8 0.0 6.28808 ! Peak 1074
assign (resid 19 and name HN) (resid 79 and name HA) 1.8 0.0 4.20000 ! Peak 679
assign (resid 21 and name HN) (resid 79 and name HA) 1.8 0.0 4.20000 ! Peak 347
assign (resid 23 and name HN) (resid 40 and name HH2) 1.8 0.0 4.20000 ! Peak 287
assign (resid 23 and name HB*) (resid 76 and name HN) 1.8 0.0 4.93479 ! Peak 500
assign (resid 24 and name HA) (resid 75 and name HN) 1.8 0.0 4.20000 ! Peak 1088
assign (resid 24 and name HG*) (resid 76 and name HN) 1.8 0.0 4.93479 ! Peak 495
assign (resid 25 and name HN) (resid 74 and name HA) 1.8 0.0 4.20000 ! Peak 403
assign (resid 25 and name HN) (resid 75 and name HA) 1.8 0.0 4.20000 ! Peak 402
assign (resid 25 and name HN) (resid 75 and name HN) 1.8 0.0 4.20000 ! Peak 1155
assign (resid 25 and name HB*) (resid 95 and name HE2*) 1.8 0.0 5.75956 ! Peak 908
assign (resid 30 and name HG1*) (resid 34 and name HN) 1.8 0.0 5.40565 ! Peak 1015
assign (resid 30 and name HG2*) (resid 73 and name HN) 1.8 0.0 5.40565 ! Peak 647
assign (resid 30 and name HN) (resid 73 and name HA*) 1.8 0.0 4.93479 ! Peak 1166
assign (resid 32 and name HN) (resid 97 and name HG2*) 1.8 0.0 5.40565 ! Peak 1130
assign (resid 37 and name HB1) (resid 96 and name HN) 1.8 0.0 4.20000 ! Peak 921
assign (resid 37 and name HB1) (resid 97 and name HN) 1.8 0.0 4.20000 ! Peak 802
assign (resid 37 and name HD*) (resid 97 and name HN) 1.8 0.0 4.93479 ! Peak 101
assign (resid 37 and name HD*) (resid 98 and name HN) 1.8 0.0 4.93479 ! Peak 1150
assign (resid 40 and name HN) (resid 51 and name HA) 1.8 0.0 4.20000 ! Peak 1175
assign (resid 40 and name HB1) (resid 53 and name HN) 1.8 0.0 4.20000 ! Peak 846
assign (resid 40 and name HE1) (resid 53 and name HG2*) 1.8 0.0 5.40565 ! Peak 567
assign (resid 40 and name HN) (resid 53 and name HG2*) 1.8 0.0 5.40565 ! Peak 628
assign (resid 40 and name HN) (resid 54 and name HA) 1.8 0.0 4.20000 ! Peak 411
assign (resid 41 and name HA) (resid 50 and name HN) 1.8 0.0 4.20000 ! Peak 346
assign (resid 41 and name HD*) (resid 104 and name HN) 1.8 0.0 4.93479 ! Peak 308
assign (resid 42 and name HN) (resid 51 and name HA) 1.8 0.0 4.20000 ! Peak 507
assign (resid 42 and name HD*) (resid 89 and name HN) 1.8 0.0 6.28808 ! Peak 1013
assign (resid 42 and name HN) (resid 91 and name HE*) 1.8 0.0 4.93479 ! Peak 1151
assign (resid 42 and name HA) (resid 92 and name HN) 1.8 0.0 4.20000 ! Peak 405
assign (resid 43 and name HB*) (resid 90 and name HN) 1.8 0.0 4.93479 ! Peak 828
assign (resid 53 and name HG2*) (resid 57 and name HN) 1.8 0.0 5.40565 ! Peak 644
assign (resid 53 and name HD1*) (resid 60 and name HN) 1.8 0.0 5.40565 ! Peak 1067
assign (resid 53 and name HG2*) (resid 69 and name HN) 1.8 0.0 5.40565 ! Peak 643
assign (resid 53 and name HG1*) (resid 79 and name HN) 1.8 0.0 4.93479 ! Peak 585
assign (resid 54 and name HD*) (resid 59 and name HN) 1.8 0.0 4.93479 ! Peak 1149
assign (resid 54 and name HN) (resid 60 and name HN) 1.8 0.0 4.20000 ! Peak 289
assign (resid 56 and name HG*) (resid 71 and name HN) 1.8 0.0 4.26606 ! Peak 1007
assign (resid 59 and name HB*) (resid 63 and name HN) 1.8 0.0 4.93479 ! Peak 784
assign (resid 59 and name HN) (resid 63 and name HB) 1.8 0.0 4.20000 ! Peak 1040
assign (resid 66 and name HN) (resid 82 and name HG*) 1.8 0.0 4.93479 ! Peak 1001
assign (resid 67 and name HN) (resid 80 and name HA) 1.8 0.0 4.20000 ! Peak 702
assign (resid 67 and name HA) (resid 81 and name HN) 1.8 0.0 4.20000 ! Peak 371
assign (resid 67 and name HZ) (resid 87 and name HN) 1.8 0.0 4.20000 ! Peak 1022
assign (resid 68 and name HN) (resid 78 and name HD*) 1.8 0.0 6.28808 ! Peak 636
assign (resid 70 and name HN) (resid 78 and name HA) 1.8 0.0 4.20000 ! Peak 419
assign (resid 71 and name HA*) (resid 77 and name HN) 1.8 0.0 4.93479 ! Peak 409
assign (resid 72 and name HN) (resid 76 and name HA) 1.8 0.0 2.70000 ! Peak 739
assign (resid 90 and name HG2*) (resid 106 and name HN) 1.8 0.0 5.40565 ! Peak 1086
assign (resid 91 and name HB*) (resid 107 and name HN) 1.8 0.0 4.93479 ! Peak 1174
assign (resid 91 and name HN) (resid 107 and name HB) 1.8 0.0 4.20000 ! Peak 468
assign (resid 92 and name HB1) (resid 106 and name HN) 1.8 0.0 4.20000 ! Peak 1060
assign (resid 93 and name HN) (resid 106 and name HN) 1.8 0.0 4.20000 ! Peak 253
assign (resid 94 and name HA) (resid 104 and name HN) 1.8 0.0 4.20000 ! Peak 435
!
!
!     vl_n15_120_long4.bou
!
assign (resid 1 and name HB*) (resid 95 and name HE2*) 1.8 0.0 5.75956 ! Peak 909
assign (resid 5 and name HG2*) (resid 24 and name HN) 1.8 0.0 5.40565 ! Peak 1066
assign (resid 5 and name HN) (resid 25 and name HA) 1.8 0.0 4.20000 ! Peak 379
assign (resid 6 and name HN) (resid 23 and name HA) 1.8 0.0 4.20000 ! Peak 1161
assign (resid 13 and name HN) (resid 112 and name HA) 1.8 0.0 4.20000 ! Peak 1052
assign (resid 19 and name HN) (resid 80 and name HN) 1.8 0.0 1.20000 ! Peak 94
assign (resid 21 and name HN) (resid 77 and name HB) 1.8 0.0 4.20000 ! Peak 474
assign (resid 22 and name HA) (resid 76 and name HN) 1.8 0.0 4.20000 ! Peak 376
assign (resid 25 and name HN) (resid 74 and name HG2*) 1.8 0.0 5.40565 ! Peak 625
assign (resid 40 and name HB2) (resid 53 and name HN) 1.8 0.0 4.20000 ! Peak 849
assign (resid 52 and name HN) (resid 60 and name HB2) 1.8 0.0 4.20000 ! Peak 486
assign (resid 68 and name HN) (resid 79 and name HB*) 1.8 0.0 4.93479 ! Peak 551
!
!
!     vl_c13_long3.bou
!
!
assign (resid 1 and name HB*) (resid 102 and name HG2*) 1.8 0.0 2.24404 ! Peak 135
assign (resid 2 and name HG1*) (resid 25 and name HA) 1.8 0.0 3.00376 ! Peak 379
assign (resid 2 and name HG1*) (resid 25 and name HB*) 1.8 0.0 2.24404 ! Peak 377
assign (resid 2 and name HG2*) (resid 27 and name HB2) 1.8 0.0 3.00376 ! Peak 154
assign (resid 2 and name HB) (resid 29 and name HD2*) 1.8 0.0 3.00376 ! Peak 1276
assign (resid 2 and name HG1*) (resid 98 and name HD2) 1.8 0.0 3.00376 ! Peak 378
assign (resid 2 and name HG2*) (resid 98 and name HB1) 1.8 0.0 3.00376 ! Peak 330
assign (resid 2 and name HG2*) (resid 98 and name HB2) 1.8 0.0 1.80282 ! Peak 156
assign (resid 3 and name HA) (resid 102 and name HG2*) 1.8 0.0 3.00376 ! Peak 1333
assign (resid 4 and name HA) (resid 25 and name HA) 1.8 0.0 1.20000 ! Peak 109
assign (resid 4 and name HE*) (resid 25 and name HA) 1.8 0.0 3.00376 ! Peak 462
assign (resid 4 and name HE*) (resid 25 and name HB*) 1.8 0.0 3.59206 ! Peak 456
assign (resid 4 and name HE*) (resid 38 and name HD*) 1.8 0.0 2.24721 ! Peak 143
assign (resid 4 and name HE*) (resid 94 and name HA) 1.8 0.0 3.00376 ! Peak 460
assign (resid 5 and name HB) (resid 24 and name HB*) 1.8 0.0 2.68986 ! Peak 558
assign (resid 6 and name HA) (resid 23 and name HA) 1.8 0.0 0.70000 ! Peak 907
assign (resid 6 and name HG*) (resid 23 and name HA) 1.8 0.0 2.68986 ! Peak 1141
assign (resid 7 and name HB) (resid 22 and name HB*) 1.8 0.0 1.57003 ! Peak 798
assign (resid 8 and name HD*) (resid 21 and name HA) 1.8 0.0 1.00616 ! Peak 840
assign (resid 8 and name HD*) (resid 107 and name HG2*) 1.8 0.0 1.57003 ! Peak 537
assign (resid 9 and name HA) (resid 107 and name HA) 1.8 0.0 1.20000 ! Peak 837
assign (resid 10 and name HA) (resid 107 and name HG2*) 1.8 0.0 3.00282 ! Peak 412
assign (resid 11 and name HD2*) (resid 19 and name HA) 1.8 0.0 3.00376 ! Peak 1331
assign (resid 11 and name HB2) (resid 109 and name HA) 1.8 0.0 2.20000 ! Peak 441
assign (resid 11 and name HD2*) (resid 109 and name HA) 1.8 0.0 4.20000 ! Peak 76
assign (resid 12 and name HB1) (resid 112 and name HA) 1.8 0.0 2.20000 ! Peak 512
assign (resid 13 and name HB) (resid 17 and name HB*) 1.8 0.0 2.68000 ! Peak 298
assign (resid 13 and name HG2*) (resid 111 and name HA) 1.8 0.0 1.80282 ! Peak 631
assign (resid 15 and name HA) (resid 83 and name HG*) 1.8 0.0 2.68000 ! Peak 405
assign (resid 15 and name HD2*) (resid 84 and name HA) 1.8 0.0 3.00376 ! Peak 397
assign (resid 15 and name HD2*) (resid 85 and name HA) 1.8 0.0 1.20235 ! Peak 719
assign (resid 17 and name HB*) (resid 83 and name HG*) 1.8 0.0 4.25239 ! Peak 1274
assign (resid 18 and name HA) (resid 81 and name HA) 1.8 0.0 2.20000 ! Peak 843
assign (resid 18 and name HG*) (resid 81 and name HA) 1.8 0.0 1.56739 ! Peak 502
assign (resid 18 and name HG*) (resid 81 and name HB*) 1.8 0.0 3.23971 ! Peak 503
assign (resid 18 and name HA) (resid 82 and name HA) 1.8 0.0 2.20000 ! Peak 1156
assign (resid 18 and name HA) (resid 83 and name HG*) 1.8 0.0 3.59206 ! Peak 368
assign (resid 19 and name HB*) (resid 80 and name HB) 1.8 0.0 3.00376 ! Peak 1273
assign (resid 19 and name HB*) (resid 80 and name HD1*) 1.8 0.0 1.80565 ! Peak 1044
assign (resid 19 and name HB*) (resid 80 and name HG2*) 1.8 0.0 3.59000 ! Peak 141
assign (resid 20 and name HA) (resid 77 and name HG2*) 1.8 0.0 1.80282 ! Peak 410
assign (resid 20 and name HB*) (resid 77 and name HG2*) 1.8 0.0 1.57003 ! Peak 1447
assign (resid 20 and name HA) (resid 79 and name HA) 1.8 0.0 0.70000 ! Peak 888
assign (resid 20 and name HB*) (resid 79 and name HA) 1.8 0.0 2.68986 ! Peak 804
assign (resid 20 and name HB*) (resid 79 and name HG*) 1.8 0.0 4.49963 ! Peak 1366
assign (resid 21 and name HG2*) (resid 40 and name HZ3) 1.8 0.0 3.00376 ! Peak 946
assign (resid 21 and name HD1*) (resid 91 and name HB*) 1.8 0.0 2.24404 ! Peak 1449
assign (resid 21 and name HD1*) (resid 107 and name HB) 1.8 0.0 3.00000 ! Peak 474
assign (resid 21 and name HG2*) (resid 107 and name HB) 1.8 0.0 1.20235 ! Peak 431
assign (resid 22 and name HA) (resid 40 and name HH2) 1.8 0.0 2.20000 ! Peak 978
assign (resid 22 and name HA) (resid 77 and name HA) 1.8 0.0 1.20000 ! Peak 834
assign (resid 22 and name HA) (resid 77 and name HG2*) 1.8 0.0 1.80282 ! Peak 408
assign (resid 22 and name HB*) (resid 77 and name HA) 1.8 0.0 3.59000 ! Peak 795
assign (resid 24 and name HA) (resid 75 and name HA) 1.8 0.0 1.20000 ! Peak 31
assign (resid 24 and name HG*) (resid 75 and name HA) 1.8 0.0 2.68986 ! Peak 999
assign (resid 25 and name HB*) (resid 29 and name HD1*) 1.8 0.0 2.24404 ! Peak 518
assign (resid 25 and name HB*) (resid 29 and name HD2*) 1.8 0.0 2.24404 ! Peak 373
assign (resid 25 and name HB*) (resid 74 and name HA) 1.8 0.0 2.68986 ! Peak 846
assign (resid 27 and name HA) (resid 74 and name HG2*) 1.8 0.0 3.00376 ! Peak 1443
assign (resid 28 and name HA) (resid 74 and name HG2*) 1.8 0.0 1.20235 ! Peak 1135
assign (resid 29 and name HD1*) (resid 38 and name HD*) 1.8 0.0 2.24721 ! Peak 346
assign (resid 29 and name HD1*) (resid 76 and name HD*) 1.8 0.0 3.59206 ! Peak 965
assign (resid 29 and name HD1*) (resid 76 and name HZ) 1.8 0.0 1.80282 ! Peak 1036
assign (resid 29 and name HD1*) (resid 95 and name HA) 1.8 0.0 3.00376 ! Peak 525
assign (resid 29 and name HD1*) (resid 95 and name HB*) 1.8 0.0 2.24404 ! Peak 348
assign (resid 29 and name HD1*) (resid 95 and name HG*) 1.8 0.0 3.59206 ! Peak 1414
assign (resid 29 and name HD2*) (resid 95 and name HB*) 1.8 0.0 3.59206 ! Peak 1277
assign (resid 29 and name HD2*) (resid 95 and name HG*) 1.8 0.0 3.59206 ! Peak 1278
assign (resid 29 and name HA) (resid 97 and name HG2*) 1.8 0.0 3.00000 ! Peak 395
assign (resid 29 and name HB2) (resid 97 and name HG2*) 1.8 0.0 3.00000 ! Peak 166
assign (resid 30 and name HG1*) (resid 34 and name HA*) 1.8 0.0 3.59000 ! Peak 418
assign (resid 30 and name HA) (resid 36 and name HA) 1.8 0.0 1.2000 ! Peak 817
assign (resid 30 and name HG2*) (resid 73 and name HA*) 1.8 0.0 2.24404 ! Peak 535
assign (resid 31 and name HA) (resid 97 and name HG2*) 1.8 0.0 3.0000 ! Peak 391
assign (resid 31 and name HB2) (resid 97 and name HG2*) 1.8 0.0 3.00376 ! Peak 335
assign (resid 31 and name HD2) (resid 97 and name HA) 1.8 0.0 2.20000 ! Peak 970
assign (resid 36 and name HB) (resid 56 and name HG*) 1.8 0.0 3.00000 ! Peak 359
assign (resid 37 and name HD*) (resid 97 and name HG2*) 1.8 0.0 3.59206 ! Peak 933
assign (resid 38 and name HB*) (resid 56 and name HA) 1.8 0.0 2.68986 ! Peak 1054
assign (resid 38 and name HD*) (resid 56 and name HA) 1.8 0.0 2.24404 ! Peak 128
assign (resid 38 and name HD*) (resid 76 and name HB1) 1.8 0.0 2.24404 ! Peak 560
assign (resid 38 and name HD*) (resid 76 and name HZ) 1.8 0.0 3.59206 ! Peak 925
assign (resid 38 and name HD*) (resid 93 and name HB*) 1.8 0.0 4.25239 ! Peak 1279
assign (resid 38 and name HA) (resid 95 and name HA) 1.8 0.0 2.20000 ! Peak 732
assign (resid 38 and name HD*) (resid 95 and name HA) 1.8 0.0 3.59206 ! Peak 386
assign (resid 39 and name HA) (resid 51 and name HD1*) 1.8 0.0 3.00376 ! Peak 1357
assign (resid 39 and name HB*) (resid 51 and name HD1*) 1.8 0.0 2.24404 ! Peak 147
assign (resid 39 and name HD2*) (resid 51 and name HD1*) 1.8 0.0 2.24404 ! Peak 1440
assign (resid 39 and name HA) (resid 53 and name HG2*) 1.8 0.0 3.00376 ! Peak 1094
assign (resid 39 and name HA) (resid 54 and name HA) 1.8 0.0 0.70000 ! Peak 735
assign (resid 40 and name HN) (resid 51 and name HD1*) 1.8 0.0 4.20470 ! Peak 1401
assign (resid 40 and name HB1) (resid 53 and name HB) 1.8 0.0 2.20000 ! Peak 1373
assign (resid 40 and name HB2) (resid 53 and name HB) 1.8 0.0 1.20000 ! Peak 1056
assign (resid 40 and name HD1) (resid 53 and name HB) 1.8 0.0 1.20000 ! Peak 1405
assign (resid 40 and name HD1) (resid 53 and name HG2*) 1.8 0.0 1.80282 ! Peak 948
assign (resid 40 and name HH2) (resid 77 and name HA) 1.8 0.0 2.20000 ! Peak 1227
assign (resid 40 and name HZ2) (resid 77 and name HA) 1.8 0.0 2.20000 ! Peak 971
assign (resid 40 and name HB1) (resid 78 and name HD*) 1.8 0.0 3.59206 ! Peak 1037
assign (resid 40 and name HB1) (resid 78 and name HG) 1.8 0.0 3.20000 ! Peak 321
assign (resid 40 and name HZ3) (resid 78 and name HD*) 1.8 0.0 3.59206 ! Peak 17
assign (resid 41 and name HA) (resid 51 and name HA) 1.8 0.0 1.20000 ! Peak 916
assign (resid 42 and name HB1) (resid 52 and name HD*) 1.8 0.0 3.59206 ! Peak 1048
assign (resid 42 and name HD*) (resid 52 and name HD*) 1.8 0.0 3.65143 ! Peak 4
assign (resid 42 and name HD*) (resid 87 and name HA) 1.8 0.0 2.24404 ! Peak 1247
assign (resid 42 and name HD*) (resid 89 and name HA*) 1.8 0.0 2.73929 ! Peak 422
assign (resid 42 and name HA) (resid 91 and name HA) 1.8 0.0 1.20000 ! Peak 63
assign (resid 42 and name HD*) (resid 91 and name HD*) 1.8 0.0 4.25239 ! Peak 942
assign (resid 42 and name HD*) (resid 91 and name HE*) 1.8 0.0 2.73929 ! Peak 941
assign (resid 51 and name HD2*) (resid 60 and name HD*) 1.8 0.0 4.94007 ! Peak 77
assign (resid 52 and name HA) (resid 63 and name HG1*) 1.8 0.0 1.80282 ! Peak 428
assign (resid 52 and name HA) (resid 63 and name HG2*) 1.8 0.0 1.20235 ! Peak 355
assign (resid 52 and name HB*) (resid 63 and name HG1*) 1.8 0.0 4.94007 ! Peak 174
assign (resid 52 and name HD*) (resid 63 and name HG1*) 1.8 0.0 2.24721 ! Peak 172
assign (resid 52 and name HD*) (resid 63 and name HG2*) 1.8 0.0 2.24721 ! Peak 121
assign (resid 52 and name HD*) (resid 67 and name HD*) 1.8 0.0 4.25239 ! Peak 1034
assign (resid 52 and name HD*) (resid 67 and name HE*) 1.8 0.0 4.25239 ! Peak 15
assign (resid 52 and name HD*) (resid 78 and name HD*) 1.8 0.0 3.65143 ! Peak 1
assign (resid 52 and name HD*) (resid 91 and name HD*) 1.8 0.0 3.65143 ! Peak 13
assign (resid 52 and name HD*) (resid 91 and name HE*) 1.8 0.0 1.98274 ! Peak 14
assign (resid 53 and name HD1*) (resid 57 and name HA) 1.8 0.0 3.00000 ! Peak 657
assign (resid 53 and name HG2*) (resid 57 and name HA) 1.8 0.0 1.80282 ! Peak 439
assign (resid 53 and name HA) (resid 59 and name HA) 1.8 0.0 0.70000 ! Peak 887
assign (resid 53 and name HD1*) (resid 59 and name HA) 1.8 0.0 1.80282 ! Peak 488
assign (resid 53 and name HD1*) (resid 59 and name HG*) 1.8 0.0 3.59206 ! Peak 292
assign (resid 53 and name HD1*) (resid 67 and name HB1) 1.8 0.0 3.00376 ! Peak 258
assign (resid 53 and name HD1*) (resid 68 and name HA) 1.8 0.0 1.80282 ! Peak 489
assign (resid 53 and name HD1*) (resid 69 and name HA*) 1.8 0.0 3.59206 ! Peak 1346
assign (resid 53 and name HG2*) (resid 69 and name HA*) 1.8 0.0 2.24404 ! Peak 438
assign (resid 53 and name HG1*) (resid 78 and name HG) 1.8 0.0 2.68986 ! Peak 125
assign (resid 54 and name HE*) (resid 60 and name HA) 1.8 0.0 1.56739 ! Peak 975
assign (resid 56 and name HG*) (resid 70 and name HA) 1.8 0.0 1.57003 ! Peak 669
assign (resid 59 and name HA) (resid 63 and name HG2*) 1.8 0.0 3.00376 ! Peak 358
assign (resid 59 and name HB*) (resid 63 and name HB) 1.8 0.0 1.00616 ! Peak 1316
assign (resid 59 and name HB*) (resid 63 and name HG1*) 1.8 0.0 4.94007 ! Peak 176
assign (resid 59 and name HD*) (resid 63 and name HG1*) 1.8 0.0 2.24404 ! Peak 180
assign (resid 59 and name HD*) (resid 65 and name HA) 1.8 0.0 1.56739 ! Peak 724
assign (resid 63 and name HG1*) (resid 67 and name HB1) 1.8 0.0 3.00376 ! Peak 178
assign (resid 63 and name HG1*) (resid 67 and name HB2) 1.8 0.0 1.80282 ! Peak 179
assign (resid 63 and name HG1*) (resid 67 and name HD*) 1.8 0.0 3.59206 ! Peak 943
assign (resid 66 and name HD*) (resid 80 and name HG2*) 1.8 0.0 3.59206 ! Peak 202
assign (resid 66 and name HA) (resid 81 and name HB*) 1.8 0.0 1.56739 ! Peak 895
assign (resid 67 and name HA) (resid 78 and name HG) 1.8 0.0 3.20000 ! Peak 654
assign (resid 67 and name HB1) (resid 78 and name HG) 1.8 0.0 3.20000 ! Peak 131
assign (resid 67 and name HD*) (resid 78 and name HD*) 1.8 0.0 4.25239 ! Peak 16
assign (resid 67 and name HD*) (resid 78 and name HG) 1.8 0.0 2.68986 ! Peak 921
assign (resid 67 and name HA) (resid 80 and name HA) 1.8 0.0 1.20000 ! Peak 857
assign (resid 67 and name HD*) (resid 80 and name HD1*) 1.8 0.0 3.59206 ! Peak 960
assign (resid 67 and name HD*) (resid 80 and name HG2*) 1.8 0.0 3.59206 ! Peak 949
assign (resid 67 and name HE*) (resid 80 and name HG2*) 1.8 0.0 3.59206 ! Peak 950
assign (resid 67 and name HZ) (resid 80 and name HD1*) 1.8 0.0 3.00376 ! Peak 1172
assign (resid 67 and name HZ) (resid 80 and name HG2*) 1.8 0.0 3.00376 ! Peak 951
assign (resid 69 and name HA*) (resid 78 and name HA) 1.8 0.0 1.56739 ! Peak 60
assign (resid 69 and name HA*) (resid 78 and name HG) 1.8 0.0 2.68986 ! Peak 365
assign (resid 71 and name HA*) (resid 76 and name HA) 1.8 0.0 1.00616 ! Peak 750
assign (resid 78 and name HD*) (resid 91 and name HD*) 1.8 0.0 2.73929 ! Peak 1158
assign (resid 78 and name HD*) (resid 91 and name HE*) 1.8 0.0 2.73929 ! Peak 1157
assign (resid 78 and name HG) (resid 91 and name HE*) 1.8 0.0 3.59000 ! Peak 919
assign (resid 83 and name HG*) (resid 87 and name HB*) 1.8 0.0 1.98274 ! Peak 151
assign (resid 85 and name HA) (resid 111 and name HD1*) 1.8 0.0 3.00000 ! Peak 720
assign (resid 88 and name HA) (resid 109 and name HB*) 1.8 0.0 1.56739 ! Peak 712
assign (resid 88 and name HA) (resid 109 and name HD*) 1.8 0.0 2.24404 ! Peak 50
assign (resid 88 and name HD2*) (resid 109 and name HB*) 1.8 0.0 3.59206 ! Peak 153
assign (resid 88 and name HD1*) (resid 110 and name HA) 1.8 0.0 3.00376 ! Peak 21
assign (resid 88 and name HD2*) (resid 110 and name HA) 1.8 0.0 1.80282 ! Peak 20
assign (resid 88 and name HD2*) (resid 111 and name HA) 1.8 0.0 3.00376 ! Peak 1134
assign (resid 88 and name HD2*) (resid 111 and name HG2*) 1.8 0.0 3.59000 ! Peak 169
assign (resid 90 and name HA) (resid 108 and name HA) 1.8 0.0 1.20000 ! Peak 854
assign (resid 90 and name HD1*) (resid 108 and name HE*) 1.8 0.0 4.94007 ! Peak 285
assign (resid 91 and name HB*) (resid 107 and name HB) 1.8 0.0 1.56739 ! Peak 541
assign (resid 91 and name HD*) (resid 109 and name HB*) 1.8 0.0 3.23971 ! Peak 1166
assign (resid 91 and name HD*) (resid 109 and name HD*) 1.8 0.0 4.25239 ! Peak 92
assign (resid 91 and name HE*) (resid 109 and name HB*) 1.8 0.0 3.23971 ! Peak 952
assign (resid 91 and name HE*) (resid 109 and name HD*) 1.8 0.0 2.73929 ! Peak 1161
assign (resid 92 and name HA) (resid 106 and name HA*) 1.8 0.0 2.68986 ! Peak 897
assign (resid 94 and name HA) (resid 103 and name HA) 1.8 0.0 1.20000 ! Peak 901
assign (resid 94 and name HB*) (resid 103 and name HA) 1.8 0.0 1.56739 ! Peak 679
!
!     vl_c13_long4.bou
!
assign (resid 10 and name HA) (resid 108 and name HB*) 1.8 0.0 3.8000 ! Peak 682
assign (resid 10 and name HB*) (resid 108 and name HB*) 1.8 0.0 3.23971 ! Peak 1438
assign (resid 11 and name HD1*) (resid 21 and name HA) 1.8 0.0 3.00376 ! Peak 606
assign (resid 11 and name HB1) (resid 109 and name HA) 1.8 0.0 2.20000 ! Peak 1019
assign (resid 11 and name HB1) (resid 109 and name HD*) 1.8 0.0 3.59206 ! Peak 1259
assign (resid 12 and name HB2) (resid 112 and name HG*) 1.8 0.0 2.68000 ! Peak 1325
assign (resid 13 and name HB) (resid 83 and name HG*) 1.8 0.0 3.59206 ! Peak 1290
assign (resid 13 and name HG2*) (resid 109 and name HG) 1.8 0.0 3.00000 ! Peak 1049
assign (resid 15 and name HD2*) (resid 85 and name HB*) 1.8 0.0 3.97000 ! Peak 1281
assign (resid 15 and name HD2*) (resid 88 and name HG) 1.8 0.0 3.00000 ! Peak 1283
assign (resid 16 and name HA*) (resid 82 and name HB*) 1.8 0.0 3.23971 ! Peak 1052
assign (resid 21 and name HB) (resid 78 and name HD*) 1.8 0.0 4.94007 ! Peak 1411
assign (resid 21 and name HD1*) (resid 91 and name HD*) 1.8 0.0 2.24404 ! Peak 959
assign (resid 28 and name HA) (resid 74 and name HA) 1.8 0.0 2.20000 ! Peak 847
assign (resid 29 and name HA) (resid 97 and name HB) 1.8 0.0 2.20000 ! Peak 1252
assign (resid 31 and name HD2) (resid 97 and name HG2*) 1.8 0.0 1.80282 ! Peak 932
assign (resid 37 and name HB1) (resid 97 and name HA) 1.8 0.0 3.20000 ! Peak 1128
assign (resid 38 and name HD*) (resid 76 and name HB2) 1.8 0.0 3.59206 ! Peak 127
assign (resid 42 and name HD*) (resid 87 and name HB*) 1.8 0.0 4.25000 ! Peak 39
assign (resid 53 and name HD1*) (resid 67 and name HB2) 1.8 0.0 3.00376 ! Peak 295
assign (resid 66 and name HB*) (resid 80 and name HG2*) 1.8 0.0 3.59206 ! Peak 201
assign (resid 67 and name HA) (resid 80 and name HG2*) 1.8 0.0 3.00376 ! Peak 447
assign (resid 67 and name HE*) (resid 80 and name HD1*) 1.8 0.0 2.24404 ! Peak 1171
assign (resid 68 and name HN) (resid 78 and name HG) 1.8 0.0 2.20000 ! Peak 1398
assign (resid 88 and name HB1) (resid 110 and name HA) 1.8 0.0 2.20000 ! Peak 29
!
!     vl_c13_120_long3.bou
!
!
assign (resid 1 and name HA) (resid 102 and name HG2*) 1.8 0.0 5.40565 ! Peak 60
assign (resid 4 and name HE*) (resid 23 and name HB*) 1.8 0.0 4.26606 ! Peak 1388
assign (resid 4 and name HA) (resid 25 and name HB*) 1.8 0.0 4.93479 ! Peak 141
assign (resid 4 and name HE*) (resid 29 and name HD1*) 1.8 0.0 2.52678 ! Peak 479
assign (resid 4 and name HE*) (resid 76 and name HB2) 1.8 0.0 5.40565 ! Peak 304
assign (resid 4 and name HE*) (resid 76 and name HZ) 1.8 0.0 5.40565 ! Peak 1582
assign (resid 4 and name HE*) (resid 95 and name HA) 1.8 0.0 5.40565 ! Peak 646
assign (resid 4 and name HE*) (resid 95 and name HB*) 1.8 0.0 6.28808 ! Peak 303
assign (resid 5 and name HB) (resid 24 and name HD*) 1.8 0.0 4.93479 ! Peak 1554
assign (resid 6 and name HA) (resid 23 and name HB*) 1.8 0.0 4.93479 ! Peak 1334
assign (resid 8 and name HG*) (resid 107 and name HG2*) 1.8 0.0 4.26606 ! Peak 223
assign (resid 10 and name HB*) (resid 108 and name HD*) 1.8 0.0 5.75956 ! Peak 720
assign (resid 11 and name HG) (resid 19 and name HB*) 1.8 0.0 5.40565 ! Peak 186
assign (resid 11 and name HD2*) (resid 21 and name HA) 1.8 0.0 5.40565 ! Peak 1759
assign (resid 11 and name HD2*) (resid 109 and name HG) 1.8 0.0 3.60423 ! Peak 1746
assign (resid 12 and name HA) (resid 112 and name HA) 1.8 0.0 4.20000 ! Peak 1143
assign (resid 13 and name HG1*) (resid 17 and name HB*) 1.8 0.0 4.26606 ! Peak 225
assign (resid 13 and name HG2*) (resid 17 and name HB*) 1.8 0.0 4.26606 ! Peak 260
assign (resid 13 and name HG1*) (resid 109 and name HA) 1.8 0.0 5.40565 ! Peak 564
assign (resid 13 and name HG2*) (resid 109 and name HA) 1.8 0.0 5.40565 ! Peak 611
assign (resid 14 and name HA) (resid 111 and name HG1*) 1.8 0.0 4.93479 ! Peak 935
assign (resid 15 and name HG) (resid 111 and name HD1*) 1.8 0.0 3.60423 ! Peak 13
assign (resid 16 and name HA*) (resid 82 and name HA) 1.8 0.0 4.93479 ! Peak 1013
assign (resid 18 and name HB*) (resid 81 and name HA) 1.8 0.0 4.93479 ! Peak 1724
assign (resid 19 and name HA) (resid 109 and name HD*) 1.8 0.0 4.26606 ! Peak 746
assign (resid 20 and name HA) (resid 79 and name HD*) 1.8 0.0 4.93479 ! Peak 968
assign (resid 20 and name HA) (resid 79 and name HG*) 1.8 0.0 4.93479 ! Peak 130
assign (resid 21 and name HD1*) (resid 109 and name HG) 1.8 0.0 5.40565 ! Peak 1306
assign (resid 22 and name HA) (resid 77 and name HB) 1.8 0.0 4.20000 ! Peak 1033
assign (resid 22 and name HB*) (resid 77 and name HG2*) 1.8 0.0 6.28808 ! Peak 1520
assign (resid 24 and name HA) (resid 75 and name HB*) 1.8 0.0 4.93479 ! Peak 1716
assign (resid 24 and name HD*) (resid 75 and name HA) 1.8 0.0 4.93479 ! Peak 1459
assign (resid 25 and name HA) (resid 29 and name HD2*) 1.8 0.0 5.40565 ! Peak 1544
assign (resid 29 and name HD1*) (resid 38 and name HA) 1.8 0.0 5.40565 ! Peak 1490
assign (resid 30 and name HG1*) (resid 36 and name HA) 1.8 0.0 3.60282 ! Peak 588
assign (resid 30 and name HA) (resid 97 and name HG2*) 1.8 0.0 5.40565 ! Peak 1711
assign (resid 31 and name HB1) (resid 97 and name HG2*) 1.8 0.0 5.40565 ! Peak 893
assign (resid 37 and name HB2) (resid 97 and name HA) 1.8 0.0 4.20000 ! Peak 1513
assign (resid 38 and name HD*) (resid 56 and name HB) 1.8 0.0 6.28808 ! Peak 1726
assign (resid 38 and name HD*) (resid 95 and name HB*) 1.8 0.0 7.27859 ! Peak 200
assign (resid 38 and name HD*) (resid 95 and name HG*) 1.8 0.0 5.00894 ! Peak 199
assign (resid 40 and name HB1) (resid 52 and name HD*) 1.8 0.0 6.28808 ! Peak 1650
assign (resid 40 and name HB1) (resid 53 and name HD1*) 1.8 0.0 5.40565 ! Peak 405
assign (resid 40 and name HD1) (resid 53 and name HD1*) 1.8 0.0 5.40565 ! Peak 1262
assign (resid 40 and name HD1) (resid 78 and name HG) 1.8 0.0 4.20000 ! Peak 1214
assign (resid 40 and name HZ2) (resid 78 and name HD*) 1.8 0.0 6.28808 ! Peak 1686
assign (resid 42 and name HD*) (resid 67 and name HE*) 1.8 0.0 7.27859 ! Peak 1688
assign (resid 42 and name HD*) (resid 91 and name HA) 1.8 0.0 6.28808 ! Peak 594
assign (resid 44 and name HA) (resid 89 and name HA*) 1.8 0.0 4.93479 ! Peak 1354
assign (resid 44 and name HE*) (resid 89 and name HA*) 1.8 0.0 5.75956 ! Peak 775
assign (resid 51 and name HD1*) (resid 60 and name HA) 1.8 0.0 5.40565 ! Peak 554
assign (resid 51 and name HD1*) (resid 60 and name HB2) 1.8 0.0 3.60423 ! Peak 205
assign (resid 53 and name HG2*) (resid 57 and name HB*) 1.8 0.0 6.28808 ! Peak 1730
assign (resid 53 and name HD1*) (resid 59 and name HB*) 1.8 0.0 6.28808 ! Peak 401
assign (resid 53 and name HD1*) (resid 67 and name HA) 1.8 0.0 5.40565 ! Peak 684
assign (resid 53 and name HD1*) (resid 67 and name HD*) 1.8 0.0 6.28808 ! Peak 1263
assign (resid 53 and name HD1*) (resid 68 and name HB*) 1.8 0.0 6.28808 ! Peak 1519
assign (resid 53 and name HB) (resid 78 and name HG) 1.8 0.0 4.20000 ! Peak 175
assign (resid 53 and name HD1*) (resid 78 and name HA) 1.8 0.0 5.40565 ! Peak 681
assign (resid 53 and name HG1*) (resid 78 and name HD*) 1.8 0.0 7.27859 ! Peak 5
assign (resid 57 and name HA) (resid 69 and name HA*) 1.8 0.0 3.25109 ! Peak 1164
assign (resid 63 and name HG1*) (resid 67 and name HE*) 1.8 0.0 6.28808 ! Peak 1245
assign (resid 66 and name HA) (resid 80 and name HG2*) 1.8 0.0 5.40565 ! Peak 976
assign (resid 67 and name HE*) (resid 109 and name HD*) 1.8 0.0 7.27859 ! Peak 88
assign (resid 68 and name HB*) (resid 79 and name HD*) 1.8 0.0 5.75956 ! Peak 1489
assign (resid 83 and name HA) (resid 87 and name HB*) 1.8 0.0 4.93479 ! Peak 817
assign (resid 83 and name HG*) (resid 88 and name HA) 1.8 0.0 6.28808 ! Peak 566
assign (resid 88 and name HD2*) (resid 109 and name HG) 1.8 0.0 3.60423 ! Peak 1303
assign (resid 88 and name HD2*) (resid 111 and name HB) 1.8 0.0 5.40565 ! Peak 407
assign (resid 88 and name HD2*) (resid 111 and name HG1*) 1.8 0.0
4.26606 ! Peak 1308
assign (resid 90 and name HG2*) (resid 106 and name HA*) 1.8 0.0 6.28808 ! Peak 1729
assign (resid 90 and name HG2*) (resid 108 and name HA) 1.8 0.0 5.40565 ! Peak 992
assign (resid 91 and name HD*) (resid 109 and name HG) 1.8 0.0 4.93479 ! Peak 1690
assign (resid 91 and name HE*) (resid 109 and name HG) 1.8 0.0 4.93479 ! Peak 1689
!
!     vl_c13_120_long4.bou
!
assign (resid 3 and name HG*) (resid 26 and name HA) 1.8 0.0 4.93479 ! Peak 577
assign (resid 10 and name HA) (resid 107 and name HA) 1.8 0.0 4.20000 ! Peak 1130
assign (resid 10 and name HA) (resid 109 and name HD*) 1.8 0.0 6.28808 ! Peak 958
assign (resid 13 and name HG2*) (resid 83 and name HB) 1.8 0.0 5.40565 ! Peak 1381
assign (resid 14 and name HA) (resid 112 and name HB*) 1.8 0.0 4.93479 ! Peak 936
assign (resid 14 and name HA) (resid 112 and name HD*) 1.8 0.0 4.93479 ! Peak 937
assign (resid 15 and name HD1*) (resid 85 and name HB*) 1.8 0.0 2.52678 ! Peak 296
assign (resid 16 and name HA*) (resid 82 and name HG*) 1.8 0.0 5.75956 ! Peak 146
assign (resid 22 and name HA) (resid 40 and name HZ2) 1.8 0.0 4.20000 ! Peak 1284
assign (resid 24 and name HB*) (resid 74 and name HA) 1.8 0.0 4.93479 ! Peak 868
assign (resid 29 and name HB1) (resid 95 and name HG*) 1.8 0.0 4.93479 ! Peak 461
assign (resid 29 and name HD2*) (resid 95 and name HA) 1.8 0.0 5.40565 ! Peak 736
assign (resid 30 and name HB) (resid 36 and name HA) 1.8 0.0 4.20000 ! Peak 848
assign (resid 31 and name HA) (resid 37 and name HE*) 1.8 0.0 4.93479 ! Peak 1275
assign (resid 40 and name HB2) (resid 53 and name HD1*) 1.8 0.0 5.40565 ! Peak 403
assign (resid 41 and name HA) (resid 52 and name HD*) 1.8 0.0 6.28808 ! Peak 1433
assign (resid 42 and name HB2) (resid 67 and name HE*) 1.8 0.0 4.93479 ! Peak 1248
assign (resid 44 and name HG*) (resid 89 and name HA*) 1.8 0.0 5.75956 ! Peak 774
assign (resid 51 and name HG) (resid 60 and name HB2) 1.8 0.0 4.20000 ! Peak 374
assign (resid 52 and name HB*) (resid 78 and name HG) 1.8 0.0 4.93479 ! Peak 178
assign (resid 56 and name HG*) (resid 76 and name HD*) 1.8 0.0 2.73929 ! Peak 1238
assign (resid 57 and name HB*) (resid 70 and name HA) 1.8 0.0 4.93479 ! Peak 1185
assign (resid 66 and name HB*) (resid 82 and name HN) 1.8 0.0 4.93479 ! Peak 1593
assign (resid 67 and name HB2) (resid 78 and name HG) 1.8 0.0 4.20000 ! Peak 1441
assign (resid 67 and name HA) (resid 80 and name HG1*) 1.8 0.0 4.93479 ! Peak 912
assign (resid 91 and name HD*) (resid 107 and name HB) 1.8 0.0 4.93479 ! Peak 1266
assign (resid 96 and name HA) (resid 101 and name HA) 1.8 0.0 4.20000 ! Peak 1113
!
!     vl_l78hb_long1.bou
!
assign (resid 21 and name HN) (resid 78 and name HB1) 1.8 0.0 2.70000 ! Peak 9
assign (resid 21 and name HB) (resid 78 and name HB2) 1.8 0.0 4.20000 ! Peak 12
assign (resid 21 and name HD1*) (resid 78 and name HB2) 1.8 0.0 3.60282 ! Peak 15
assign (resid 21 and name HG2*) (resid 78 and name HB2) 1.8 0.0 5.40565 ! Peak 20
!
!
! E.) H-bond constraints
!
 assign (resid  5 and name HN  ) (resid  24 and name O   ) 1.7 0.0 0.8
 assign (resid  5 and name N   ) (resid  24 and name O   ) 2.7 0.0 0.8
 assign (resid  24 and name HN  ) (resid  5 and name O   ) 1.7 0.0 0.8
 assign (resid  24 and name N   ) (resid  5 and name O   ) 2.7 0.0 0.8
 assign (resid  23 and name HN  ) (resid  76 and name O   ) 1.7 0.0 0.8
 assign (resid  23 and name N   ) (resid  76 and name O   ) 2.7 0.0 0.8
 assign (resid  76 and name HN  ) (resid  23 and name O   ) 1.7 0.0 0.8
 assign (resid  76 and name N   ) (resid  23 and name O   ) 2.7 0.0 0.8
 assign (resid  21 and name HN  ) (resid  78 and name O   ) 1.7 0.0 0.8
 assign (resid  21 and name N   ) (resid  78 and name O   ) 2.7 0.0 0.8
 assign (resid  78 and name HN  ) (resid  21 and name O   ) 1.7 0.0 0.8
 assign (resid  78 and name N   ) (resid  21 and name O   ) 2.7 0.0 0.8
 assign (resid  19 and name HN  ) (resid  80 and name O   ) 1.7 0.0 0.8
 assign (resid  19 and name N   ) (resid  80 and name O   ) 2.7 0.0 0.8
 assign (resid  80 and name HN  ) (resid  19 and name O   ) 1.7 0.0 0.8
 assign (resid  80 and name N   ) (resid  19 and name O   ) 2.7 0.0 0.8
 assign (resid  77 and name HN  ) (resid  70 and name O   ) 1.7 0.0 0.8
 assign (resid  77 and name N   ) (resid  70 and name O   ) 2.7 0.0 0.8
 assign (resid  70 and name HN  ) (resid  77 and name O   ) 1.7 0.0 0.8
 assign (resid  70 and name N   ) (resid  77 and name O   ) 2.7 0.0 0.8
 assign (resid  79 and name HN  ) (resid  68 and name O   ) 1.7 0.0 0.8
 assign (resid  79 and name N   ) (resid  68 and name O   ) 2.7 0.0 0.8
 assign (resid  68 and name HN  ) (resid  79 and name O   ) 1.7 0.0 0.8
 assign (resid  68 and name N   ) (resid  79 and name O   ) 2.7 0.0 0.8
 assign (resid  107 and name HN  ) (resid  91 and name O   ) 1.7 0.0 0.8
 assign (resid  107 and name N   ) (resid  91 and name O   ) 2.7 0.0 0.8
 assign (resid  91 and name HN  ) (resid  107 and name O   ) 1.7 0.0 0.8
 assign (resid  91 and name N   ) (resid  107 and name O   ) 2.7 0.0 0.8
 assign (resid  109 and name HN  ) (resid  89 and name O   ) 1.7 0.0 0.8
 assign (resid  109 and name N   ) (resid  89 and name O   ) 2.7 0.0 0.8
 assign (resid  89 and name HN  ) (resid  109 and name O   ) 1.7 0.0 0.8
 assign (resid  89 and name N   ) (resid  109 and name O   ) 2.7 0.0 0.8
 assign (resid  94 and name HN  ) (resid  39 and name O   ) 1.7 0.0 0.8
 assign (resid  94 and name N   ) (resid  39 and name O   ) 2.7 0.0 0.8
 assign (resid  39 and name HN  ) (resid  94 and name O   ) 1.7 0.0 0.8
 assign (resid  39 and name N   ) (resid  94 and name O   ) 2.7 0.0 0.8
 assign (resid  92 and name HN  ) (resid  41 and name O   ) 1.7 0.0 0.8
 assign (resid  92 and name N   ) (resid  41 and name O   ) 2.7 0.0 0.8
 assign (resid  41 and name HN  ) (resid  92 and name O   ) 1.7 0.0 0.8
 assign (resid  41 and name N   ) (resid  92 and name O   ) 2.7 0.0 0.8
 assign (resid  90 and name HN  ) (resid  43 and name O   ) 1.7 0.0 0.8
 assign (resid  90 and name N   ) (resid  43 and name O   ) 2.7 0.0 0.8
 assign (resid  43 and name HN  ) (resid  90 and name O   ) 1.7 0.0 0.8
 assign (resid  43 and name N   ) (resid  90 and name O   ) 2.7 0.0 0.8
 assign (resid  40 and name HN  ) (resid  53 and name O   ) 1.7 0.0 0.8
 assign (resid  40 and name N   ) (resid  53 and name O   ) 2.7 0.0 0.8

  Entry H atom name         Orig H atom name
  Start of MODEL           1
 Raw file had  865 H/Q atoms
  Start of MODEL    1
    1   1H    ASP   1           HT3      ASP   1   1.976  -0.489  -0.324
    2   2H    ASP   1           HT1      ASP   1   1.483   0.607  -1.524
    3   3H    ASP   1           HT2      ASP   1   0.847  -0.968  -1.501
    4    HA   ASP   1           HA       ASP   1   2.881  -1.928  -2.132
    5   1HB   ASP   1           HB2      ASP   1   3.029   0.546  -3.830
    6   2HB   ASP   1           HB1      ASP   1   2.956  -1.141  -4.331
    7    H    VAL   2           HN       VAL   2   5.011  -0.943  -3.368
    8    HA   VAL   2           HA       VAL   2   6.673  -0.308  -1.148
    9    HB   VAL   2           HB       VAL   2   7.252  -0.048  -4.138
   10   1HG1  VAL   2          HG13      VAL   2   8.878   1.076  -2.529
   11   2HG1  VAL   2          HG11      VAL   2   9.200  -0.521  -1.861
   12   3HG1  VAL   2          HG12      VAL   2   9.585  -0.177  -3.542
   13   1HG2  VAL   2          HG23      VAL   2   7.388  -2.366  -2.198
   14   2HG2  VAL   2          HG21      VAL   2   6.595  -2.305  -3.769
   15   3HG2  VAL   2          HG22      VAL   2   8.353  -2.345  -3.671
   16    H    VAL   3           HN       VAL   3   7.073   1.606  -0.233
   17    HA   VAL   3           HA       VAL   3   6.052   4.060  -1.494
   18    HB   VAL   3           HB       VAL   3   7.592   3.705   1.125
   19   1HG1  VAL   3          HG12      VAL   3   5.857   5.920  -0.012
   20   2HG1  VAL   3          HG13      VAL   3   6.303   5.833   1.689
   21   3HG1  VAL   3          HG11      VAL   3   7.551   6.021   0.461
   22   1HG2  VAL   3          HG23      VAL   3   4.632   3.530   0.492
   23   2HG2  VAL   3          HG21      VAL   3   5.633   2.329   1.302
   24   3HG2  VAL   3          HG22      VAL   3   5.233   3.837   2.118
   25    H    MET   4           HN       MET   4   7.303   5.822  -2.114
   26    HA   MET   4           HA       MET   4  10.228   5.258  -2.373
   27   1HB   MET   4           HB2      MET   4   8.193   6.398  -4.286
   28   2HB   MET   4           HB1      MET   4   9.847   6.989  -4.393
   29   1HG   MET   4           HG1      MET   4  10.514   4.490  -4.354
   30   2HG   MET   4           HG2      MET   4   8.839   4.169  -4.714
   31   1HE   MET   4           HE2      MET   4  12.054   4.170  -5.777
   32   2HE   MET   4           HE3      MET   4  12.179   4.659  -7.468
   33   3HE   MET   4           HE1      MET   4  12.196   5.878  -6.194
   34    H    THR   5           HN       THR   5  10.990   6.393  -0.655
   35    HA   THR   5           HA       THR   5  10.036   9.117  -0.114
   36    HB   THR   5           HB       THR   5  12.482   7.745   1.132
   37    HG1  THR   5           HG1      THR   5  10.332   7.405   2.583
   38   1HG2  THR   5          HG22      THR   5  10.298   9.618   2.214
   39   2HG2  THR   5          HG23      THR   5  11.667   9.011   3.141
   40   3HG2  THR   5          HG21      THR   5  11.932  10.138   1.814
   41    H    GLN   6           HN       GLN   6  10.655  10.622  -1.541
   42    HA   GLN   6           HA       GLN   6  13.267  10.501  -2.864
   43   1HB   GLN   6           HB2      GLN   6  10.738  11.928  -3.191
   44   2HB   GLN   6           HB1      GLN   6  12.078  13.066  -3.254
   45   1HG   GLN   6           HG1      GLN   6  12.631  10.609  -4.762
   46   2HG   GLN   6           HG2      GLN   6  11.215  11.460  -5.364
   47   1HE2  GLN   6          HE22      GLN   6  13.061  14.296  -6.476
   48   2HE2  GLN   6          HE21      GLN   6  11.521  13.747  -6.027
   49    H    THR   7           HN       THR   7  15.034  11.706  -2.440
   50    HA   THR   7           HA       THR   7  14.960  13.993  -0.628
   51    HB   THR   7           HB       THR   7  16.929  12.270   0.606
   52    HG1  THR   7           HG1      THR   7  14.348  11.119   0.258
   53   1HG2  THR   7          HG21      THR   7  14.344  13.598   1.327
   54   2HG2  THR   7          HG22      THR   7  14.684  12.143   2.258
   55   3HG2  THR   7          HG23      THR   7  15.823  13.484   2.275
   56    HA   PRO   8           HA       PRO   8  16.627  14.809   0.740
   57   1HB   PRO   8           HB2      PRO   8  17.809  17.338   0.178
   58   2HB   PRO   8           HB1      PRO   8  18.523  16.061   1.163
   59   1HG   PRO   8           HG1      PRO   8  19.323  16.958  -1.490
   60   2HG   PRO   8           HG2      PRO   8  20.133  15.794  -0.441
   61   1HD   PRO   8           HD1      PRO   8  18.537  15.259  -2.807
   62   2HD   PRO   8           HD2      PRO   8  19.399  14.092  -1.782
   63    H    LEU   9           HN       LEU   9  15.521  17.036   1.178
   64    HA   LEU   9           HA       LEU   9  13.367  17.283  -0.763
   65   1HB   LEU   9           HB2      LEU   9  14.049  18.391   1.931
   66   2HB   LEU   9           HB1      LEU   9  13.015  19.410   0.937
   67    HG   LEU   9           HG       LEU   9  11.495  17.450   0.576
   68   1HD1  LEU   9          HD12      LEU   9  13.574  16.166   2.344
   69   2HD1  LEU   9          HD13      LEU   9  11.910  15.591   2.392
   70   3HD1  LEU   9          HD11      LEU   9  12.820  15.529   0.886
   71   1HD2  LEU   9          HD21      LEU   9  11.103  19.105   2.408
   72   2HD2  LEU   9          HD22      LEU   9  10.518  17.498   2.826
   73   3HD2  LEU   9          HD23      LEU   9  12.036  18.084   3.498
   74    H    SER  10           HN       SER  10  16.330  18.959  -0.128
   75    HA   SER  10           HA       SER  10  15.723  20.774  -2.414
   76   1HB   SER  10           HB2      SER  10  16.858  21.565   0.322
   77   2HB   SER  10           HB1      SER  10  16.884  22.637  -1.092
   78    HG   SER  10           HG       SER  10  14.873  22.220   0.549
   79    H    LEU  11           HN       LEU  11  17.463  21.245  -3.715
   80    HA   LEU  11           HA       LEU  11  20.135  20.233  -2.873
   81   1HB   LEU  11           HB2      LEU  11  18.590  18.687  -4.443
   82   2HB   LEU  11           HB1      LEU  11  19.201  19.752  -5.699
   83    HG   LEU  11           HG       LEU  11  21.542  19.258  -4.552
   84   1HD1  LEU  11          HD13      LEU  11  19.821  16.885  -3.747
   85   2HD1  LEU  11          HD11      LEU  11  21.580  16.909  -3.675
   86   3HD1  LEU  11          HD12      LEU  11  20.643  17.996  -2.656
   87   1HD2  LEU  11          HD23      LEU  11  19.995  17.354  -6.336
   88   2HD2  LEU  11          HD21      LEU  11  21.096  18.633  -6.839
   89   3HD2  LEU  11          HD22      LEU  11  21.722  17.198  -6.033
   90    HA   PRO  12           HA       PRO  12  20.282  24.420  -4.830
   91   1HB   PRO  12           HB2      PRO  12  22.101  25.253  -2.769
   92   2HB   PRO  12           HB1      PRO  12  20.410  25.724  -2.939
   93   1HG   PRO  12           HG1      PRO  12  21.585  23.927  -0.979
   94   2HG   PRO  12           HG2      PRO  12  19.921  24.501  -1.072
   95   1HD   PRO  12           HD1      PRO  12  20.921  21.876  -1.732
   96   2HD   PRO  12           HD2      PRO  12  19.250  22.459  -1.847
   97    H    VAL  13           HN       VAL  13  21.582  24.012  -6.548
   98    HA   VAL  13           HA       VAL  13  24.510  23.784  -6.021
   99    HB   VAL  13           HB       VAL  13  24.716  22.022  -7.721
  100   1HG1  VAL  13          HG11      VAL  13  23.913  21.461  -5.320
  101   2HG1  VAL  13          HG12      VAL  13  22.334  21.195  -6.051
  102   3HG1  VAL  13          HG13      VAL  13  23.710  20.218  -6.549
  103   1HG2  VAL  13          HG21      VAL  13  21.754  22.545  -8.122
  104   2HG2  VAL  13          HG22      VAL  13  23.041  22.676  -9.316
  105   3HG2  VAL  13          HG23      VAL  13  22.547  21.092  -8.723
  106    H    SER  14           HN       SER  14  25.847  24.562  -7.719
  107    HA   SER  14           HA       SER  14  24.552  26.685  -9.285
  108   1HB   SER  14           HB2      SER  14  27.469  25.920  -9.636
  109   2HB   SER  14           HB1      SER  14  26.746  27.539  -9.556
  110    HG   SER  14           HG       SER  14  27.680  25.973  -7.554
  111    H    LEU  15           HN       LEU  15  24.497  26.785 -11.553
  112    HA   LEU  15           HA       LEU  15  24.124  24.281 -12.884
  113   1HB   LEU  15           HB2      LEU  15  24.618  27.050 -14.072
  114   2HB   LEU  15           HB1      LEU  15  23.981  25.666 -14.953
  115    HG   LEU  15           HG       LEU  15  22.676  26.986 -12.544
  116   1HD1  LEU  15          HD12      LEU  15  21.897  26.907 -15.478
  117   2HD1  LEU  15          HD13      LEU  15  20.944  27.636 -14.191
  118   3HD1  LEU  15          HD11      LEU  15  22.510  28.317 -14.619
  119   1HD2  LEU  15          HD23      LEU  15  22.163  24.457 -14.053
  120   2HD2  LEU  15          HD21      LEU  15  21.880  24.820 -12.355
  121   3HD2  LEU  15          HD22      LEU  15  20.759  25.407 -13.580
  122    H    GLY  16           HN       GLY  16  25.996  23.150 -12.464
  123   1HA   GLY  16           HA1      GLY  16  27.839  22.778 -14.457
  124   2HA   GLY  16           HA2      GLY  16  28.584  24.050 -13.490
  125    H    ASP  17           HN       ASP  17  27.429  23.082 -10.996
  126    HA   ASP  17           HA       ASP  17  29.509  21.182 -10.299
  127   1HB   ASP  17           HB2      ASP  17  27.036  21.949  -8.676
  128   2HB   ASP  17           HB1      ASP  17  28.547  21.309  -8.045
  129    H    GLN  18           HN       GLN  18  28.891  19.186  -9.004
  130    HA   GLN  18           HA       GLN  18  27.056  17.599 -10.691
  131   1HB   GLN  18           HB2      GLN  18  29.023  16.859  -8.477
  132   2HB   GLN  18           HB1      GLN  18  28.032  15.678  -9.325
  133   1HG   GLN  18           HG1      GLN  18  29.073  16.250 -11.456
  134   2HG   GLN  18           HG2      GLN  18  29.957  17.581 -10.712
  135   1HE2  GLN  18          HE22      GLN  18  32.209  15.335  -8.946
  136   2HE2  GLN  18          HE21      GLN  18  31.354  16.780  -8.703
  137    H    ALA  19           HN       ALA  19  25.181  16.718 -10.002
  138    HA   ALA  19           HA       ALA  19  24.390  17.253  -7.159
  139   1HB   ALA  19           HB1      ALA  19  22.996  17.783  -9.761
  140   2HB   ALA  19           HB2      ALA  19  21.989  17.187  -8.445
  141   3HB   ALA  19           HB3      ALA  19  22.904  18.678  -8.248
  142    H    SER  20           HN       SER  20  23.497  15.587  -6.059
  143    HA   SER  20           HA       SER  20  22.852  13.095  -7.591
  144   1HB   SER  20           HB2      SER  20  24.374  13.289  -4.938
  145   2HB   SER  20           HB1      SER  20  23.971  11.786  -5.791
  146    HG   SER  20           HG       SER  20  25.143  13.782  -7.315
  147    H    ILE  21           HN       ILE  21  20.691  13.028  -7.394
  148    HA   ILE  21           HA       ILE  21  19.445  13.669  -4.777
  149    HB   ILE  21           HB       ILE  21  18.166  12.820  -7.417
  150   1HG1  ILE  21          HG11      ILE  21  17.758  15.593  -6.732
  151   2HG1  ILE  21          HG12      ILE  21  19.483  15.255  -6.751
  152   1HG2  ILE  21          HG21      ILE  21  17.107  14.070  -4.841
  153   2HG2  ILE  21          HG22      ILE  21  16.163  13.996  -6.325
  154   3HG2  ILE  21          HG23      ILE  21  16.656  12.510  -5.519
  155   1HD1  ILE  21          HD11      ILE  21  19.102  14.091  -8.995
  156   2HD1  ILE  21          HD12      ILE  21  17.484  14.786  -8.977
  157   3HD1  ILE  21          HD13      ILE  21  18.894  15.840  -9.004
  158    H    SER  22           HN       SER  22  18.618  12.170  -3.450
  159    HA   SER  22           HA       SER  22  19.074   9.329  -4.178
  160   1HB   SER  22           HB2      SER  22  18.497  10.689  -1.498
  161   2HB   SER  22           HB1      SER  22  18.805   8.952  -1.697
  162    HG   SER  22           HG       SER  22  20.776   9.908  -1.339
  163    H    CYS  23           HN       CYS  23  17.552   7.732  -3.322
  164    HA   CYS  23           HA       CYS  23  14.762   8.494  -2.915
  165   1HB   CYS  23           HB2      CYS  23  15.771   7.294  -5.507
  166   2HB   CYS  23           HB1      CYS  23  14.149   6.956  -4.963
  167    NH1  ARG  24           NH2      ARG  24  19.059   6.475   1.905
  168    NH2  ARG  24           NH1      ARG  24  18.720   7.294   3.997
  169    H    ARG  24           HN       ARG  24  14.113   7.094  -1.410
  170    HA   ARG  24           HA       ARG  24  15.376   4.395  -1.337
  171   1HB   ARG  24           HB2      ARG  24  14.015   6.187   0.687
  172   2HB   ARG  24           HB1      ARG  24  14.125   4.458   1.003
  173   1HG   ARG  24           HG1      ARG  24  16.434   4.503   1.209
  174   2HG   ARG  24           HG2      ARG  24  16.615   5.853   0.095
  175   1HD   ARG  24           HD1      ARG  24  16.285   7.432   1.745
  176   2HD   ARG  24           HD2      ARG  24  15.147   6.418   2.632
  177    HE   ARG  24           HE       ARG  24  17.034   5.265   3.646
  178   1HH1  ARG  24          HH21      ARG  24  18.727   5.925   1.137
  179   2HH1  ARG  24          HH22      ARG  24  19.952   6.919   1.851
  180   1HH2  ARG  24          HH11      ARG  24  18.134   7.360   4.804
  181   2HH2  ARG  24          HH12      ARG  24  19.602   7.760   3.980
  182    H    SER  25           HN       SER  25  14.170   2.515  -1.196
  183    HA   SER  25           HA       SER  25  11.264   2.800  -1.871
  184   1HB   SER  25           HB2      SER  25  13.262   0.674  -2.820
  185   2HB   SER  25           HB1      SER  25  11.541   0.716  -3.248
  186    HG   SER  25           HG       SER  25  12.025   2.984  -3.881
  187    H    SER  26           HN       SER  26   9.979   2.024  -0.369
  188    HA   SER  26           HA       SER  26  10.333   1.012   2.059
  189   1HB   SER  26           HB2      SER  26   8.377   0.003  -0.040
  190   2HB   SER  26           HB1      SER  26   8.299  -0.557   1.641
  191    HG   SER  26           HG       SER  26   8.067   1.532   2.325
  192    H    GLN  27           HN       GLN  27   9.711  -1.584  -0.281
  193    HA   GLN  27           HA       GLN  27  11.755  -3.191   1.173
  194   1HB   GLN  27           HB2      GLN  27   9.049  -3.689   0.807
  195   2HB   GLN  27           HB1      GLN  27   9.759  -4.599  -0.522
  196   1HG   GLN  27           HG1      GLN  27   9.909  -6.176   1.172
  197   2HG   GLN  27           HG2      GLN  27  11.459  -5.366   1.371
  198   1HE2  GLN  27          HE22      GLN  27  10.429  -3.626   4.355
  199   2HE2  GLN  27          HE21      GLN  27  11.419  -3.459   2.987
  200    H    SER  28           HN       SER  28  12.675  -1.545  -0.789
  201    HA   SER  28           HA       SER  28  14.050  -1.586  -2.680
  202   1HB   SER  28           HB2      SER  28  14.916  -3.726  -1.612
  203   2HB   SER  28           HB1      SER  28  13.700  -4.625  -2.536
  204    HG   SER  28           HG       SER  28  15.012  -4.470  -4.159
  205    H    LEU  29           HN       LEU  29  14.101  -2.227  -4.993
  206    HA   LEU  29           HA       LEU  29  11.302  -2.601  -5.985
  207   1HB   LEU  29           HB2      LEU  29  13.641  -1.245  -7.393
  208   2HB   LEU  29           HB1      LEU  29  11.968  -1.252  -7.927
  209    HG   LEU  29           HG       LEU  29  12.778  -0.117  -5.238
  210   1HD1  LEU  29          HD11      LEU  29  13.861   0.940  -7.406
  211   2HD1  LEU  29          HD12      LEU  29  12.249   1.603  -7.646
  212   3HD1  LEU  29          HD13      LEU  29  13.149   1.986  -6.183
  213   1HD2  LEU  29          HD23      LEU  29  10.374   0.199  -7.067
  214   2HD2  LEU  29          HD21      LEU  29  10.404  -0.615  -5.507
  215   3HD2  LEU  29          HD22      LEU  29  10.621   1.130  -5.593
  216    H    VAL  30           HN       VAL  30  12.961  -4.791  -5.362
  217    HA   VAL  30           HA       VAL  30  13.982  -5.756  -7.967
  218    HB   VAL  30           HB       VAL  30  13.969  -6.965  -5.160
  219   1HG1  VAL  30          HG13      VAL  30  14.909  -8.041  -7.823
  220   2HG1  VAL  30          HG11      VAL  30  15.681  -8.554  -6.326
  221   3HG1  VAL  30          HG12      VAL  30  13.966  -8.859  -6.581
  222   1HG2  VAL  30          HG22      VAL  30  15.498  -4.956  -5.835
  223   2HG2  VAL  30          HG23      VAL  30  16.254  -6.345  -5.061
  224   3HG2  VAL  30          HG21      VAL  30  16.366  -6.138  -6.806
  225    H    HIS  31           HN       HIS  31  12.613  -6.666  -9.317
  226    HA   HIS  31           HA       HIS  31   9.992  -7.590  -8.543
  227   1HB   HIS  31           HB2      HIS  31  10.737  -6.700 -10.845
  228   2HB   HIS  31           HB1      HIS  31  11.511  -8.258 -11.106
  229    HD2  HIS  31           HD2      HIS  31   7.972  -6.661 -11.072
  230    HE1  HIS  31           HE1      HIS  31   7.520 -10.681 -11.925
  231    H    SER  32           HN       SER  32   9.288  -9.860  -9.309
  232    HA   SER  32           HA       SER  32  10.706 -11.783  -7.682
  233   1HB   SER  32           HB2      SER  32   8.442 -12.090  -9.724
  234   2HB   SER  32           HB1      SER  32   8.984 -13.389  -8.643
  235    HG   SER  32           HG       SER  32   8.413 -10.811  -7.650
  236    H    ASN  33           HN       ASN  33  12.792 -11.460  -8.806
  237    HA   ASN  33           HA       ASN  33  13.516 -13.708 -10.353
  238   1HB   ASN  33           HB2      ASN  33  14.061 -12.223 -12.515
  239   2HB   ASN  33           HB1      ASN  33  12.460 -12.929 -12.324
  240   1HD2  ASN  33          HD22      ASN  33  10.964  -9.768 -12.471
  241   2HD2  ASN  33          HD21      ASN  33  10.904 -11.420 -12.856
  242    H    GLY  34           HN       GLY  34  14.124 -10.419  -9.411
  243   1HA   GLY  34           HA1      GLY  34  16.240  -9.967  -8.197
  244   2HA   GLY  34           HA2      GLY  34  17.050 -11.047  -9.326
  245    H    ASN  35           HN       ASN  35  14.650  -8.867 -10.524
  246    HA   ASN  35           HA       ASN  35  16.824  -7.161 -11.678
  247   1HB   ASN  35           HB2      ASN  35  14.223  -8.221 -12.847
  248   2HB   ASN  35           HB1      ASN  35  15.035  -6.829 -13.558
  249   1HD2  ASN  35          HD22      ASN  35  17.443  -8.783 -15.190
  250   2HD2  ASN  35          HD21      ASN  35  16.721  -7.262 -14.984
  251    H    THR  36           HN       THR  36  16.546  -4.972 -11.689
  252    HA   THR  36           HA       THR  36  14.159  -3.955 -10.198
  253    HB   THR  36           HB       THR  36  17.037  -2.890 -10.383
  254    HG1  THR  36           HG1      THR  36  15.366  -3.705  -8.230
  255   1HG2  THR  36          HG21      THR  36  14.442  -1.652  -9.452
  256   2HG2  THR  36          HG22      THR  36  15.822  -1.477  -8.372
  257   3HG2  THR  36          HG23      THR  36  15.902  -0.844 -10.013
  258    OH   TYR  37           OH       TYR  37  12.597  -7.525 -15.096
  259    H    TYR  37           HN       TYR  37  12.836  -2.589 -11.216
  260    HA   TYR  37           HA       TYR  37  13.788  -1.389 -13.791
  261   1HB   TYR  37           HB2      TYR  37  10.918  -2.037 -12.967
  262   2HB   TYR  37           HB1      TYR  37  11.462  -1.531 -14.564
  263    HD1  TYR  37           HD1      TYR  37  11.604  -4.292 -12.091
  264    HD2  TYR  37           HD2      TYR  37  12.419  -3.116 -16.098
  265    HE1  TYR  37           HE1      TYR  37  11.973  -6.635 -12.706
  266    HE2  TYR  37           HE2      TYR  37  12.785  -5.463 -16.709
  267    HH   TYR  37           HH       TYR  37  11.773  -7.995 -14.947
  268    H    LEU  38           HN       LEU  38  14.563   0.470 -12.658
  269    HA   LEU  38           HA       LEU  38  12.552   2.146 -11.272
  270   1HB   LEU  38           HB2      LEU  38  15.201   1.722 -10.794
  271   2HB   LEU  38           HB1      LEU  38  15.335   3.127 -11.840
  272    HG   LEU  38           HG       LEU  38  13.292   3.259  -9.659
  273   1HD1  LEU  38          HD13      LEU  38  16.295   3.283  -9.234
  274   2HD1  LEU  38          HD11      LEU  38  15.176   4.055  -8.111
  275   3HD1  LEU  38          HD12      LEU  38  15.093   2.318  -8.382
  276   1HD2  LEU  38          HD21      LEU  38  14.663   5.028 -11.465
  277   2HD2  LEU  38          HD22      LEU  38  13.383   5.421 -10.323
  278   3HD2  LEU  38          HD23      LEU  38  15.069   5.502  -9.819
  279    H    ASN  39           HN       ASN  39  12.478   4.486 -11.838
  280    HA   ASN  39           HA       ASN  39  13.129   5.133 -14.647
  281   1HB   ASN  39           HB2      ASN  39  10.481   4.311 -13.805
  282   2HB   ASN  39           HB1      ASN  39  10.423   6.022 -14.217
  283   1HD2  ASN  39          HD22      ASN  39  11.689   3.499 -17.200
  284   2HD2  ASN  39          HD21      ASN  39  12.167   3.182 -15.603
  285    CH2  TRP  40           CH2      TRP  40  16.491  10.312  -7.980
  286    H    TRP  40           HN       TRP  40  14.535   6.657 -13.651
  287    HA   TRP  40           HA       TRP  40  13.693   8.590 -11.741
  288   1HB   TRP  40           HB2      TRP  40  15.924   8.365 -13.739
  289   2HB   TRP  40           HB1      TRP  40  15.622   9.960 -13.061
  290    HD1  TRP  40           HD1      TRP  40  17.051   6.545 -12.148
  291    HE1  TRP  40           HE1      TRP  40  17.839   6.707  -9.752
  292    HE3  TRP  40           HE3      TRP  40  15.084  10.940 -10.977
  293    HZ2  TRP  40           HZ2      TRP  40  17.611   8.561  -7.488
  294    HZ3  TRP  40           HZ3      TRP  40  15.329  11.936  -8.741
  295    HH2  TRP  40           HH2      TRP  40  16.610  10.756  -7.004
  296    OH   TYR  41           OH       TYR  41   7.079  12.285 -17.701
  297    H    TYR  41           HN       TYR  41  13.219  10.860 -12.072
  298    HA   TYR  41           HA       TYR  41  12.230  11.591 -14.766
  299   1HB   TYR  41           HB2      TYR  41  10.502  10.401 -13.003
  300   2HB   TYR  41           HB1      TYR  41  10.321  12.078 -12.517
  301    HD1  TYR  41           HD2      TYR  41  10.885  10.604 -15.917
  302    HD2  TYR  41           HD1      TYR  41   8.268  12.781 -13.366
  303    HE1  TYR  41           HE2      TYR  41   9.357  10.975 -17.798
  304    HE2  TYR  41           HE1      TYR  41   6.744  13.153 -15.248
  305    HH   TYR  41           HH       TYR  41   6.266  11.813 -17.507
  306    H    LEU  42           HN       LEU  42  11.512  13.816 -14.895
  307    HA   LEU  42           HA       LEU  42  12.192  15.671 -12.734
  308   1HB   LEU  42           HB2      LEU  42  14.424  15.575 -13.526
  309   2HB   LEU  42           HB1      LEU  42  13.928  15.237 -15.176
  310    HG   LEU  42           HG       LEU  42  13.046  17.602 -15.321
  311   1HD1  LEU  42          HD12      LEU  42  13.487  17.526 -12.525
  312   2HD1  LEU  42          HD13      LEU  42  14.699  18.628 -13.165
  313   3HD1  LEU  42          HD11      LEU  42  12.991  18.923 -13.475
  314   1HD2  LEU  42          HD22      LEU  42  15.338  16.848 -16.109
  315   2HD2  LEU  42          HD23      LEU  42  15.224  18.561 -15.717
  316   3HD2  LEU  42          HD21      LEU  42  15.982  17.448 -14.584
  317    H    GLN  43           HN       GLN  43  11.155  17.623 -12.998
  318    HA   GLN  43           HA       GLN  43   9.981  18.279 -15.630
  319   1HB   GLN  43           HB2      GLN  43   8.209  16.911 -14.728
  320   2HB   GLN  43           HB1      GLN  43   8.393  17.598 -13.122
  321   1HG   GLN  43           HG1      GLN  43   6.384  18.496 -14.293
  322   2HG   GLN  43           HG2      GLN  43   7.542  19.764 -13.918
  323   1HE2  GLN  43          HE22      GLN  43   7.391  18.538 -17.847
  324   2HE2  GLN  43          HE21      GLN  43   7.240  17.379 -16.616
  325    H    LYS  44           HN       LYS  44   9.494  20.419 -15.888
  326    HA   LYS  44           HA       LYS  44  10.558  22.222 -13.779
  327   1HB   LYS  44           HB2      LYS  44  10.913  22.130 -16.534
  328   2HB   LYS  44           HB1      LYS  44   9.669  23.361 -16.379
  329   1HG   LYS  44           HG1      LYS  44  11.298  24.835 -15.849
  330   2HG   LYS  44           HG2      LYS  44  11.523  23.952 -14.343
  331   1HD   LYS  44           HD1      LYS  44  13.669  24.025 -15.453
  332   2HD   LYS  44           HD2      LYS  44  13.067  22.380 -15.597
  333   1HE   LYS  44           HE1      LYS  44  13.794  22.890 -17.787
  334   2HE   LYS  44           HE2      LYS  44  12.060  23.165 -17.863
  335   1HZ   LYS  44           HZ1      LYS  44  12.347  25.326 -18.218
  336   2HZ   LYS  44           HZ2      LYS  44  13.544  25.474 -17.021
  337    H    ALA  45           HN       ALA  45   9.272  24.559 -14.377
  338    HA   ALA  45           HA       ALA  45   6.713  24.142 -13.064
  339   1HB   ALA  45           HB2      ALA  45   8.098  26.583 -14.262
  340   2HB   ALA  45           HB3      ALA  45   6.528  26.682 -13.470
  341   3HB   ALA  45           HB1      ALA  45   7.944  26.174 -12.556
  342    H    GLY  46           HN       GLY  46   5.801  22.722 -14.737
  343   1HA   GLY  46           HA1      GLY  46   4.098  22.468 -16.358
  344   2HA   GLY  46           HA2      GLY  46   4.030  24.222 -16.494
  345    H    GLN  47           HN       GLN  47   6.413  21.660 -17.178
  346    HA   GLN  47           HA       GLN  47   6.674  22.781 -19.931
  347   1HB   GLN  47           HB2      GLN  47   8.548  23.214 -17.986
  348   2HB   GLN  47           HB1      GLN  47   9.119  21.672 -18.605
  349   1HG   GLN  47           HG1      GLN  47  10.194  23.000 -20.149
  350   2HG   GLN  47           HG2      GLN  47   8.625  22.995 -20.950
  351   1HE2  GLN  47          HE22      GLN  47   7.847  26.256 -19.268
  352   2HE2  GLN  47          HE21      GLN  47   7.174  24.700 -19.196
  353    H    SER  48           HN       SER  48   8.627  21.033 -20.834
  354    HA   SER  48           HA       SER  48   7.015  18.597 -21.122
  355   1HB   SER  48           HB2      SER  48   8.541  19.918 -22.917
  356   2HB   SER  48           HB1      SER  48   9.788  18.820 -22.292
  357    HG   SER  48           HG       SER  48   7.348  18.241 -23.556
  358    HA   PRO  49           HA       PRO  49   9.140  16.567 -17.799
  359   1HB   PRO  49           HB2      PRO  49   8.140  14.018 -18.768
  360   2HB   PRO  49           HB1      PRO  49   7.571  14.942 -17.378
  361   1HG   PRO  49           HG1      PRO  49   6.249  14.587 -19.914
  362   2HG   PRO  49           HG2      PRO  49   5.690  15.536 -18.536
  363   1HD   PRO  49           HD1      PRO  49   6.732  16.504 -21.056
  364   2HD   PRO  49           HD2      PRO  49   6.144  17.459 -19.682
  365    H    LYS  50           HN       LYS  50  10.858  15.043 -17.547
  366    HA   LYS  50           HA       LYS  50  12.063  14.015 -20.074
  367   1HB   LYS  50           HB2      LYS  50  12.999  16.313 -19.133
  368   2HB   LYS  50           HB1      LYS  50  13.787  15.298 -17.932
  369   1HG   LYS  50           HG1      LYS  50  15.407  14.801 -19.426
  370   2HG   LYS  50           HG2      LYS  50  14.204  14.076 -20.485
  371   1HD   LYS  50           HD1      LYS  50  15.177  15.787 -21.812
  372   2HD   LYS  50           HD2      LYS  50  13.677  16.503 -21.236
  373   1HE   LYS  50           HE1      LYS  50  15.064  17.434 -19.273
  374   2HE   LYS  50           HE2      LYS  50  16.485  16.985 -20.209
  375   1HZ   LYS  50           HZ1      LYS  50  15.757  19.312 -20.539
  376   2HZ   LYS  50           HZ2      LYS  50  15.801  18.411 -21.977
  377    H    LEU  51           HN       LEU  51  12.713  11.976 -19.892
  378    HA   LEU  51           HA       LEU  51  12.888  10.769 -17.168
  379   1HB   LEU  51           HB2      LEU  51  11.355   9.544 -18.566
  380   2HB   LEU  51           HB1      LEU  51  12.399   9.678 -19.970
  381    HG   LEU  51           HG       LEU  51  14.090   8.205 -18.693
  382   1HD1  LEU  51          HD13      LEU  51  11.829   8.339 -16.765
  383   2HD1  LEU  51          HD11      LEU  51  12.464   6.722 -17.053
  384   3HD1  LEU  51          HD12      LEU  51  13.531   7.997 -16.475
  385   1HD2  LEU  51          HD22      LEU  51  12.339   7.512 -20.497
  386   2HD2  LEU  51          HD23      LEU  51  13.079   6.244 -19.525
  387   3HD2  LEU  51          HD21      LEU  51  11.453   6.806 -19.148
  388    H    LEU  52           HN       LEU  52  14.794  10.039 -16.394
  389    HA   LEU  52           HA       LEU  52  17.164  10.321 -18.170
  390   1HB   LEU  52           HB2      LEU  52  16.985   9.928 -15.135
  391   2HB   LEU  52           HB1      LEU  52  18.448  10.300 -16.033
  392    HG   LEU  52           HG       LEU  52  17.788  12.399 -15.200
  393   1HD1  LEU  52          HD11      LEU  52  18.068  12.319 -17.741
  394   2HD1  LEU  52          HD12      LEU  52  16.310  12.357 -17.842
  395   3HD1  LEU  52          HD13      LEU  52  17.178  13.702 -17.111
  396   1HD2  LEU  52          HD21      LEU  52  15.269  11.202 -14.952
  397   2HD2  LEU  52          HD22      LEU  52  15.703  12.837 -14.463
  398   3HD2  LEU  52          HD23      LEU  52  15.010  12.547 -16.056
  399    H    ILE  53           HN       ILE  53  17.152   8.282 -15.363
  400    HA   ILE  53           HA       ILE  53  17.984   6.004 -16.965
  401    HB   ILE  53           HB       ILE  53  17.513   6.544 -14.008
  402   1HG1  ILE  53          HG11      ILE  53  19.984   6.294 -13.920
  403   2HG1  ILE  53          HG12      ILE  53  20.005   6.089 -15.658
  404   1HG2  ILE  53          HG22      ILE  53  18.296   3.995 -15.466
  405   2HG2  ILE  53          HG23      ILE  53  18.854   4.285 -13.823
  406   3HG2  ILE  53          HG21      ILE  53  17.130   4.190 -14.160
  407   1HD1  ILE  53          HD11      ILE  53  18.740   8.523 -14.426
  408   2HD1  ILE  53          HD12      ILE  53  20.481   8.448 -14.695
  409   3HD1  ILE  53          HD13      ILE  53  19.374   8.310 -16.060
  410    OH   TYR  54           OH       TYR  54  18.820   1.543 -21.267
  411    H    TYR  54           HN       TYR  54  16.890   4.013 -17.101
  412    HA   TYR  54           HA       TYR  54  14.026   4.050 -16.232
  413   1HB   TYR  54           HB2      TYR  54  13.543   2.794 -18.401
  414   2HB   TYR  54           HB1      TYR  54  14.089   4.450 -18.654
  415    HD1  TYR  54           HD2      TYR  54  16.391   4.899 -19.428
  416    HD2  TYR  54           HD1      TYR  54  14.968   0.914 -18.988
  417    HE1  TYR  54           HE2      TYR  54  18.319   4.055 -20.701
  418    HE2  TYR  54           HE1      TYR  54  16.890   0.080 -20.260
  419    HH   TYR  54           HH       TYR  54  18.669   1.721 -22.198
  420    H    LYS  55           HN       LYS  55  16.367   2.825 -14.996
  421    HA   LYS  55           HA       LYS  55  15.231   0.194 -14.523
  422   1HB   LYS  55           HB2      LYS  55  16.760   0.139 -16.713
  423   2HB   LYS  55           HB1      LYS  55  18.077   0.134 -15.549
  424   1HG   LYS  55           HG1      LYS  55  17.497  -1.948 -14.685
  425   2HG   LYS  55           HG2      LYS  55  15.800  -1.772 -15.117
  426   1HD   LYS  55           HD1      LYS  55  17.776  -1.841 -17.360
  427   2HD   LYS  55           HD2      LYS  55  17.470  -3.353 -16.516
  428   1HE   LYS  55           HE1      LYS  55  15.909  -3.134 -18.392
  429   2HE   LYS  55           HE2      LYS  55  15.023  -3.028 -16.876
  430   1HZ   LYS  55           HZ1      LYS  55  14.275  -1.318 -18.333
  431   2HZ   LYS  55           HZ2      LYS  55  15.149  -0.584 -17.075
  432    H    VAL  56           HN       VAL  56  18.388   1.812 -14.353
  433    HA   VAL  56           HA       VAL  56  18.283   2.121 -11.490
  434    HB   VAL  56           HB       VAL  56  18.644  -0.390 -11.713
  435   1HG1  VAL  56          HG12      VAL  56  20.020  -0.163 -13.840
  436   2HG1  VAL  56          HG13      VAL  56  21.357   0.389 -12.834
  437   3HG1  VAL  56          HG11      VAL  56  20.713  -1.236 -12.629
  438   1HG2  VAL  56          HG22      VAL  56  19.468   0.843  -9.729
  439   2HG2  VAL  56          HG23      VAL  56  20.555  -0.479 -10.141
  440   3HG2  VAL  56          HG21      VAL  56  20.984   1.177 -10.561
  441    H    SER  57           HN       SER  57  20.247   1.883 -14.409
  442    HA   SER  57           HA       SER  57  21.670   4.339 -13.568
  443   1HB   SER  57           HB2      SER  57  23.902   3.328 -13.949
  444   2HB   SER  57           HB1      SER  57  23.032   2.308 -12.788
  445    HG   SER  57           HG       SER  57  23.858   1.714 -15.287
  446    H    ASN  58           HN       ASN  58  21.025   1.960 -16.089
  447    HA   ASN  58           HA       ASN  58  22.297   3.192 -18.270
  448   1HB   ASN  58           HB2      ASN  58  19.683   1.650 -18.032
  449   2HB   ASN  58           HB1      ASN  58  20.267   2.216 -19.594
  450   1HD2  ASN  58          HD22      ASN  58  21.760  -1.168 -18.164
  451   2HD2  ASN  58          HD21      ASN  58  20.307  -0.461 -17.643
  452    NH1  ARG  59           NH2      ARG  59  25.413   7.091 -21.476
  453    NH2  ARG  59           NH1      ARG  59  26.510   6.531 -19.569
  454    H    ARG  59           HN       ARG  59  21.686   4.752 -19.774
  455    HA   ARG  59           HA       ARG  59  19.671   6.695 -18.739
  456   1HB   ARG  59           HB2      ARG  59  21.932   6.978 -20.758
  457   2HB   ARG  59           HB1      ARG  59  20.856   8.285 -20.275
  458   1HG   ARG  59           HG1      ARG  59  21.774   8.446 -18.156
  459   2HG   ARG  59           HG2      ARG  59  22.205   6.739 -18.099
  460   1HD   ARG  59           HD1      ARG  59  23.538   8.629 -20.021
  461   2HD   ARG  59           HD2      ARG  59  24.134   8.430 -18.377
  462    HE   ARG  59           HE       ARG  59  23.883   5.833 -19.386
  463   1HH1  ARG  59          HH21      ARG  59  24.549   7.268 -21.943
  464   2HH1  ARG  59          HH22      ARG  59  26.276   7.174 -21.973
  465   1HH2  ARG  59          HH11      ARG  59  26.471   6.287 -18.602
  466   2HH2  ARG  59          HH12      ARG  59  27.391   6.593 -20.036
  467    H    PHE  60           HN       PHE  60  17.879   7.177 -19.872
  468    HA   PHE  60           HA       PHE  60  17.059   5.523 -22.078
  469   1HB   PHE  60           HB2      PHE  60  15.605   6.783 -20.317
  470   2HB   PHE  60           HB1      PHE  60  15.819   8.202 -21.339
  471    HD1  PHE  60           HD1      PHE  60  14.460   4.751 -21.242
  472    HD2  PHE  60           HD2      PHE  60  14.672   8.383 -23.459
  473    HE1  PHE  60           HE1      PHE  60  12.682   3.948 -22.733
  474    HE2  PHE  60           HE2      PHE  60  12.893   7.576 -24.946
  475    HZ   PHE  60           HZ       PHE  60  11.896   5.358 -24.585
  476    H    SER  61           HN       SER  61  16.320   6.362 -24.183
  477    HA   SER  61           HA       SER  61  18.431   7.630 -25.609
  478   1HB   SER  61           HB2      SER  61  15.496   7.098 -26.242
  479   2HB   SER  61           HB1      SER  61  16.561   7.896 -27.416
  480    HG   SER  61           HG       SER  61  16.872   5.757 -27.771
  481    H    GLY  62           HN       GLY  62  19.011   9.684 -25.704
  482   1HA   GLY  62           HA1      GLY  62  18.293  12.010 -26.296
  483   2HA   GLY  62           HA2      GLY  62  16.936  11.786 -25.196
  484    H    VAL  63           HN       VAL  63  18.596  10.397 -23.208
  485    HA   VAL  63           HA       VAL  63  19.331  12.618 -21.604
  486    HB   VAL  63           HB       VAL  63  20.404   9.762 -21.455
  487   1HG1  VAL  63          HG11      VAL  63  21.416  11.709 -20.023
  488   2HG1  VAL  63          HG12      VAL  63  19.896  11.627 -19.135
  489   3HG1  VAL  63          HG13      VAL  63  20.954  10.221 -19.206
  490   1HG2  VAL  63          HG22      VAL  63  17.893   9.915 -21.547
  491   2HG2  VAL  63          HG23      VAL  63  18.484   9.294 -20.011
  492   3HG2  VAL  63          HG21      VAL  63  17.941  10.964 -20.136
  493    HA   PRO  64           HA       PRO  64  23.118  13.739 -23.622
  494   1HB   PRO  64           HB2      PRO  64  23.774  15.463 -21.391
  495   2HB   PRO  64           HB1      PRO  64  23.140  15.937 -22.967
  496   1HG   PRO  64           HG1      PRO  64  21.751  15.918 -20.440
  497   2HG   PRO  64           HG2      PRO  64  21.109  16.378 -22.016
  498   1HD   PRO  64           HD1      PRO  64  20.557  13.973 -20.499
  499   2HD   PRO  64           HD2      PRO  64  19.871  14.464 -22.059
  500    H    ASP  65           HN       ASP  65  22.972  11.517 -21.489
  501    HA   ASP  65           HA       ASP  65  24.556  10.099 -20.509
  502   1HB   ASP  65           HB2      ASP  65  25.963  11.507 -22.525
  503   2HB   ASP  65           HB1      ASP  65  26.981  11.633 -21.095
  504    NH1  ARG  66           NH2      ARG  66  24.253  19.251 -21.007
  505    NH2  ARG  66           NH1      ARG  66  25.631  18.821 -22.762
  506    H    ARG  66           HN       ARG  66  24.789  13.528 -19.938
  507    HA   ARG  66           HA       ARG  66  26.515  13.584 -17.700
  508   1HB   ARG  66           HB2      ARG  66  24.000  15.244 -18.225
  509   2HB   ARG  66           HB1      ARG  66  25.279  15.682 -17.100
  510   1HG   ARG  66           HG1      ARG  66  26.841  16.068 -18.830
  511   2HG   ARG  66           HG2      ARG  66  25.922  15.129 -19.999
  512   1HD   ARG  66           HD1      ARG  66  24.055  16.944 -19.586
  513   2HD   ARG  66           HD2      ARG  66  25.397  17.918 -18.983
  514    HE   ARG  66           HE       ARG  66  26.100  16.773 -21.522
  515   1HH1  ARG  66          HH21      ARG  66  23.888  18.980 -20.116
  516   2HH1  ARG  66          HH22      ARG  66  23.940  20.096 -21.436
  517   1HH2  ARG  66          HH11      ARG  66  26.304  18.224 -23.195
  518   2HH2  ARG  66          HH12      ARG  66  25.340  19.661 -23.218
  519    H    PHE  67           HN       PHE  67  23.314  12.358 -17.989
  520    HA   PHE  67           HA       PHE  67  22.829  12.401 -15.077
  521   1HB   PHE  67           HB2      PHE  67  21.259  11.334 -17.460
  522   2HB   PHE  67           HB1      PHE  67  20.693  11.198 -15.799
  523    HD1  PHE  67           HD1      PHE  67  21.792  13.707 -18.353
  524    HD2  PHE  67           HD2      PHE  67  19.619  13.018 -14.755
  525    HE1  PHE  67           HE1      PHE  67  20.911  15.998 -18.442
  526    HE2  PHE  67           HE2      PHE  67  18.735  15.297 -14.858
  527    HZ   PHE  67           HZ       PHE  67  19.384  16.798 -16.692
  528    H    SER  68           HN       SER  68  23.146  10.750 -13.743
  529    HA   SER  68           HA       SER  68  23.583   8.038 -14.879
  530   1HB   SER  68           HB2      SER  68  25.863   8.509 -14.553
  531   2HB   SER  68           HB1      SER  68  25.528   9.753 -13.335
  532    HG   SER  68           HG       SER  68  25.801   7.010 -13.058
  533    H    GLY  69           HN       GLY  69  22.662   6.471 -13.714
  534   1HA   GLY  69           HA1      GLY  69  21.568   7.221 -11.031
  535   2HA   GLY  69           HA2      GLY  69  20.732   6.147 -12.144
  536    H    SER  70           HN       SER  70  21.507   5.597  -9.439
  537    HA   SER  70           HA       SER  70  22.728   2.995  -9.858
  538   1HB   SER  70           HB2      SER  70  24.714   3.498  -8.303
  539   2HB   SER  70           HB1      SER  70  24.801   4.384  -9.838
  540    HG   SER  70           HG       SER  70  23.233   5.768  -8.244
  541    H    GLY  71           HN       GLY  71  23.320   2.096  -7.494
  542   1HA   GLY  71           HA1      GLY  71  22.481   2.674  -5.076
  543   2HA   GLY  71           HA2      GLY  71  20.906   2.720  -5.856
  544    H    SER  72           HN       SER  72  21.123   1.039  -3.843
  545    HA   SER  72           HA       SER  72  21.822  -1.649  -4.881
  546   1HB   SER  72           HB2      SER  72  22.562  -1.167  -2.584
  547   2HB   SER  72           HB1      SER  72  20.932  -0.644  -2.123
  548    HG   SER  72           HG       SER  72  21.926  -3.203  -2.612
  549    H    GLY  73           HN       GLY  73  19.355  -1.620  -2.545
  550   1HA   GLY  73           HA1      GLY  73  17.324  -2.268  -4.649
  551   2HA   GLY  73           HA2      GLY  73  17.410  -3.109  -3.105
  552    H    THR  74           HN       THR  74  17.430  -1.388  -1.189
  553    HA   THR  74           HA       THR  74  14.925   0.145  -1.544
  554    HB   THR  74           HB       THR  74  15.164   0.426   1.007
  555    HG1  THR  74           HG1      THR  74  16.916  -0.543   1.901
  556   1HG2  THR  74          HG21      THR  74  14.998  -2.186  -0.454
  557   2HG2  THR  74          HG22      THR  74  15.419  -2.320   1.248
  558   3HG2  THR  74          HG23      THR  74  13.911  -1.546   0.773
  559    H    ASP  75           HN       ASP  75  17.700   0.943  -2.522
  560    HA   ASP  75           HA       ASP  75  17.442   3.767  -1.707
  561   1HB   ASP  75           HB2      ASP  75  19.341   2.022  -0.488
  562   2HB   ASP  75           HB1      ASP  75  20.261   3.012  -1.617
  563    H    PHE  76           HN       PHE  76  17.982   5.136  -3.314
  564    HA   PHE  76           HA       PHE  76  19.681   4.168  -5.550
  565   1HB   PHE  76           HB2      PHE  76  16.880   5.348  -5.884
  566   2HB   PHE  76           HB1      PHE  76  17.977   4.968  -7.209
  567    HD1  PHE  76           HD1      PHE  76  18.720   2.546  -7.511
  568    HD2  PHE  76           HD2      PHE  76  15.545   3.639  -4.888
  569    HE1  PHE  76           HE1      PHE  76  17.927   0.223  -7.500
  570    HE2  PHE  76           HE2      PHE  76  14.757   1.315  -4.881
  571    HZ   PHE  76           HZ       PHE  76  15.947  -0.395  -6.184
  572    H    THR  77           HN       THR  77  20.212   5.951  -7.090
  573    HA   THR  77           HA       THR  77  19.895   8.683  -6.035
  574    HB   THR  77           HB       THR  77  22.677   7.423  -6.357
  575    HG1  THR  77           HG1      THR  77  20.947   8.043  -4.200
  576   1HG2  THR  77          HG21      THR  77  21.684  10.126  -5.282
  577   2HG2  THR  77          HG22      THR  77  23.343   9.556  -5.134
  578   3HG2  THR  77          HG23      THR  77  22.673   9.912  -6.725
  579    H    LEU  78           HN       LEU  78  20.564  10.320  -7.482
  580    HA   LEU  78           HA       LEU  78  21.142   9.386 -10.266
  581   1HB   LEU  78           HB2      LEU  78  18.705  10.178  -9.732
  582   2HB   LEU  78           HB1      LEU  78  19.391  11.786  -9.583
  583    HG   LEU  78           HG       LEU  78  19.582  10.017 -12.057
  584   1HD1  LEU  78          HD13      LEU  78  17.590  11.911 -11.079
  585   2HD1  LEU  78          HD11      LEU  78  18.253  12.413 -12.631
  586   3HD1  LEU  78          HD12      LEU  78  17.509  10.827 -12.464
  587   1HD2  LEU  78          HD21      LEU  78  20.634  12.773 -11.384
  588   2HD2  LEU  78          HD22      LEU  78  21.525  11.399 -12.033
  589   3HD2  LEU  78          HD23      LEU  78  20.375  12.260 -13.046
  590    H    LYS  79           HN       LYS  79  23.293   9.972 -10.261
  591    HA   LYS  79           HA       LYS  79  24.017  12.667  -9.327
  592   1HB   LYS  79           HB2      LYS  79  26.366  11.909 -10.083
  593   2HB   LYS  79           HB1      LYS  79  25.653  11.070  -8.716
  594   1HG   LYS  79           HG1      LYS  79  24.730   9.581 -10.856
  595   2HG   LYS  79           HG2      LYS  79  26.336  10.053 -11.389
  596   1HD   LYS  79           HD1      LYS  79  27.055   8.317 -10.102
  597   2HD   LYS  79           HD2      LYS  79  26.794   9.428  -8.762
  598   1HE   LYS  79           HE1      LYS  79  24.265   8.478  -9.092
  599   2HE   LYS  79           HE2      LYS  79  25.198   7.070  -9.593
  600   1HZ   LYS  79           HZ1      LYS  79  25.104   8.409  -6.985
  601   2HZ   LYS  79           HZ2      LYS  79  25.075   6.750  -7.353
  602    H    ILE  80           HN       ILE  80  24.571  14.341 -10.571
  603    HA   ILE  80           HA       ILE  80  24.410  13.960 -13.531
  604    HB   ILE  80           HB       ILE  80  23.678  16.403 -11.837
  605   1HG1  ILE  80          HG11      ILE  80  21.796  14.625 -13.416
  606   2HG1  ILE  80          HG12      ILE  80  22.126  14.378 -11.705
  607   1HG2  ILE  80          HG22      ILE  80  24.386  16.228 -14.572
  608   2HG2  ILE  80          HG23      ILE  80  22.627  16.265 -14.586
  609   3HG2  ILE  80          HG21      ILE  80  23.529  17.566 -13.812
  610   1HD1  ILE  80          HD12      ILE  80  21.250  17.074 -12.763
  611   2HD1  ILE  80          HD13      ILE  80  20.080  15.842 -12.304
  612   3HD1  ILE  80          HD11      ILE  80  21.198  16.484 -11.105
  613    H    SER  81           HN       SER  81  26.092  14.506 -14.673
  614    HA   SER  81           HA       SER  81  28.516  15.196 -13.441
  615   1HB   SER  81           HB2      SER  81  27.549  15.394 -16.318
  616   2HB   SER  81           HB1      SER  81  29.202  15.859 -15.870
  617    HG   SER  81           HG       SER  81  29.013  13.610 -16.376
  618    NH1  ARG  82           NH2      ARG  82  27.376  23.088 -19.811
  619    NH2  ARG  82           NH1      ARG  82  28.473  23.863 -17.973
  620    H    ARG  82           HN       ARG  82  26.069  17.219 -14.911
  621    HA   ARG  82           HA       ARG  82  27.057  19.527 -13.461
  622   1HB   ARG  82           HB2      ARG  82  27.810  20.836 -15.283
  623   2HB   ARG  82           HB1      ARG  82  28.384  19.245 -15.757
  624   1HG   ARG  82           HG1      ARG  82  26.470  18.927 -17.229
  625   2HG   ARG  82           HG2      ARG  82  25.726  20.414 -16.651
  626   1HD   ARG  82           HD1      ARG  82  28.496  20.637 -17.735
  627   2HD   ARG  82           HD2      ARG  82  27.199  20.355 -18.897
  628    HE   ARG  82           HE       ARG  82  26.313  22.430 -17.194
  629   1HH1  ARG  82          HH21      ARG  82  26.723  22.443 -20.205
  630   2HH1  ARG  82          HH22      ARG  82  27.827  23.761 -20.393
  631   1HH2  ARG  82          HH11      ARG  82  28.642  23.799 -16.990
  632   2HH2  ARG  82          HH12      ARG  82  28.949  24.552 -18.519
  633    H    VAL  83           HN       VAL  83  25.434  20.838 -13.019
  634    HA   VAL  83           HA       VAL  83  22.770  20.136 -14.033
  635    HB   VAL  83           HB       VAL  83  23.643  22.277 -12.030
  636   1HG1  VAL  83          HG12      VAL  83  21.300  22.405 -13.134
  637   2HG1  VAL  83          HG13      VAL  83  20.939  20.928 -12.247
  638   3HG1  VAL  83          HG11      VAL  83  21.353  22.400 -11.375
  639   1HG2  VAL  83          HG22      VAL  83  23.388  19.349 -11.864
  640   2HG2  VAL  83          HG23      VAL  83  24.177  20.467 -10.753
  641   3HG2  VAL  83          HG21      VAL  83  22.441  20.193 -10.642
  642    H    GLU  84           HN       GLU  84  21.475  21.400 -15.270
  643    HA   GLU  84           HA       GLU  84  22.677  23.923 -16.352
  644   1HB   GLU  84           HB2      GLU  84  21.128  21.686 -17.725
  645   2HB   GLU  84           HB1      GLU  84  21.292  23.276 -18.460
  646   1HG   GLU  84           HG1      GLU  84  23.439  22.871 -19.078
  647   2HG   GLU  84           HG2      GLU  84  23.859  22.251 -17.485
  648    H    ALA  85           HN       ALA  85  20.984  25.382 -17.320
  649    HA   ALA  85           HA       ALA  85  19.103  26.174 -15.403
  650   1HB   ALA  85           HB3      ALA  85  19.093  26.512 -18.438
  651   2HB   ALA  85           HB1      ALA  85  17.968  27.357 -17.379
  652   3HB   ALA  85           HB2      ALA  85  19.697  27.659 -17.247
  653    H    GLU  86           HN       GLU  86  18.644  23.982 -18.142
  654    HA   GLU  86           HA       GLU  86  15.813  23.638 -17.823
  655   1HB   GLU  86           HB2      GLU  86  17.988  21.832 -18.975
  656   2HB   GLU  86           HB1      GLU  86  16.273  21.459 -19.092
  657   1HG   GLU  86           HG1      GLU  86  16.425  24.109 -19.955
  658   2HG   GLU  86           HG2      GLU  86  17.865  23.364 -20.643
  659    H    ASP  87           HN       ASP  87  18.596  21.969 -16.490
  660    HA   ASP  87           HA       ASP  87  17.310  19.767 -15.275
  661   1HB   ASP  87           HB2      ASP  87  19.863  20.526 -15.439
  662   2HB   ASP  87           HB1      ASP  87  19.542  21.235 -13.860
  663    H    LEU  88           HN       LEU  88  17.540  23.103 -14.259
  664    HA   LEU  88           HA       LEU  88  16.800  22.853 -11.551
  665   1HB   LEU  88           HB2      LEU  88  15.884  25.022 -13.499
  666   2HB   LEU  88           HB1      LEU  88  16.014  25.185 -11.753
  667    HG   LEU  88           HG       LEU  88  18.345  24.605 -13.617
  668   1HD1  LEU  88          HD11      LEU  88  17.424  26.898 -13.879
  669   2HD1  LEU  88          HD12      LEU  88  17.570  27.146 -12.142
  670   3HD1  LEU  88          HD13      LEU  88  19.014  26.926 -13.125
  671   1HD2  LEU  88          HD21      LEU  88  17.970  24.512 -10.710
  672   2HD2  LEU  88          HD22      LEU  88  19.304  23.902 -11.681
  673   3HD2  LEU  88          HD23      LEU  88  19.278  25.590 -11.183
  674    H    GLY  89           HN       GLY  89  14.814  22.929 -10.479
  675   1HA   GLY  89           HA1      GLY  89  12.268  23.217 -10.975
  676   2HA   GLY  89           HA2      GLY  89  12.537  21.894 -12.109
  677    H    ILE  90           HN       ILE  90  11.334  20.341 -11.142
  678    HA   ILE  90           HA       ILE  90  12.157  19.546  -8.375
  679    HB   ILE  90           HB       ILE  90   9.509  18.830  -9.688
  680   1HG1  ILE  90          HG11      ILE  90   9.658  21.285  -9.756
  681   2HG1  ILE  90          HG12      ILE  90   8.482  20.772  -8.556
  682   1HG2  ILE  90          HG22      ILE  90  10.274  17.657  -7.586
  683   2HG2  ILE  90          HG23      ILE  90  10.359  19.216  -6.773
  684   3HG2  ILE  90          HG21      ILE  90   8.806  18.591  -7.318
  685   1HD1  ILE  90          HD11      ILE  90  11.268  21.105  -7.561
  686   2HD1  ILE  90          HD12      ILE  90  10.437  22.583  -8.029
  687   3HD1  ILE  90          HD13      ILE  90   9.744  21.537  -6.795
  688    OH   TYR  91           OH       TYR  91  17.846  16.483 -13.428
  689    H    TYR  91           HN       TYR  91  12.788  17.467  -8.074
  690    HA   TYR  91           HA       TYR  91  12.888  15.784 -10.536
  691   1HB   TYR  91           HB2      TYR  91  14.672  16.214  -8.199
  692   2HB   TYR  91           HB1      TYR  91  14.508  14.524  -8.673
  693    HD1  TYR  91           HD1      TYR  91  15.388  17.903  -9.921
  694    HD2  TYR  91           HD2      TYR  91  15.501  13.725 -10.717
  695    HE1  TYR  91           HE1      TYR  91  16.868  18.307 -11.829
  696    HE2  TYR  91           HE2      TYR  91  16.992  14.128 -12.628
  697    HH   TYR  91           HH       TYR  91  18.428  17.217 -13.203
  698    H    PHE  92           HN       PHE  92  12.552  13.515 -10.360
  699    HA   PHE  92           HA       PHE  92  11.101  12.530  -7.981
  700   1HB   PHE  92           HB2      PHE  92   9.847  12.331 -10.754
  701   2HB   PHE  92           HB1      PHE  92   9.098  11.925  -9.220
  702    HD1  PHE  92           HD2      PHE  92  10.189  14.707 -11.393
  703    HD2  PHE  92           HD1      PHE  92   8.186  13.652  -7.786
  704    HE1  PHE  92           HE2      PHE  92   9.297  16.988 -11.216
  705    HE2  PHE  92           HE1      PHE  92   7.296  15.934  -7.613
  706    HZ   PHE  92           HZ       PHE  92   7.846  17.600  -9.330
  707    H    CYS  93           HN       CYS  93  10.525  10.196  -8.275
  708    HA   CYS  93           HA       CYS  93  12.186   8.770 -10.261
  709   1HB   CYS  93           HB2      CYS  93  13.029   7.283  -8.333
  710   2HB   CYS  93           HB1      CYS  93  13.775   8.848  -8.503
  711    H    SER  94           HN       SER  94  10.844   7.386 -11.153
  712    HA   SER  94           HA       SER  94   8.623   6.270  -9.511
  713   1HB   SER  94           HB2      SER  94   8.422   7.466 -11.915
  714   2HB   SER  94           HB1      SER  94   8.813   5.834 -12.493
  715    HG   SER  94           HG       SER  94   6.496   6.460 -11.881
  716    H    GLN  95           HN       GLN  95   7.944   4.027 -10.602
  717    HA   GLN  95           HA       GLN  95  10.186   2.279 -11.249
  718   1HB   GLN  95           HB2      GLN  95   9.703   0.817  -9.152
  719   2HB   GLN  95           HB1      GLN  95  10.601   2.303  -8.872
  720   1HG   GLN  95           HG1      GLN  95   8.993   3.021  -7.457
  721   2HG   GLN  95           HG2      GLN  95   7.803   2.928  -8.749
  722   1HE2  GLN  95          HE22      GLN  95   6.654  -0.342  -7.761
  723   2HE2  GLN  95          HE21      GLN  95   6.893   0.628  -9.131
  724    H    THR  96           HN       THR  96   9.471   0.529 -12.333
  725    HA   THR  96           HA       THR  96   6.522   0.078 -12.347
  726    HB   THR  96           HB       THR  96   7.636   0.763 -14.547
  727    HG1  THR  96           HG1      THR  96   6.542  -1.852 -14.261
  728   1HG2  THR  96          HG22      THR  96   8.766  -2.062 -14.259
  729   2HG2  THR  96          HG23      THR  96   8.945  -1.027 -15.671
  730   3HG2  THR  96          HG21      THR  96   9.742  -0.604 -14.159
  731    H    THR  97           HN       THR  97   8.881  -1.060 -10.695
  732    HA   THR  97           HA       THR  97   8.989  -3.874 -11.282
  733    HB   THR  97           HB       THR  97   9.578  -2.226  -8.762
  734    HG1  THR  97           HG1      THR  97  11.669  -3.355  -9.632
  735   1HG2  THR  97          HG22      THR  97   9.003  -4.699  -8.232
  736   2HG2  THR  97          HG23      THR  97  10.298  -5.152  -9.335
  737   3HG2  THR  97          HG21      THR  97  10.665  -4.252  -7.868
  738    H    HIS  98           HN       HIS  98   7.208  -2.085  -8.765
  739    HA   HIS  98           HA       HIS  98   5.500  -4.495  -8.378
  740   1HB   HIS  98           HB2      HIS  98   5.568  -1.955  -6.692
  741   2HB   HIS  98           HB1      HIS  98   4.936  -3.532  -6.225
  742    HD2  HIS  98           HD2      HIS  98   8.396  -1.751  -6.774
  743    HE1  HIS  98           HE1      HIS  98   9.068  -5.359  -4.871
  744    H    VAL  99           HN       VAL  99   3.192  -4.116  -7.959
  745    HA   VAL  99           HA       VAL  99   2.114  -1.832  -9.550
  746    HB   VAL  99           HB       VAL  99   1.731  -4.785  -9.841
  747   1HG1  VAL  99          HG11      VAL  99  -0.592  -2.837 -10.049
  748   2HG1  VAL  99          HG12      VAL  99  -0.595  -4.438 -10.776
  749   3HG1  VAL  99          HG13      VAL  99  -0.497  -4.267  -9.027
  750   1HG2  VAL  99          HG23      VAL  99   2.821  -3.379 -11.562
  751   2HG2  VAL  99          HG21      VAL  99   1.351  -4.117 -12.191
  752   3HG2  VAL  99          HG22      VAL  99   1.350  -2.422 -11.713
  753    HA   PRO 100           HA       PRO 100   0.205  -1.008 -10.033
  754   1HB   PRO 100           HB2      PRO 100  -0.647   1.450  -8.843
  755   2HB   PRO 100           HB1      PRO 100  -1.675   0.271  -9.658
  756   1HG   PRO 100           HG1      PRO 100  -1.514   0.859  -6.810
  757   2HG   PRO 100           HG2      PRO 100  -2.644  -0.209  -7.643
  758   1HD   PRO 100           HD1      PRO 100  -0.376  -0.954  -6.016
  759   2HD   PRO 100           HD2      PRO 100  -1.514  -2.028  -6.847
  760    HA   PRO 101           HA       PRO 101   3.914   1.305  -9.979
  761   1HB   PRO 101           HB2      PRO 101   2.949   3.552 -11.540
  762   2HB   PRO 101           HB1      PRO 101   3.882   2.170 -12.114
  763   1HG   PRO 101           HG1      PRO 101   1.090   2.732 -12.587
  764   2HG   PRO 101           HG2      PRO 101   2.022   1.349 -13.160
  765   1HD   PRO 101           HD1      PRO 101   0.012   1.395 -11.080
  766   2HD   PRO 101           HD2      PRO 101   0.933   0.001 -11.674
  767    H    THR 102           HN       THR 102   4.922   3.030  -8.903
  768    HA   THR 102           HA       THR 102   3.192   4.457  -7.003
  769    HB   THR 102           HB       THR 102   5.480   5.306  -6.131
  770    HG1  THR 102           HG1      THR 102   7.101   3.783  -7.268
  771   1HG2  THR 102          HG23      THR 102   5.244   2.288  -6.660
  772   2HG2  THR 102          HG21      THR 102   6.312   3.019  -5.465
  773   3HG2  THR 102          HG22      THR 102   4.566   3.113  -5.260
  774    H    PHE 103           HN       PHE 103   6.004   5.780  -8.702
  775    HA   PHE 103           HA       PHE 103   6.304   7.802  -9.827
  776   1HB   PHE 103           HB2      PHE 103   3.935   6.691 -10.835
  777   2HB   PHE 103           HB1      PHE 103   3.443   8.317 -10.374
  778    HD1  PHE 103           HD2      PHE 103   5.619  10.052 -10.925
  779    HD2  PHE 103           HD1      PHE 103   4.470   6.578 -13.108
  780    HE1  PHE 103           HE2      PHE 103   6.712  10.949 -12.932
  781    HE2  PHE 103           HE1      PHE 103   5.566   7.479 -15.112
  782    HZ   PHE 103           HZ       PHE 103   6.686   9.665 -15.028
  783    H    GLY 104           HN       GLY 104   6.874   9.354  -8.438
  784   1HA   GLY 104           HA1      GLY 104   5.177  11.432  -7.642
  785   2HA   GLY 104           HA2      GLY 104   5.151  10.288  -6.305
  786    H    GLY 105           HN       GLY 105   6.201  11.702  -4.894
  787   1HA   GLY 105           HA1      GLY 105   8.249  12.191  -3.750
  788   2HA   GLY 105           HA2      GLY 105   9.137  11.775  -5.213
  789    H    GLY 106           HN       GLY 106  10.219  13.909  -4.428
  790   1HA   GLY 106           HA1      GLY 106   9.688  15.950  -6.282
  791   2HA   GLY 106           HA2      GLY 106   8.762  16.370  -4.849
  792    H    THR 107           HN       THR 107  11.972  15.958  -6.171
  793    HA   THR 107           HA       THR 107  13.148  17.106  -3.683
  794    HB   THR 107           HB       THR 107  14.429  15.784  -6.154
  795    HG1  THR 107           HG1      THR 107  14.757  14.187  -4.645
  796   1HG2  THR 107          HG21      THR 107  15.565  17.423  -3.909
  797   2HG2  THR 107          HG22      THR 107  16.320  15.845  -4.110
  798   3HG2  THR 107          HG23      THR 107  16.315  16.997  -5.443
  799    H    LYS 108           HN       LYS 108  13.379  19.233  -3.620
  800    HA   LYS 108           HA       LYS 108  13.016  20.885  -5.960
  801   1HB   LYS 108           HB2      LYS 108  12.405  21.555  -3.608
  802   2HB   LYS 108           HB1      LYS 108  14.115  21.627  -3.209
  803   1HG   LYS 108           HG1      LYS 108  13.485  23.876  -3.731
  804   2HG   LYS 108           HG2      LYS 108  14.358  23.295  -5.144
  805   1HD   LYS 108           HD1      LYS 108  12.313  22.892  -6.349
  806   2HD   LYS 108           HD2      LYS 108  11.340  23.125  -4.902
  807   1HE   LYS 108           HE1      LYS 108  12.953  25.463  -5.244
  808   2HE   LYS 108           HE2      LYS 108  12.207  25.100  -6.796
  809   1HZ   LYS 108           HZ1      LYS 108  10.097  25.302  -5.934
  810   2HZ   LYS 108           HZ2      LYS 108  10.597  25.046  -4.330
  811    H    LEU 109           HN       LEU 109  14.413  21.557  -7.374
  812    HA   LEU 109           HA       LEU 109  17.300  21.757  -6.667
  813   1HB   LEU 109           HB2      LEU 109  16.499  19.590  -8.039
  814   2HB   LEU 109           HB1      LEU 109  16.474  20.716  -9.392
  815    HG   LEU 109           HG       LEU 109  18.900  20.846  -7.676
  816   1HD1  LEU 109          HD12      LEU 109  18.314  18.469  -9.480
  817   2HD1  LEU 109          HD13      LEU 109  19.888  18.837  -8.781
  818   3HD1  LEU 109          HD11      LEU 109  18.538  18.411  -7.735
  819   1HD2  LEU 109          HD21      LEU 109  18.588  22.163  -9.770
  820   2HD2  LEU 109          HD22      LEU 109  19.971  21.081  -9.884
  821   3HD2  LEU 109          HD23      LEU 109  18.458  20.662 -10.681
  822    H    GLU 110           HN       GLU 110  16.683  24.006  -6.548
  823    HA   GLU 110           HA       GLU 110  16.285  25.237  -9.244
  824   1HB   GLU 110           HB2      GLU 110  14.545  25.566  -7.328
  825   2HB   GLU 110           HB1      GLU 110  15.756  26.598  -6.577
  826   1HG   GLU 110           HG1      GLU 110  14.116  27.865  -8.016
  827   2HG   GLU 110           HG2      GLU 110  15.787  28.068  -8.530
  828    H    ILE 111           HN       ILE 111  18.781  24.694  -9.033
  829    HA   ILE 111           HA       ILE 111  20.924  25.594  -9.029
  830    HB   ILE 111           HB       ILE 111  19.127  27.617  -9.812
  831   1HG1  ILE 111          HG11      ILE 111  22.136  27.904  -9.873
  832   2HG1  ILE 111          HG12      ILE 111  21.294  26.718 -10.864
  833   1HG2  ILE 111          HG23      ILE 111  19.710  28.556  -7.418
  834   2HG2  ILE 111          HG21      ILE 111  21.291  28.907  -8.107
  835   3HG2  ILE 111          HG22      ILE 111  19.851  29.655  -8.784
  836   1HD1  ILE 111          HD12      ILE 111  19.904  28.533 -11.841
  837   2HD1  ILE 111          HD13      ILE 111  20.774  29.714 -10.868
  838   3HD1  ILE 111          HD11      ILE 111  21.619  28.817 -12.125
  839    H    LYS 112           HN       LYS 112  22.411  27.151  -7.754
  840    HA   LYS 112           HA       LYS 112  21.991  26.515  -4.908
  841   1HB   LYS 112           HB2      LYS 112  24.204  26.096  -5.917
  842   2HB   LYS 112           HB1      LYS 112  24.315  27.768  -6.446
  843   1HG   LYS 112           HG1      LYS 112  24.221  28.485  -4.043
  844   2HG   LYS 112           HG2      LYS 112  24.240  26.788  -3.572
  845   1HD   LYS 112           HD1      LYS 112  26.390  26.564  -4.934
  846   2HD   LYS 112           HD2      LYS 112  26.398  28.319  -5.056
  847   1HE   LYS 112           HE1      LYS 112  27.062  28.581  -2.894
  848   2HE   LYS 112           HE2      LYS 112  25.969  27.330  -2.312
  849   1HZ   LYS 112           HZ1      LYS 112  27.721  25.844  -3.623
  850   2HZ   LYS 112           HZ2      LYS 112  28.740  27.123  -3.161
  851    NH1  ARG 113           NH2      ARG 113  17.128  29.257  -6.133
  852    NH2  ARG 113           NH1      ARG 113  15.059  28.942  -5.252
  853    H    ARG 113           HN       ARG 113  21.872  28.006  -3.267
  854    HA   ARG 113           HA       ARG 113  21.394  30.838  -4.114
  855   1HB   ARG 113           HB2      ARG 113  19.918  28.959  -2.316
  856   2HB   ARG 113           HB1      ARG 113  20.082  30.601  -1.706
  857   1HG   ARG 113           HG1      ARG 113  18.778  31.504  -3.389
  858   2HG   ARG 113           HG2      ARG 113  19.273  30.295  -4.567
  859   1HD   ARG 113           HD1      ARG 113  17.872  28.600  -3.446
  860   2HD   ARG 113           HD2      ARG 113  17.403  29.781  -2.223
  861    HE   ARG 113           HE       ARG 113  16.137  30.980  -3.946
  862   1HH1  ARG 113          HH21      ARG 113  18.041  29.654  -6.051
  863   2HH1  ARG 113          HH22      ARG 113  16.889  28.715  -6.938
  864   1HH2  ARG 113          HH11      ARG 113  14.414  29.100  -4.507
  865   2HH2  ARG 113          HH12      ARG 113  14.783  28.404  -6.048
   
  Start of MODEL           2
 Raw file had  865 H/Q atoms
  Start of MODEL    2
    1   1H    ASP   1           HT3      ASP   1   3.077   0.626   0.261
    2   2H    ASP   1           HT1      ASP   1   1.725   1.146  -0.622
    3   3H    ASP   1           HT2      ASP   1   1.899  -0.497  -0.226
    4    HA   ASP   1           HA       ASP   1   2.463  -0.227  -2.511
    5   1HB   ASP   1           HB2      ASP   1   4.877   1.366  -2.156
    6   2HB   ASP   1           HB1      ASP   1   3.521   1.674  -3.236
    7    H    VAL   2           HN       VAL   2   3.220  -2.083  -2.784
    8    HA   VAL   2           HA       VAL   2   4.660  -3.856  -2.871
    9    HB   VAL   2           HB       VAL   2   6.852  -2.194  -1.610
   10   1HG1  VAL   2          HG11      VAL   2   7.190  -4.602  -2.319
   11   2HG1  VAL   2          HG12      VAL   2   6.872  -4.096  -3.976
   12   3HG1  VAL   2          HG13      VAL   2   8.270  -3.461  -3.114
   13   1HG2  VAL   2          HG22      VAL   2   5.408  -1.676  -4.163
   14   2HG2  VAL   2          HG23      VAL   2   6.286  -0.554  -3.124
   15   3HG2  VAL   2          HG21      VAL   2   7.165  -1.603  -4.233
   16    H    VAL   3           HN       VAL   3   3.808  -5.217  -1.373
   17    HA   VAL   3           HA       VAL   3   4.099  -4.755   1.481
   18    HB   VAL   3           HB       VAL   3   3.361  -7.360   0.058
   19   1HG1  VAL   3          HG11      VAL   3   2.950  -6.234   2.835
   20   2HG1  VAL   3          HG12      VAL   3   1.914  -7.511   2.209
   21   3HG1  VAL   3          HG13      VAL   3   3.644  -7.786   2.378
   22   1HG2  VAL   3          HG23      VAL   3   1.745  -4.871   0.644
   23   2HG2  VAL   3          HG21      VAL   3   1.849  -5.777  -0.863
   24   3HG2  VAL   3          HG22      VAL   3   0.968  -6.446   0.507
   25    H    MET   4           HN       MET   4   5.197  -6.216   2.943
   26    HA   MET   4           HA       MET   4   7.645  -7.432   1.726
   27   1HB   MET   4           HB2      MET   4   7.291  -5.827   4.296
   28   2HB   MET   4           HB1      MET   4   8.733  -6.780   3.971
   29   1HG   MET   4           HG1      MET   4   7.676  -4.677   2.080
   30   2HG   MET   4           HG2      MET   4   8.830  -4.313   3.334
   31   1HE   MET   4           HE2      MET   4  10.897  -5.136   3.660
   32   2HE   MET   4           HE3      MET   4  11.173  -6.770   3.055
   33   3HE   MET   4           HE1      MET   4  12.081  -5.415   2.384
   34    H    THR   5           HN       THR   5   7.140  -9.555   1.794
   35    HA   THR   5           HA       THR   5   5.769 -10.742   4.089
   36    HB   THR   5           HB       THR   5   7.289 -12.360   1.994
   37    HG1  THR   5           HG1      THR   5   4.783 -11.048   1.674
   38   1HG2  THR   5          HG23      THR   5   4.591 -12.522   3.444
   39   2HG2  THR   5          HG21      THR   5   4.973 -13.552   2.070
   40   3HG2  THR   5          HG22      THR   5   5.913 -13.679   3.553
   41    H    GLN   6           HN       GLN   6   6.673 -11.817   5.792
   42    HA   GLN   6           HA       GLN   6   9.646 -12.141   5.742
   43   1HB   GLN   6           HB2      GLN   6   9.078 -10.234   7.175
   44   2HB   GLN   6           HB1      GLN   6   7.863 -11.182   8.026
   45   1HG   GLN   6           HG1      GLN   6   9.488 -12.515   9.110
   46   2HG   GLN   6           HG2      GLN   6  10.741 -12.102   7.946
   47   1HE2  GLN   6          HE22      GLN   6  10.756 -10.061  11.273
   48   2HE2  GLN   6          HE21      GLN   6  10.248 -11.665  11.055
   49    H    THR   7           HN       THR   7  10.500 -13.887   6.758
   50    HA   THR   7           HA       THR   7   8.854 -15.773   8.268
   51    HB   THR   7           HB       THR   7   9.951 -17.460   6.230
   52    HG1  THR   7           HG1      THR   7   8.427 -15.529   4.934
   53   1HG2  THR   7          HG23      THR   7   7.570 -17.480   7.350
   54   2HG2  THR   7          HG21      THR   7   7.134 -16.258   6.160
   55   3HG2  THR   7          HG22      THR   7   7.618 -17.867   5.632
   56    HA   PRO   8           HA       PRO   8   9.241 -18.166   8.213
   57   1HB   PRO   8           HB2      PRO   8   9.947 -19.509  10.623
   58   2HB   PRO   8           HB1      PRO   8  10.242 -20.095   8.986
   59   1HG   PRO   8           HG1      PRO   8  12.172 -19.104  10.923
   60   2HG   PRO   8           HG2      PRO   8  12.485 -19.834   9.349
   61   1HD   PRO   8           HD1      PRO   8  12.654 -17.029  10.081
   62   2HD   PRO   8           HD2      PRO   8  13.016 -17.771   8.510
   63    H    LEU   9           HN       LEU   9   7.618 -18.731  10.051
   64    HA   LEU   9           HA       LEU   9   6.908 -16.218  11.347
   65   1HB   LEU   9           HB2      LEU   9   5.670 -18.962  11.846
   66   2HB   LEU   9           HB1      LEU   9   4.896 -17.394  12.034
   67    HG   LEU   9           HG       LEU   9   5.860 -18.551   9.391
   68   1HD1  LEU   9          HD13      LEU   9   3.853 -19.682  10.465
   69   2HD1  LEU   9          HD11      LEU   9   3.020 -18.133  10.374
   70   3HD1  LEU   9          HD12      LEU   9   3.528 -18.947   8.898
   71   1HD2  LEU   9          HD23      LEU   9   4.461 -15.983  10.181
   72   2HD2  LEU   9          HD21      LEU   9   5.929 -16.170   9.227
   73   3HD2  LEU   9          HD22      LEU   9   4.371 -16.620   8.542
   74    H    SER  10           HN       SER  10   8.536 -19.125  12.250
   75    HA   SER  10           HA       SER  10   8.973 -17.998  14.970
   76   1HB   SER  10           HB2      SER  10   8.311 -20.945  14.441
   77   2HB   SER  10           HB1      SER  10   8.470 -20.158  16.023
   78    HG   SER  10           HG       SER  10   6.761 -18.743  15.354
   79    H    LEU  11           HN       LEU  11  10.983 -18.418  15.822
   80    HA   LEU  11           HA       LEU  11  12.795 -20.170  14.221
   81   1HB   LEU  11           HB2      LEU  11  12.881 -17.471  13.987
   82   2HB   LEU  11           HB1      LEU  11  13.881 -17.635  15.422
   83    HG   LEU  11           HG       LEU  11  15.061 -19.542  13.993
   84   1HD1  LEU  11          HD12      LEU  11  13.506 -17.899  12.009
   85   2HD1  LEU  11          HD13      LEU  11  15.081 -18.538  11.550
   86   3HD1  LEU  11          HD11      LEU  11  13.792 -19.637  12.028
   87   1HD2  LEU  11          HD22      LEU  11  15.995 -17.299  14.810
   88   2HD2  LEU  11          HD23      LEU  11  16.726 -17.940  13.343
   89   3HD2  LEU  11          HD21      LEU  11  15.538 -16.644  13.241
   90    HA   PRO  12           HA       PRO  12  12.955 -21.027  18.794
   91   1HB   PRO  12           HB2      PRO  12  13.019 -23.840  18.106
   92   2HB   PRO  12           HB1      PRO  12  11.725 -22.965  18.923
   93   1HG   PRO  12           HG1      PRO  12  11.752 -23.965  16.211
   94   2HG   PRO  12           HG2      PRO  12  10.446 -23.116  17.037
   95   1HD   PRO  12           HD1      PRO  12  12.178 -22.102  14.962
   96   2HD   PRO  12           HD2      PRO  12  10.868 -21.248  15.798
   97    H    VAL  13           HN       VAL  13  15.017 -20.663  19.367
   98    HA   VAL  13           HA       VAL  13  17.099 -22.570  18.411
   99    HB   VAL  13           HB       VAL  13  18.680 -20.604  18.151
  100   1HG1  VAL  13          HG13      VAL  13  17.410 -21.591  16.213
  101   2HG1  VAL  13          HG11      VAL  13  16.178 -20.355  16.448
  102   3HG1  VAL  13          HG12      VAL  13  17.815 -19.893  15.992
  103   1HG2  VAL  13          HG22      VAL  13  16.113 -19.023  18.546
  104   2HG2  VAL  13          HG23      VAL  13  17.515 -19.010  19.613
  105   3HG2  VAL  13          HG21      VAL  13  17.637 -18.335  17.990
  106    H    SER  14           HN       SER  14  19.173 -22.265  19.670
  107    HA   SER  14           HA       SER  14  18.476 -21.771  22.538
  108   1HB   SER  14           HB2      SER  14  19.712 -24.022  21.199
  109   2HB   SER  14           HB1      SER  14  20.918 -23.296  22.278
  110    HG   SER  14           HG       SER  14  18.248 -23.582  23.119
  111    H    LEU  15           HN       LEU  15  18.993 -19.600  22.504
  112    HA   LEU  15           HA       LEU  15  20.673 -17.863  21.688
  113   1HB   LEU  15           HB2      LEU  15  21.006 -18.709  24.599
  114   2HB   LEU  15           HB1      LEU  15  21.334 -17.110  23.942
  115    HG   LEU  15           HG       LEU  15  18.619 -18.481  23.970
  116   1HD1  LEU  15          HD13      LEU  15  19.797 -16.194  25.584
  117   2HD1  LEU  15          HD11      LEU  15  18.083 -16.596  25.564
  118   3HD1  LEU  15          HD12      LEU  15  19.250 -17.749  26.203
  119   1HD2  LEU  15          HD22      LEU  15  19.706 -16.045  22.642
  120   2HD2  LEU  15          HD23      LEU  15  18.355 -17.069  22.169
  121   3HD2  LEU  15          HD21      LEU  15  18.145 -15.859  23.429
  122    H    GLY  16           HN       GLY  16  22.278 -18.651  20.354
  123   1HA   GLY  16           HA1      GLY  16  24.915 -18.553  21.162
  124   2HA   GLY  16           HA2      GLY  16  24.488 -20.243  21.410
  125    H    ASP  17           HN       ASP  17  22.662 -20.381  19.171
  126    HA   ASP  17           HA       ASP  17  24.667 -20.812  17.071
  127   1HB   ASP  17           HB2      ASP  17  22.534 -22.274  17.708
  128   2HB   ASP  17           HB1      ASP  17  21.685 -21.144  16.658
  129    H    GLN  18           HN       GLN  18  23.736 -20.273  14.749
  130    HA   GLN  18           HA       GLN  18  23.459 -17.325  14.734
  131   1HB   GLN  18           HB2      GLN  18  24.061 -19.416  12.596
  132   2HB   GLN  18           HB1      GLN  18  23.838 -17.713  12.209
  133   1HG   GLN  18           HG1      GLN  18  25.729 -17.069  13.553
  134   2HG   GLN  18           HG2      GLN  18  25.838 -18.667  14.284
  135   1HE2  GLN  18          HE22      GLN  18  27.194 -20.136  11.235
  136   2HE2  GLN  18          HE21      GLN  18  26.047 -20.486  12.435
  137    H    ALA  19           HN       ALA  19  21.952 -16.312  13.228
  138    HA   ALA  19           HA       ALA  19  19.444 -17.920  12.887
  139   1HB   ALA  19           HB2      ALA  19  19.263 -16.192  14.693
  140   2HB   ALA  19           HB3      ALA  19  19.737 -14.946  13.542
  141   3HB   ALA  19           HB1      ALA  19  18.208 -15.796  13.340
  142    H    SER  20           HN       SER  20  17.989 -17.033  11.193
  143    HA   SER  20           HA       SER  20  19.155 -15.315   9.131
  144   1HB   SER  20           HB2      SER  20  18.730 -18.310   8.633
  145   2HB   SER  20           HB1      SER  20  19.003 -17.121   7.343
  146    HG   SER  20           HG       SER  20  20.812 -16.538   9.048
  147    H    ILE  21           HN       ILE  21  17.270 -14.126   9.495
  148    HA   ILE  21           HA       ILE  21  14.648 -15.396   9.060
  149    HB   ILE  21           HB       ILE  21  15.217 -12.416   9.272
  150   1HG1  ILE  21          HG11      ILE  21  14.705 -14.156  11.687
  151   2HG1  ILE  21          HG12      ILE  21  16.347 -13.881  11.119
  152   1HG2  ILE  21          HG22      ILE  21  12.901 -14.282   9.942
  153   2HG2  ILE  21          HG23      ILE  21  12.956 -12.623  10.527
  154   3HG2  ILE  21          HG21      ILE  21  12.904 -12.945   8.797
  155   1HD1  ILE  21          HD13      ILE  21  15.710 -11.360  11.125
  156   2HD1  ILE  21          HD11      ILE  21  14.353 -11.856  12.131
  157   3HD1  ILE  21          HD12      ILE  21  16.003 -12.135  12.679
  158    H    SER  22           HN       SER  22  13.642 -15.487   7.179
  159    HA   SER  22           HA       SER  22  14.862 -14.197   4.828
  160   1HB   SER  22           HB2      SER  22  14.026 -16.601   4.764
  161   2HB   SER  22           HB1      SER  22  12.374 -15.989   4.990
  162    HG   SER  22           HG       SER  22  13.524 -16.205   2.724
  163    H    CYS  23           HN       CYS  23  13.776 -12.812   3.425
  164    HA   CYS  23           HA       CYS  23  11.107 -11.815   4.038
  165   1HB   CYS  23           HB2      CYS  23  13.594 -10.392   4.892
  166   2HB   CYS  23           HB1      CYS  23  12.355  -9.402   4.167
  167    NH1  ARG  24           NH2      ARG  24   7.524 -13.502  -1.752
  168    NH2  ARG  24           NH1      ARG  24   6.671 -13.951   0.307
  169    H    ARG  24           HN       ARG  24  10.211 -11.030   2.205
  170    HA   ARG  24           HA       ARG  24  12.061 -10.086   0.060
  171   1HB   ARG  24           HB2      ARG  24   9.784 -11.357  -1.158
  172   2HB   ARG  24           HB1      ARG  24  11.470 -11.846  -1.265
  173   1HG   ARG  24           HG1      ARG  24  11.223 -13.065   0.888
  174   2HG   ARG  24           HG2      ARG  24   9.517 -12.633   0.911
  175   1HD   ARG  24           HD1      ARG  24  10.005 -13.709  -1.663
  176   2HD   ARG  24           HD2      ARG  24  10.825 -14.781  -0.532
  177    HE   ARG  24           HE       ARG  24   8.709 -15.450   0.280
  178   1HH1  ARG  24          HH21      ARG  24   8.285 -13.573  -2.397
  179   2HH1  ARG  24          HH22      ARG  24   6.682 -13.037  -2.022
  180   1HH2  ARG  24          HH11      ARG  24   6.789 -14.359   1.211
  181   2HH2  ARG  24          HH12      ARG  24   5.816 -13.486   0.076
  182    H    SER  25           HN       SER  25  10.601  -9.249  -1.821
  183    HA   SER  25           HA       SER  25   8.710  -7.302  -0.559
  184   1HB   SER  25           HB2      SER  25   9.307  -5.789  -2.426
  185   2HB   SER  25           HB1      SER  25  10.820  -6.424  -1.757
  186    HG   SER  25           HG       SER  25   9.780  -8.178  -3.507
  187    H    SER  26           HN       SER  26   6.833  -6.682  -1.792
  188    HA   SER  26           HA       SER  26   5.470  -8.953  -2.924
  189   1HB   SER  26           HB2      SER  26   4.360  -6.980  -1.738
  190   2HB   SER  26           HB1      SER  26   4.690  -6.003  -3.181
  191    HG   SER  26           HG       SER  26   3.727  -8.000  -4.273
  192    H    GLN  27           HN       GLN  27   7.417  -6.440  -4.276
  193    HA   GLN  27           HA       GLN  27   7.201  -7.706  -6.915
  194   1HB   GLN  27           HB2      GLN  27   5.548  -5.540  -6.329
  195   2HB   GLN  27           HB1      GLN  27   6.939  -4.754  -7.070
  196   1HG   GLN  27           HG1      GLN  27   6.733  -6.649  -8.864
  197   2HG   GLN  27           HG2      GLN  27   5.099  -6.827  -8.238
  198   1HE2  GLN  27          HE22      GLN  27   6.004  -3.141  -9.828
  199   2HE2  GLN  27          HE21      GLN  27   7.159  -3.932  -8.868
  200    H    SER  28           HN       SER  28   8.387  -4.729  -5.372
  201    HA   SER  28           HA       SER  28  11.150  -5.406  -5.551
  202   1HB   SER  28           HB2      SER  28   9.903  -4.308  -8.006
  203   2HB   SER  28           HB1      SER  28  11.292  -3.349  -7.457
  204    HG   SER  28           HG       SER  28  11.172  -6.162  -7.844
  205    H    LEU  29           HN       LEU  29  12.323  -3.985  -4.360
  206    HA   LEU  29           HA       LEU  29  10.835  -1.726  -3.185
  207   1HB   LEU  29           HB2      LEU  29  13.664  -2.735  -2.625
  208   2HB   LEU  29           HB1      LEU  29  12.774  -1.579  -1.643
  209    HG   LEU  29           HG       LEU  29  11.825  -4.409  -2.199
  210   1HD1  LEU  29          HD11      LEU  29  13.986  -3.881  -0.685
  211   2HD1  LEU  29          HD12      LEU  29  12.743  -3.503   0.505
  212   3HD1  LEU  29          HD13      LEU  29  12.812  -5.108  -0.219
  213   1HD2  LEU  29          HD22      LEU  29  10.840  -2.095  -0.528
  214   2HD2  LEU  29          HD23      LEU  29   9.936  -3.084  -1.670
  215   3HD2  LEU  29          HD21      LEU  29  10.408  -3.749  -0.111
  216    H    VAL  30           HN       VAL  30  13.845  -2.241  -4.981
  217    HA   VAL  30           HA       VAL  30  15.015   0.212  -5.093
  218    HB   VAL  30           HB       VAL  30  14.383  -1.662  -7.412
  219   1HG1  VAL  30          HG12      VAL  30  16.111   0.818  -7.256
  220   2HG1  VAL  30          HG13      VAL  30  16.506  -0.481  -8.379
  221   3HG1  VAL  30          HG11      VAL  30  14.964   0.356  -8.511
  222   1HG2  VAL  30          HG22      VAL  30  16.703  -1.332  -5.493
  223   2HG2  VAL  30          HG23      VAL  30  15.739  -2.775  -5.790
  224   3HG2  VAL  30          HG21      VAL  30  16.872  -2.206  -7.011
  225    H    HIS  31           HN       HIS  31  14.442   2.203  -5.528
  226    HA   HIS  31           HA       HIS  31  11.812   2.941  -6.367
  227   1HB   HIS  31           HB2      HIS  31  13.661   4.280  -5.054
  228   2HB   HIS  31           HB1      HIS  31  14.250   4.734  -6.650
  229    HD2  HIS  31           HD2      HIS  31  11.289   5.461  -4.236
  230    HE1  HIS  31           HE1      HIS  31  10.716   7.733  -7.645
  231    H    SER  32           HN       SER  32  11.430   4.440  -8.272
  232    HA   SER  32           HA       SER  32  11.726   3.096 -10.704
  233   1HB   SER  32           HB2      SER  32  11.591   6.132 -10.296
  234   2HB   SER  32           HB1      SER  32  11.108   5.259 -11.764
  235    HG   SER  32           HG       SER  32   9.325   4.703 -10.802
  236    H    ASN  33           HN       ASN  33  13.998   5.161  -9.089
  237    HA   ASN  33           HA       ASN  33  16.135   4.307 -10.862
  238   1HB   ASN  33           HB2      ASN  33  16.650   6.855 -11.401
  239   2HB   ASN  33           HB1      ASN  33  15.440   6.018 -12.368
  240   1HD2  ASN  33          HD22      ASN  33  14.221   8.834  -9.642
  241   2HD2  ASN  33          HD21      ASN  33  15.756   8.126  -9.481
  242    H    GLY  34           HN       GLY  34  16.281   3.754  -8.398
  243   1HA   GLY  34           HA1      GLY  34  18.199   5.720  -7.252
  244   2HA   GLY  34           HA2      GLY  34  16.858   5.185  -6.245
  245    H    ASN  35           HN       ASN  35  17.703   3.886  -4.762
  246    HA   ASN  35           HA       ASN  35  19.408   1.616  -5.707
  247   1HB   ASN  35           HB2      ASN  35  19.898   3.671  -3.619
  248   2HB   ASN  35           HB1      ASN  35  20.176   2.024  -3.064
  249   1HD2  ASN  35          HD22      ASN  35  22.337   3.005  -6.409
  250   2HD2  ASN  35          HD21      ASN  35  20.668   3.313  -6.373
  251    H    THR  36           HN       THR  36  19.581  -0.028  -3.765
  252    HA   THR  36           HA       THR  36  16.795  -0.807  -3.205
  253    HB   THR  36           HB       THR  36  19.239  -2.384  -2.277
  254    HG1  THR  36           HG1      THR  36  19.424  -3.094  -4.413
  255   1HG2  THR  36          HG23      THR  36  16.531  -3.041  -3.567
  256   2HG2  THR  36          HG21      THR  36  17.773  -4.250  -3.260
  257   3HG2  THR  36          HG22      THR  36  17.003  -3.419  -1.914
  258    OH   TYR  37           OH       TYR  37  18.322   5.740  -3.553
  259    H    TYR  37           HN       TYR  37  16.495   1.023  -1.675
  260    HA   TYR  37           HA       TYR  37  17.969   1.000   0.833
  261   1HB   TYR  37           HB2      TYR  37  15.213   2.225   0.395
  262   2HB   TYR  37           HB1      TYR  37  16.477   2.775   1.491
  263    HD1  TYR  37           HD1      TYR  37  18.578   3.796   0.530
  264    HD2  TYR  37           HD2      TYR  37  15.208   2.907  -1.901
  265    HE1  TYR  37           HE1      TYR  37  19.457   5.263  -1.229
  266    HE2  TYR  37           HE2      TYR  37  16.080   4.378  -3.654
  267    HH   TYR  37           HH       TYR  37  17.790   6.540  -3.567
  268    H    LEU  38           HN       LEU  38  17.685  -0.360   2.459
  269    HA   LEU  38           HA       LEU  38  14.976  -1.492   2.959
  270   1HB   LEU  38           HB2      LEU  38  16.855  -2.941   1.610
  271   2HB   LEU  38           HB1      LEU  38  17.326  -3.332   3.257
  272    HG   LEU  38           HG       LEU  38  14.558  -3.695   2.058
  273   1HD1  LEU  38          HD13      LEU  38  16.959  -5.408   2.392
  274   2HD1  LEU  38          HD11      LEU  38  15.440  -6.144   2.911
  275   3HD1  LEU  38          HD12      LEU  38  15.613  -5.561   1.260
  276   1HD2  LEU  38          HD22      LEU  38  15.673  -4.081   4.846
  277   2HD2  LEU  38          HD23      LEU  38  14.215  -3.221   4.362
  278   3HD2  LEU  38          HD21      LEU  38  14.261  -4.977   4.293
  279    H    ASN  39           HN       ASN  39  14.480  -1.543   5.085
  280    HA   ASN  39           HA       ASN  39  16.748  -1.294   7.009
  281   1HB   ASN  39           HB2      ASN  39  15.533   0.348   8.263
  282   2HB   ASN  39           HB1      ASN  39  15.269   0.816   6.588
  283   1HD2  ASN  39          HD22      ASN  39  12.145  -0.359   8.877
  284   2HD2  ASN  39          HD21      ASN  39  13.727  -0.326   9.491
  285    CH2  TRP  40           CH2      TRP  40  15.196  -9.776   7.266
  286    H    TRP  40           HN       TRP  40  16.832  -2.778   8.522
  287    HA   TRP  40           HA       TRP  40  14.546  -4.641   8.818
  288   1HB   TRP  40           HB2      TRP  40  17.487  -4.693   9.573
  289   2HB   TRP  40           HB1      TRP  40  16.369  -5.857  10.277
  290    HD1  TRP  40           HD1      TRP  40  17.756  -4.753   6.818
  291    HE1  TRP  40           HE1      TRP  40  17.395  -6.733   5.291
  292    HE3  TRP  40           HE3      TRP  40  15.165  -7.661   9.892
  293    HZ2  TRP  40           HZ2      TRP  40  16.121  -9.383   5.381
  294    HZ3  TRP  40           HZ3      TRP  40  14.365  -9.892   9.232
  295    HH2  TRP  40           HH2      TRP  40  14.858 -10.763   6.981
  296    OH   TYR  41           OH       TYR  41  13.426   2.151  13.146
  297    H    TYR  41           HN       TYR  41  14.338  -5.517  11.182
  298    HA   TYR  41           HA       TYR  41  14.806  -3.510  13.260
  299   1HB   TYR  41           HB2      TYR  41  12.239  -3.711  11.790
  300   2HB   TYR  41           HB1      TYR  41  12.045  -3.807  13.537
  301    HD1  TYR  41           HD1      TYR  41  13.708  -2.039  14.809
  302    HD2  TYR  41           HD2      TYR  41  12.103  -1.552  10.906
  303    HE1  TYR  41           HE1      TYR  41  14.025   0.382  14.985
  304    HE2  TYR  41           HE2      TYR  41  12.412   0.875  11.084
  305    HH   TYR  41           HH       TYR  41  14.155   2.393  12.570
  306    H    LEU  42           HN       LEU  42  13.804  -4.142  15.328
  307    HA   LEU  42           HA       LEU  42  13.062  -6.970  15.649
  308   1HB   LEU  42           HB2      LEU  42  15.393  -7.353  15.859
  309   2HB   LEU  42           HB1      LEU  42  15.699  -5.758  16.521
  310    HG   LEU  42           HG       LEU  42  14.653  -6.415  18.655
  311   1HD1  LEU  42          HD13      LEU  42  13.767  -8.689  16.990
  312   2HD1  LEU  42          HD11      LEU  42  14.370  -9.159  18.575
  313   3HD1  LEU  42          HD12      LEU  42  13.038  -8.017  18.444
  314   1HD2  LEU  42          HD22      LEU  42  17.110  -7.052  17.938
  315   2HD2  LEU  42          HD23      LEU  42  16.443  -7.715  19.426
  316   3HD2  LEU  42          HD21      LEU  42  16.488  -8.699  17.967
  317    H    GLN  43           HN       GLN  43  11.347  -6.854  16.951
  318    HA   GLN  43           HA       GLN  43  11.105  -4.571  18.820
  319   1HB   GLN  43           HB2      GLN  43   9.218  -5.292  17.272
  320   2HB   GLN  43           HB1      GLN  43   9.091  -6.776  18.209
  321   1HG   GLN  43           HG1      GLN  43   8.072  -5.720  19.966
  322   2HG   GLN  43           HG2      GLN  43   9.114  -4.306  19.841
  323   1HE2  GLN  43          HE22      GLN  43   5.492  -4.310  18.014
  324   2HE2  GLN  43          HE21      GLN  43   6.052  -5.676  18.849
  325    H    LYS  44           HN       LYS  44  11.289  -4.698  20.939
  326    HA   LYS  44           HA       LYS  44  11.501  -7.411  22.183
  327   1HB   LYS  44           HB2      LYS  44  13.472  -5.487  22.033
  328   2HB   LYS  44           HB1      LYS  44  12.718  -5.053  23.561
  329   1HG   LYS  44           HG1      LYS  44  13.976  -6.694  24.495
  330   2HG   LYS  44           HG2      LYS  44  12.903  -7.836  23.695
  331   1HD   LYS  44           HD1      LYS  44  15.092  -8.459  22.985
  332   2HD   LYS  44           HD2      LYS  44  14.421  -7.562  21.629
  333   1HE   LYS  44           HE1      LYS  44  16.542  -6.576  21.886
  334   2HE   LYS  44           HE2      LYS  44  15.505  -5.477  22.787
  335   1HZ   LYS  44           HZ1      LYS  44  16.097  -7.143  24.715
  336   2HZ   LYS  44           HZ2      LYS  44  17.476  -7.394  23.758
  337    H    ALA  45           HN       ALA  45  11.537  -6.493  24.846
  338    HA   ALA  45           HA       ALA  45   8.736  -6.302  25.386
  339   1HB   ALA  45           HB1      ALA  45  10.474  -7.175  26.993
  340   2HB   ALA  45           HB2      ALA  45  11.081  -5.535  27.192
  341   3HB   ALA  45           HB3      ALA  45   9.456  -5.944  27.732
  342    H    GLY  46           HN       GLY  46  11.262  -3.846  25.929
  343   1HA   GLY  46           HA1      GLY  46   9.351  -1.730  25.118
  344   2HA   GLY  46           HA2      GLY  46   9.978  -1.642  26.763
  345    H    GLN  47           HN       GLN  47  11.396  -2.421  23.604
  346    HA   GLN  47           HA       GLN  47  13.659  -0.599  24.261
  347   1HB   GLN  47           HB2      GLN  47  14.372  -2.840  23.699
  348   2HB   GLN  47           HB1      GLN  47  13.295  -2.914  22.316
  349   1HG   GLN  47           HG1      GLN  47  15.466  -2.516  21.400
  350   2HG   GLN  47           HG2      GLN  47  14.660  -0.955  21.341
  351   1HE2  GLN  47          HE22      GLN  47  18.117  -0.784  22.967
  352   2HE2  GLN  47          HE21      GLN  47  17.594  -1.587  21.565
  353    H    SER  48           HN       SER  48  14.081   1.166  23.086
  354    HA   SER  48           HA       SER  48  12.128   1.879  20.979
  355   1HB   SER  48           HB2      SER  48  13.772   3.364  22.907
  356   2HB   SER  48           HB1      SER  48  13.965   4.021  21.268
  357    HG   SER  48           HG       SER  48  12.083   4.832  22.356
  358    HA   PRO  49           HA       PRO  49  16.175   2.262  18.490
  359   1HB   PRO  49           HB2      PRO  49  18.473   1.268  19.851
  360   2HB   PRO  49           HB1      PRO  49  18.090   2.968  19.581
  361   1HG   PRO  49           HG1      PRO  49  17.976   1.449  22.079
  362   2HG   PRO  49           HG2      PRO  49  17.824   3.190  21.844
  363   1HD   PRO  49           HD1      PRO  49  15.724   1.316  22.424
  364   2HD   PRO  49           HD2      PRO  49  15.569   3.053  22.120
  365    H    LYS  50           HN       LYS  50  15.324   0.514  17.344
  366    HA   LYS  50           HA       LYS  50  16.508  -2.142  17.993
  367   1HB   LYS  50           HB2      LYS  50  14.112  -2.595  16.584
  368   2HB   LYS  50           HB1      LYS  50  14.361  -2.826  18.305
  369   1HG   LYS  50           HG1      LYS  50  13.651  -0.579  18.786
  370   2HG   LYS  50           HG2      LYS  50  13.602  -0.167  17.078
  371   1HD   LYS  50           HD1      LYS  50  11.514  -1.017  16.852
  372   2HD   LYS  50           HD2      LYS  50  11.975  -2.521  17.640
  373   1HE   LYS  50           HE1      LYS  50  11.408  -1.740  19.764
  374   2HE   LYS  50           HE2      LYS  50  11.645  -0.054  19.319
  375   1HZ   LYS  50           HZ1      LYS  50   9.540  -1.400  17.873
  376   2HZ   LYS  50           HZ2      LYS  50   9.262  -1.232  19.541
  377    H    LEU  51           HN       LEU  51  17.256   0.041  16.054
  378    HA   LEU  51           HA       LEU  51  16.753  -1.218  13.435
  379   1HB   LEU  51           HB2      LEU  51  16.766   1.250  13.612
  380   2HB   LEU  51           HB1      LEU  51  18.386   1.221  14.293
  381    HG   LEU  51           HG       LEU  51  19.139   0.075  12.130
  382   1HD1  LEU  51          HD12      LEU  51  16.861  -0.624  11.397
  383   2HD1  LEU  51          HD13      LEU  51  16.413   1.069  11.213
  384   3HD1  LEU  51          HD11      LEU  51  17.656   0.369  10.180
  385   1HD2  LEU  51          HD23      LEU  51  18.042   2.896  12.205
  386   2HD2  LEU  51          HD21      LEU  51  19.711   2.374  12.415
  387   3HD2  LEU  51          HD22      LEU  51  18.956   2.290  10.827
  388    H    LEU  52           HN       LEU  52  18.223  -2.356  12.262
  389    HA   LEU  52           HA       LEU  52  20.929  -2.757  13.485
  390   1HB   LEU  52           HB2      LEU  52  19.057  -4.787  12.182
  391   2HB   LEU  52           HB1      LEU  52  20.735  -5.139  12.577
  392    HG   LEU  52           HG       LEU  52  18.869  -4.051  14.687
  393   1HD1  LEU  52          HD11      LEU  52  19.222  -6.953  13.857
  394   2HD1  LEU  52          HD12      LEU  52  18.430  -6.427  15.339
  395   3HD1  LEU  52          HD13      LEU  52  17.731  -6.021  13.775
  396   1HD2  LEU  52          HD21      LEU  52  21.479  -5.566  14.589
  397   2HD2  LEU  52          HD22      LEU  52  21.109  -4.068  15.437
  398   3HD2  LEU  52          HD23      LEU  52  20.483  -5.600  16.040
  399    H    ILE  53           HN       ILE  53  19.005  -2.815  10.538
  400    HA   ILE  53           HA       ILE  53  21.445  -2.064   8.990
  401    HB   ILE  53           HB       ILE  53  19.368  -4.172   8.209
  402   1HG1  ILE  53          HG11      ILE  53  21.106  -4.836   9.937
  403   2HG1  ILE  53          HG12      ILE  53  21.028  -5.832   8.490
  404   1HG2  ILE  53          HG22      ILE  53  21.521  -2.728   6.707
  405   2HG2  ILE  53          HG23      ILE  53  21.384  -4.457   6.394
  406   3HG2  ILE  53          HG21      ILE  53  20.007  -3.396   6.110
  407   1HD1  ILE  53          HD11      ILE  53  22.812  -3.792   7.820
  408   2HD1  ILE  53          HD12      ILE  53  23.218  -4.188   9.480
  409   3HD1  ILE  53          HD13      ILE  53  23.241  -5.444   8.246
  410    OH   TYR  54           OH       TYR  54  24.475   3.746   7.713
  411    H    TYR  54           HN       TYR  54  20.987  -0.667   7.228
  412    HA   TYR  54           HA       TYR  54  18.133  -0.049   6.712
  413   1HB   TYR  54           HB2      TYR  54  18.541   2.398   7.007
  414   2HB   TYR  54           HB1      TYR  54  18.828   1.519   8.503
  415    HD1  TYR  54           HD2      TYR  54  21.195   1.007   9.194
  416    HD2  TYR  54           HD1      TYR  54  20.332   3.561   5.904
  417    HE1  TYR  54           HE2      TYR  54  23.471   1.903   9.285
  418    HE2  TYR  54           HE1      TYR  54  22.610   4.468   6.013
  419    HH   TYR  54           HH       TYR  54  25.055   3.120   7.269
  420    H    LYS  55           HN       LYS  55  20.191  -1.300   5.095
  421    HA   LYS  55           HA       LYS  55  19.676   0.025   2.623
  422   1HB   LYS  55           HB2      LYS  55  21.456   1.550   3.872
  423   2HB   LYS  55           HB1      LYS  55  22.597   0.311   3.364
  424   1HG   LYS  55           HG1      LYS  55  22.127   0.670   1.054
  425   2HG   LYS  55           HG2      LYS  55  20.665   1.581   1.411
  426   1HD   LYS  55           HD1      LYS  55  23.273   2.590   2.496
  427   2HD   LYS  55           HD2      LYS  55  22.934   2.830   0.788
  428   1HE   LYS  55           HE1      LYS  55  21.607   4.578   1.310
  429   2HE   LYS  55           HE2      LYS  55  20.559   3.501   2.225
  430   1HZ   LYS  55           HZ1      LYS  55  22.037   5.527   3.253
  431   2HZ   LYS  55           HZ2      LYS  55  21.360   4.244   4.140
  432    H    VAL  56           HN       VAL  56  19.359  -2.533   3.128
  433    HA   VAL  56           HA       VAL  56  20.082  -4.750   2.693
  434    HB   VAL  56           HB       VAL  56  21.031  -3.249   0.198
  435   1HG1  VAL  56          HG12      VAL  56  20.340  -6.157   0.740
  436   2HG1  VAL  56          HG13      VAL  56  20.424  -5.485  -0.886
  437   3HG1  VAL  56          HG11      VAL  56  21.861  -5.514   0.129
  438   1HG2  VAL  56          HG22      VAL  56  18.663  -2.791   0.853
  439   2HG2  VAL  56          HG23      VAL  56  18.776  -3.683  -0.658
  440   3HG2  VAL  56          HG21      VAL  56  18.344  -4.521   0.826
  441    H    SER  57           HN       SER  57  21.749  -4.874   4.292
  442    HA   SER  57           HA       SER  57  23.890  -5.636   4.872
  443   1HB   SER  57           HB2      SER  57  23.876  -6.086   2.130
  444   2HB   SER  57           HB1      SER  57  25.230  -4.953   2.294
  445    HG   SER  57           HG       SER  57  24.813  -7.176   4.009
  446    H    ASN  58           HN       ASN  58  23.527  -3.617   6.036
  447    HA   ASN  58           HA       ASN  58  25.908  -2.024   6.038
  448   1HB   ASN  58           HB2      ASN  58  25.244  -0.494   4.439
  449   2HB   ASN  58           HB1      ASN  58  23.597  -1.104   4.434
  450   1HD2  ASN  58          HD22      ASN  58  22.364   1.484   6.441
  451   2HD2  ASN  58          HD21      ASN  58  22.030   0.099   5.523
  452    NH1  ARG  59           NH2      ARG  59  24.013  -4.486  11.812
  453    NH2  ARG  59           NH1      ARG  59  23.836  -6.251  10.399
  454    H    ARG  59           HN       ARG  59  26.096  -2.185   8.165
  455    HA   ARG  59           HA       ARG  59  23.827  -2.133   9.990
  456   1HB   ARG  59           HB2      ARG  59  26.720  -1.752  10.807
  457   2HB   ARG  59           HB1      ARG  59  25.446  -2.603  11.667
  458   1HG   ARG  59           HG1      ARG  59  25.462  -4.154   9.511
  459   2HG   ARG  59           HG2      ARG  59  27.089  -3.512   9.323
  460   1HD   ARG  59           HD1      ARG  59  27.741  -5.112  10.799
  461   2HD   ARG  59           HD2      ARG  59  26.965  -4.126  12.037
  462    HE   ARG  59           HE       ARG  59  26.089  -6.641  11.613
  463   1HH1  ARG  59          HH21      ARG  59  24.583  -3.926  12.410
  464   2HH1  ARG  59          HH22      ARG  59  23.045  -4.269  11.697
  465   1HH2  ARG  59          HH11      ARG  59  24.274  -7.018   9.932
  466   2HH2  ARG  59          HH12      ARG  59  22.864  -6.067  10.258
  467    H    PHE  60           HN       PHE  60  23.710  -0.764  11.842
  468    HA   PHE  60           HA       PHE  60  24.056   2.075  11.102
  469   1HB   PHE  60           HB2      PHE  60  21.862   1.210  12.005
  470   2HB   PHE  60           HB1      PHE  60  22.674   0.780  13.503
  471    HD1  PHE  60           HD1      PHE  60  22.574   3.793  11.256
  472    HD2  PHE  60           HD2      PHE  60  22.326   2.296  15.237
  473    HE1  PHE  60           HE1      PHE  60  22.241   6.076  12.097
  474    HE2  PHE  60           HE2      PHE  60  21.994   4.581  16.073
  475    HZ   PHE  60           HZ       PHE  60  21.950   6.472  14.505
  476    H    SER  61           HN       SER  61  24.646   3.530  13.058
  477    HA   SER  61           HA       SER  61  27.336   2.978  13.797
  478   1HB   SER  61           HB2      SER  61  26.983   4.930  15.411
  479   2HB   SER  61           HB1      SER  61  26.416   5.283  13.767
  480    HG   SER  61           HG       SER  61  24.405   5.179  14.429
  481    H    GLY  62           HN       GLY  62  24.376   2.737  15.771
  482   1HA   GLY  62           HA1      GLY  62  25.948   1.522  17.965
  483   2HA   GLY  62           HA2      GLY  62  24.250   1.963  18.043
  484    H    VAL  63           HN       VAL  63  26.091  -0.193  15.855
  485    HA   VAL  63           HA       VAL  63  24.431  -2.452  16.856
  486    HB   VAL  63           HB       VAL  63  24.798  -1.787  13.896
  487   1HG1  VAL  63          HG12      VAL  63  23.377  -4.004  15.401
  488   2HG1  VAL  63          HG13      VAL  63  23.008  -3.623  13.724
  489   3HG1  VAL  63          HG11      VAL  63  24.624  -4.168  14.169
  490   1HG2  VAL  63          HG23      VAL  63  23.219  -0.256  15.117
  491   2HG2  VAL  63          HG21      VAL  63  22.417  -1.245  13.900
  492   3HG2  VAL  63          HG22      VAL  63  22.288  -1.668  15.606
  493    HA   PRO  64           HA       PRO  64  28.486  -4.247  16.689
  494   1HB   PRO  64           HB2      PRO  64  27.409  -6.802  17.464
  495   2HB   PRO  64           HB1      PRO  64  28.197  -5.620  18.509
  496   1HG   PRO  64           HG1      PRO  64  25.382  -6.310  18.400
  497   2HG   PRO  64           HG2      PRO  64  26.182  -5.183  19.496
  498   1HD   PRO  64           HD1      PRO  64  24.480  -4.561  17.242
  499   2HD   PRO  64           HD2      PRO  64  25.267  -3.429  18.358
  500    H    ASP  65           HN       ASP  65  29.517  -6.097  15.625
  501    HA   ASP  65           HA       ASP  65  28.557  -6.465  12.931
  502   1HB   ASP  65           HB2      ASP  65  30.547  -8.022  12.785
  503   2HB   ASP  65           HB1      ASP  65  30.969  -6.465  13.492
  504    NH1  ARG  66           NH1      ARG  66  30.088  -9.425  19.792
  505    NH2  ARG  66           NH2      ARG  66  30.971  -9.287  17.703
  506    H    ARG  66           HN       ARG  66  27.696  -7.986  15.777
  507    HA   ARG  66           HA       ARG  66  27.435 -10.714  15.018
  508   1HB   ARG  66           HB2      ARG  66  25.661  -9.054  16.867
  509   2HB   ARG  66           HB1      ARG  66  25.751 -10.810  16.855
  510   1HG   ARG  66           HG1      ARG  66  27.976  -8.871  17.565
  511   2HG   ARG  66           HG2      ARG  66  27.180 -10.012  18.643
  512   1HD   ARG  66           HD1      ARG  66  28.021 -11.883  17.174
  513   2HD   ARG  66           HD2      ARG  66  28.947 -10.687  16.267
  514    HE   ARG  66           HE       ARG  66  29.858 -11.829  18.662
  515   1HH1  ARG  66          HH11      ARG  66  29.508  -9.909  20.445
  516   2HH1  ARG  66          HH12      ARG  66  30.556  -8.585  20.065
  517   1HH2  ARG  66          HH21      ARG  66  31.056  -9.667  16.781
  518   2HH2  ARG  66          HH22      ARG  66  31.452  -8.444  17.939
  519    H    PHE  67           HN       PHE  67  26.017  -8.183  13.485
  520    HA   PHE  67           HA       PHE  67  23.680  -9.875  12.682
  521   1HB   PHE  67           HB2      PHE  67  23.932  -6.840  12.906
  522   2HB   PHE  67           HB1      PHE  67  22.556  -7.645  12.163
  523    HD1  PHE  67           HD2      PHE  67  24.482  -7.389  15.348
  524    HD2  PHE  67           HD1      PHE  67  20.810  -8.518  13.507
  525    HE1  PHE  67           HE2      PHE  67  23.456  -7.674  17.561
  526    HE2  PHE  67           HE1      PHE  67  19.788  -8.784  15.717
  527    HZ   PHE  67           HZ       PHE  67  21.108  -8.374  17.749
  528    H    SER  68           HN       SER  68  23.016  -9.696  10.478
  529    HA   SER  68           HA       SER  68  24.678  -8.226   8.577
  530   1HB   SER  68           HB2      SER  68  26.176 -10.152   8.962
  531   2HB   SER  68           HB1      SER  68  24.828 -11.286   8.737
  532    HG   SER  68           HG       SER  68  26.187 -10.767   6.819
  533    H    GLY  69           HN       GLY  69  23.157  -7.475   7.297
  534   1HA   GLY  69           HA1      GLY  69  20.953  -9.309   6.437
  535   2HA   GLY  69           HA2      GLY  69  20.784  -7.558   6.555
  536    H    SER  70           HN       SER  70  20.442  -9.414   4.237
  537    HA   SER  70           HA       SER  70  21.854  -7.740   2.301
  538   1HB   SER  70           HB2      SER  70  23.452  -9.711   3.129
  539   2HB   SER  70           HB1      SER  70  22.456 -10.701   2.045
  540    HG   SER  70           HG       SER  70  23.918  -8.345   1.450
  541    H    GLY  71           HN       GLY  71  21.593  -8.962   0.012
  542   1HA   GLY  71           HA1      GLY  71  19.633 -10.687  -0.734
  543   2HA   GLY  71           HA2      GLY  71  18.676  -9.290  -0.260
  544    H    SER  72           HN       SER  72  18.425 -10.067  -2.803
  545    HA   SER  72           HA       SER  72  20.311  -8.482  -4.450
  546   1HB   SER  72           HB2      SER  72  19.231 -10.903  -4.966
  547   2HB   SER  72           HB1      SER  72  17.950  -9.905  -5.676
  548    HG   SER  72           HG       SER  72  20.225 -10.443  -6.777
  549    H    GLY  73           HN       GLY  73  16.815  -8.848  -4.963
  550   1HA   GLY  73           HA1      GLY  73  16.521  -5.890  -4.720
  551   2HA   GLY  73           HA2      GLY  73  16.024  -6.667  -6.218
  552    H    THR  74           HN       THR  74  14.759  -8.922  -5.370
  553    HA   THR  74           HA       THR  74  12.511  -7.812  -3.738
  554    HB   THR  74           HB       THR  74  11.001  -9.239  -5.068
  555    HG1  THR  74           HG1      THR  74  12.282 -11.051  -5.167
  556   1HG2  THR  74          HG22      THR  74  12.142  -7.194  -6.293
  557   2HG2  THR  74          HG23      THR  74  13.145  -8.411  -7.077
  558   3HG2  THR  74          HG21      THR  74  11.400  -8.424  -7.313
  559    H    ASP  75           HN       ASP  75  15.017  -9.417  -3.079
  560    HA   ASP  75           HA       ASP  75  13.671 -11.232  -1.183
  561   1HB   ASP  75           HB2      ASP  75  14.770 -12.200  -3.615
  562   2HB   ASP  75           HB1      ASP  75  15.977 -12.585  -2.392
  563    H    PHE  76           HN       PHE  76  14.693 -11.267   0.728
  564    HA   PHE  76           HA       PHE  76  17.569 -10.569   0.889
  565   1HB   PHE  76           HB2      PHE  76  15.415  -9.087   2.475
  566   2HB   PHE  76           HB1      PHE  76  17.145  -8.771   2.534
  567    HD1  PHE  76           HD2      PHE  76  14.113  -8.521   0.433
  568    HD2  PHE  76           HD1      PHE  76  18.242  -7.525   0.757
  569    HE1  PHE  76           HE2      PHE  76  13.891  -6.974  -1.460
  570    HE2  PHE  76           HE1      PHE  76  18.017  -5.986  -1.142
  571    HZ   PHE  76           HZ       PHE  76  15.841  -5.702  -2.246
  572    H    THR  77           HN       THR  77  18.366 -10.742   3.189
  573    HA   THR  77           HA       THR  77  16.753 -12.466   4.959
  574    HB   THR  77           HB       THR  77  19.489 -13.424   3.937
  575    HG1  THR  77           HG1      THR  77  16.821 -13.770   3.117
  576   1HG2  THR  77          HG23      THR  77  17.176 -14.763   5.454
  577   2HG2  THR  77          HG21      THR  77  18.591 -15.620   4.855
  578   3HG2  THR  77          HG22      THR  77  18.764 -14.421   6.132
  579    H    LEU  78           HN       LEU  78  17.360 -12.353   7.069
  580    HA   LEU  78           HA       LEU  78  19.700 -10.593   7.691
  581   1HB   LEU  78           HB2      LEU  78  17.447  -9.686   8.340
  582   2HB   LEU  78           HB1      LEU  78  17.164 -11.118   9.318
  583    HG   LEU  78           HG       LEU  78  19.676  -9.534   9.792
  584   1HD1  LEU  78          HD11      LEU  78  16.924  -8.791  10.833
  585   2HD1  LEU  78          HD12      LEU  78  18.442  -8.077  11.368
  586   3HD1  LEU  78          HD13      LEU  78  17.891  -7.836   9.714
  587   1HD2  LEU  78          HD21      LEU  78  17.923 -11.471  11.223
  588   2HD2  LEU  78          HD22      LEU  78  19.676 -11.313  11.248
  589   3HD2  LEU  78          HD23      LEU  78  18.680 -10.225  12.209
  590    H    LYS  79           HN       LYS  79  21.352 -11.784   8.374
  591    HA   LYS  79           HA       LYS  79  20.745 -14.184  10.022
  592   1HB   LYS  79           HB2      LYS  79  23.495 -14.170   9.214
  593   2HB   LYS  79           HB1      LYS  79  22.228 -15.259   8.670
  594   1HG   LYS  79           HG1      LYS  79  21.547 -13.373   7.039
  595   2HG   LYS  79           HG2      LYS  79  23.105 -12.647   7.425
  596   1HD   LYS  79           HD1      LYS  79  24.307 -14.501   6.556
  597   2HD   LYS  79           HD2      LYS  79  22.886 -15.539   6.582
  598   1HE   LYS  79           HE1      LYS  79  21.838 -14.010   4.862
  599   2HE   LYS  79           HE2      LYS  79  23.383 -13.174   4.748
  600   1HZ   LYS  79           HZ1      LYS  79  24.411 -15.027   3.854
  601   2HZ   LYS  79           HZ2      LYS  79  23.211 -16.095   4.399
  602    H    ILE  80           HN       ILE  80  21.985 -14.624  11.857
  603    HA   ILE  80           HA       ILE  80  23.520 -12.297  12.941
  604    HB   ILE  80           HB       ILE  80  21.569 -14.163  14.380
  605   1HG1  ILE  80          HG11      ILE  80  21.489 -11.142  14.130
  606   2HG1  ILE  80          HG12      ILE  80  20.657 -12.217  13.012
  607   1HG2  ILE  80          HG21      ILE  80  23.867 -12.662  15.384
  608   2HG2  ILE  80          HG22      ILE  80  22.390 -11.968  16.040
  609   3HG2  ILE  80          HG23      ILE  80  22.745 -13.673  16.290
  610   1HD1  ILE  80          HD13      ILE  80  20.241 -12.651  15.948
  611   2HD1  ILE  80          HD11      ILE  80  19.428 -11.288  15.188
  612   3HD1  ILE  80          HD12      ILE  80  19.128 -12.924  14.612
  613    H    SER  81           HN       SER  81  25.360 -12.697  13.945
  614    HA   SER  81           HA       SER  81  26.599 -15.211  13.396
  615   1HB   SER  81           HB2      SER  81  27.613 -12.755  13.795
  616   2HB   SER  81           HB1      SER  81  27.776 -13.354  15.457
  617    HG   SER  81           HG       SER  81  28.585 -15.350  14.296
  618    NH1  ARG  82           NH1      ARG  82  27.102 -14.640  22.101
  619    NH2  ARG  82           NH2      ARG  82  28.593 -12.939  21.926
  620    H    ARG  82           HN       ARG  82  24.860 -13.998  16.110
  621    HA   ARG  82           HA       ARG  82  24.790 -16.585  17.375
  622   1HB   ARG  82           HB2      ARG  82  26.022 -15.944  19.462
  623   2HB   ARG  82           HB1      ARG  82  27.089 -15.897  18.065
  624   1HG   ARG  82           HG1      ARG  82  26.230 -13.354  17.974
  625   2HG   ARG  82           HG2      ARG  82  25.991 -13.636  19.693
  626   1HD   ARG  82           HD1      ARG  82  28.594 -14.189  18.224
  627   2HD   ARG  82           HD2      ARG  82  28.268 -12.727  19.152
  628    HE   ARG  82           HE       ARG  82  28.969 -15.298  20.273
  629   1HH1  ARG  82          HH11      ARG  82  26.699 -15.466  21.714
  630   2HH1  ARG  82          HH12      ARG  82  26.783 -14.293  22.983
  631   1HH2  ARG  82          HH21      ARG  82  29.316 -12.488  21.409
  632   2HH2  ARG  82          HH22      ARG  82  28.288 -12.558  22.800
  633    H    VAL  83           HN       VAL  83  22.722 -16.566  17.996
  634    HA   VAL  83           HA       VAL  83  21.325 -14.106  18.594
  635    HB   VAL  83           HB       VAL  83  20.502 -16.983  19.196
  636   1HG1  VAL  83          HG11      VAL  83  19.145 -15.084  20.212
  637   2HG1  VAL  83          HG12      VAL  83  18.807 -14.533  18.574
  638   3HG1  VAL  83          HG13      VAL  83  18.232 -16.109  19.109
  639   1HG2  VAL  83          HG23      VAL  83  20.838 -15.504  16.667
  640   2HG2  VAL  83          HG21      VAL  83  20.664 -17.237  16.938
  641   3HG2  VAL  83          HG22      VAL  83  19.235 -16.212  16.859
  642    H    GLU  84           HN       GLU  84  21.739 -13.000  20.378
  643    HA   GLU  84           HA       GLU  84  22.501 -14.398  22.870
  644   1HB   GLU  84           HB2      GLU  84  22.201 -11.413  22.274
  645   2HB   GLU  84           HB1      GLU  84  22.970 -12.103  23.698
  646   1HG   GLU  84           HG1      GLU  84  24.054 -13.141  21.154
  647   2HG   GLU  84           HG2      GLU  84  24.294 -11.412  21.370
  648    H    ALA  85           HN       ALA  85  21.493 -13.435  24.933
  649    HA   ALA  85           HA       ALA  85  18.729 -14.092  24.988
  650   1HB   ALA  85           HB2      ALA  85  20.510 -12.489  26.871
  651   2HB   ALA  85           HB3      ALA  85  18.831 -12.853  27.261
  652   3HB   ALA  85           HB1      ALA  85  19.990 -14.162  27.052
  653    H    GLU  86           HN       GLU  86  20.351 -10.997  24.624
  654    HA   GLU  86           HA       GLU  86  17.880  -9.461  24.802
  655   1HB   GLU  86           HB2      GLU  86  19.498  -7.649  23.767
  656   2HB   GLU  86           HB1      GLU  86  19.813  -8.215  25.402
  657   1HG   GLU  86           HG1      GLU  86  21.072  -9.863  23.290
  658   2HG   GLU  86           HG2      GLU  86  21.677  -8.212  23.378
  659    H    ASP  87           HN       ASP  87  19.370 -11.297  22.372
  660    HA   ASP  87           HA       ASP  87  18.446  -9.742  20.091
  661   1HB   ASP  87           HB2      ASP  87  20.348 -11.528  20.177
  662   2HB   ASP  87           HB1      ASP  87  19.059 -12.726  20.104
  663    H    LEU  88           HN       LEU  88  17.093 -12.185  22.148
  664    HA   LEU  88           HA       LEU  88  15.055 -13.261  20.530
  665   1HB   LEU  88           HB2      LEU  88  14.892 -12.473  23.477
  666   2HB   LEU  88           HB1      LEU  88  13.833 -13.628  22.677
  667    HG   LEU  88           HG       LEU  88  16.846 -13.963  22.740
  668   1HD1  LEU  88          HD13      LEU  88  15.929 -13.902  25.057
  669   2HD1  LEU  88          HD11      LEU  88  14.768 -15.150  24.614
  670   3HD1  LEU  88          HD12      LEU  88  16.490 -15.512  24.621
  671   1HD2  LEU  88          HD22      LEU  88  14.493 -15.796  22.159
  672   2HD2  LEU  88          HD23      LEU  88  15.721 -15.261  21.016
  673   3HD2  LEU  88          HD21      LEU  88  16.152 -16.359  22.321
  674    H    GLY  89           HN       GLY  89  12.888 -12.718  20.175
  675   1HA   GLY  89           HA1      GLY  89  11.161 -10.880  20.961
  676   2HA   GLY  89           HA2      GLY  89  12.363  -9.788  20.283
  677    H    ILE  90           HN       ILE  90  10.084  -9.454  19.144
  678    HA   ILE  90           HA       ILE  90   9.682 -11.290  16.874
  679    HB   ILE  90           HB       ILE  90   8.366  -8.576  17.315
  680   1HG1  ILE  90          HG11      ILE  90   8.101  -9.747  19.421
  681   2HG1  ILE  90          HG12      ILE  90   6.574  -9.817  18.555
  682   1HG2  ILE  90          HG22      ILE  90   7.475 -11.195  16.009
  683   2HG2  ILE  90          HG23      ILE  90   6.468  -9.757  16.144
  684   3HG2  ILE  90          HG21      ILE  90   7.927  -9.722  15.159
  685   1HD1  ILE  90          HD11      ILE  90   8.654 -12.035  18.527
  686   2HD1  ILE  90          HD12      ILE  90   7.226 -12.023  19.556
  687   3HD1  ILE  90          HD13      ILE  90   7.048 -12.098  17.807
  688    OH   TYR  91           OH       TYR  91  17.960  -9.641  16.275
  689    H    TYR  91           HN       TYR  91  11.150 -11.126  15.288
  690    HA   TYR  91           HA       TYR  91  12.487  -8.599  14.714
  691   1HB   TYR  91           HB2      TYR  91  12.649 -11.425  13.787
  692   2HB   TYR  91           HB1      TYR  91  13.100 -10.223  12.578
  693    HD1  TYR  91           HD1      TYR  91  13.814 -11.412  16.022
  694    HD2  TYR  91           HD2      TYR  91  15.146  -8.968  12.804
  695    HE1  TYR  91           HE1      TYR  91  15.957 -11.076  17.160
  696    HE2  TYR  91           HE2      TYR  91  17.292  -8.638  13.947
  697    HH   TYR  91           HH       TYR  91  18.244 -10.485  16.640
  698    H    PHE  92           HN       PHE  92  12.470  -7.511  12.688
  699    HA   PHE  92           HA       PHE  92  10.092  -7.965  10.972
  700   1HB   PHE  92           HB2      PHE  92  10.725  -5.479  12.598
  701   2HB   PHE  92           HB1      PHE  92   9.817  -5.337  11.095
  702    HD1  PHE  92           HD1      PHE  92   7.566  -6.301  10.900
  703    HD2  PHE  92           HD2      PHE  92   9.758  -6.638  14.536
  704    HE1  PHE  92           HE1      PHE  92   5.517  -6.972  12.074
  705    HE2  PHE  92           HE2      PHE  92   7.705  -7.303  15.707
  706    HZ   PHE  92           HZ       PHE  92   5.585  -7.474  14.479
  707    H    CYS  93           HN       CYS  93  10.162  -6.617   8.998
  708    HA   CYS  93           HA       CYS  93  12.823  -5.563   8.267
  709   1HB   CYS  93           HB2      CYS  93  13.003  -7.008   6.305
  710   2HB   CYS  93           HB1      CYS  93  12.884  -7.990   7.740
  711    H    SER  94           HN       SER  94  11.624  -3.606   8.191
  712    HA   SER  94           HA       SER  94   9.505  -3.366   6.141
  713   1HB   SER  94           HB2      SER  94  10.750  -1.351   8.090
  714   2HB   SER  94           HB1      SER  94   9.394  -0.981   7.009
  715    HG   SER  94           HG       SER  94   8.921  -1.836   9.234
  716    H    GLN  95           HN       GLN  95   9.797  -1.074   4.897
  717    HA   GLN  95           HA       GLN  95  12.603  -0.984   3.877
  718   1HB   GLN  95           HB2      GLN  95  11.601  -0.779   1.541
  719   2HB   GLN  95           HB1      GLN  95  11.369  -2.359   2.279
  720   1HG   GLN  95           HG1      GLN  95   9.106  -2.098   2.425
  721   2HG   GLN  95           HG2      GLN  95   9.232  -0.405   2.891
  722   1HE2  GLN  95          HE22      GLN  95   8.029  -1.086  -0.761
  723   2HE2  GLN  95          HE21      GLN  95   7.768  -2.057   0.607
  724    H    THR  96           HN       THR  96  13.141   0.960   2.746
  725    HA   THR  96           HA       THR  96  11.335   3.246   3.375
  726    HB   THR  96           HB       THR  96  13.255   3.181   4.995
  727    HG1  THR  96           HG1      THR  96  13.596   5.151   2.971
  728   1HG2  THR  96          HG21      THR  96  14.683   2.342   2.713
  729   2HG2  THR  96          HG22      THR  96  15.206   4.005   2.941
  730   3HG2  THR  96          HG23      THR  96  15.416   2.831   4.236
  731    H    THR  97           HN       THR  97  11.267   1.999   0.961
  732    HA   THR  97           HA       THR  97  12.747   3.882  -0.836
  733    HB   THR  97           HB       THR  97  11.561   1.156  -1.611
  734    HG1  THR  97           HG1      THR  97  13.174   0.459  -0.435
  735   1HG2  THR  97          HG23      THR  97  13.496   3.186  -2.809
  736   2HG2  THR  97          HG21      THR  97  13.670   1.480  -3.213
  737   3HG2  THR  97          HG22      THR  97  12.186   2.338  -3.619
  738    H    HIS  98           HN       HIS  98   9.703   2.028  -0.624
  739    HA   HIS  98           HA       HIS  98   8.433   3.930  -2.482
  740   1HB   HIS  98           HB2      HIS  98   7.425   1.452  -1.000
  741   2HB   HIS  98           HB1      HIS  98   6.401   2.432  -2.046
  742    HD2  HIS  98           HD2      HIS  98   9.674   0.235  -2.354
  743    HE1  HIS  98           HE1      HIS  98   7.951   0.605  -6.093
  744    H    VAL  99           HN       VAL  99   6.784   5.343  -1.936
  745    HA   VAL  99           HA       VAL  99   6.517   5.862   0.995
  746    HB   VAL  99           HB       VAL  99   6.225   7.785  -1.362
  747   1HG1  VAL  99          HG11      VAL  99   4.904   8.319   0.748
  748   2HG1  VAL  99          HG12      VAL  99   6.442   8.411   1.601
  749   3HG1  VAL  99          HG13      VAL  99   6.090   9.538   0.297
  750   1HG2  VAL  99          HG23      VAL  99   8.474   7.313   0.624
  751   2HG2  VAL  99          HG21      VAL  99   8.547   7.122  -1.125
  752   3HG2  VAL  99          HG22      VAL  99   8.380   8.727  -0.421
  753    HA   PRO 100           HA       PRO 100   5.306   6.924   2.377
  754   1HB   PRO 100           HB2      PRO 100   3.556   5.462   4.121
  755   2HB   PRO 100           HB1      PRO 100   3.511   7.195   3.794
  756   1HG   PRO 100           HG1      PRO 100   1.637   5.162   2.915
  757   2HG   PRO 100           HG2      PRO 100   1.549   6.905   2.658
  758   1HD   PRO 100           HD1      PRO 100   2.234   4.851   0.731
  759   2HD   PRO 100           HD2      PRO 100   2.094   6.598   0.461
  760    HA   PRO 101           HA       PRO 101   7.844   3.521   3.353
  761   1HB   PRO 101           HB2      PRO 101   7.516   3.746   6.265
  762   2HB   PRO 101           HB1      PRO 101   8.926   4.164   5.290
  763   1HG   PRO 101           HG1      PRO 101   7.090   5.979   6.528
  764   2HG   PRO 101           HG2      PRO 101   8.416   6.390   5.441
  765   1HD   PRO 101           HD1      PRO 101   5.574   6.485   4.893
  766   2HD   PRO 101           HD2      PRO 101   6.907   6.935   3.813
  767    H    THR 102           HN       THR 102   7.220   1.492   3.085
  768    HA   THR 102           HA       THR 102   4.724   0.563   4.372
  769    HB   THR 102           HB       THR 102   5.365  -1.538   2.827
  770    HG1  THR 102           HG1      THR 102   6.624  -0.192   1.067
  771   1HG2  THR 102          HG22      THR 102   3.763   0.635   2.354
  772   2HG2  THR 102          HG23      THR 102   5.037   0.976   1.185
  773   3HG2  THR 102          HG21      THR 102   4.126  -0.532   1.085
  774    H    PHE 103           HN       PHE 103   4.897  -0.280   6.324
  775    HA   PHE 103           HA       PHE 103   7.400  -1.533   7.205
  776   1HB   PHE 103           HB2      PHE 103   4.963  -0.442   8.443
  777   2HB   PHE 103           HB1      PHE 103   5.423  -1.980   9.169
  778    HD1  PHE 103           HD2      PHE 103   7.280   1.008   7.841
  779    HD2  PHE 103           HD1      PHE 103   6.752  -1.715  11.074
  780    HE1  PHE 103           HE2      PHE 103   9.084   2.123   9.079
  781    HE2  PHE 103           HE1      PHE 103   8.555  -0.594  12.309
  782    HZ   PHE 103           HZ       PHE 103   9.722   1.326  11.313
  783    H    GLY 104           HN       GLY 104   7.588  -3.688   7.924
  784   1HA   GLY 104           HA1      GLY 104   5.432  -5.599   7.645
  785   2HA   GLY 104           HA2      GLY 104   6.523  -5.676   6.264
  786    H    GLY 105           HN       GLY 105   6.101  -7.770   8.130
  787   1HA   GLY 105           HA1      GLY 105   8.276  -9.139   8.556
  788   2HA   GLY 105           HA2      GLY 105   8.664  -7.827   9.657
  789    H    GLY 106           HN       GLY 106   8.688  -9.958  11.030
  790   1HA   GLY 106           HA1      GLY 106   7.096  -9.974  13.144
  791   2HA   GLY 106           HA2      GLY 106   5.942 -10.609  11.981
  792    H    THR 107           HN       THR 107   9.379 -11.265  12.729
  793    HA   THR 107           HA       THR 107   8.735 -14.170  12.549
  794    HB   THR 107           HB       THR 107  11.393 -12.627  12.506
  795    HG1  THR 107           HG1      THR 107  10.297 -14.462  10.660
  796   1HG2  THR 107          HG22      THR 107  10.738 -15.606  12.672
  797   2HG2  THR 107          HG23      THR 107  12.160 -15.072  11.782
  798   3HG2  THR 107          HG21      THR 107  12.023 -14.740  13.506
  799    H    LYS 108           HN       LYS 108   8.248 -15.130  14.391
  800    HA   LYS 108           HA       LYS 108   8.830 -13.959  16.964
  801   1HB   LYS 108           HB2      LYS 108   6.937 -15.649  16.157
  802   2HB   LYS 108           HB1      LYS 108   8.113 -16.876  16.607
  803   1HG   LYS 108           HG1      LYS 108   7.391 -16.647  18.740
  804   2HG   LYS 108           HG2      LYS 108   8.158 -15.064  18.748
  805   1HD   LYS 108           HD1      LYS 108   5.876 -14.677  19.370
  806   2HD   LYS 108           HD2      LYS 108   6.001 -14.164  17.692
  807   1HE   LYS 108           HE1      LYS 108   4.025 -15.501  17.792
  808   2HE   LYS 108           HE2      LYS 108   5.245 -16.538  17.064
  809   1HZ   LYS 108           HZ1      LYS 108   5.473 -16.881  19.796
  810   2HZ   LYS 108           HZ2      LYS 108   3.806 -16.907  19.465
  811    H    LEU 109           HN       LEU 109  11.025 -13.739  17.241
  812    HA   LEU 109           HA       LEU 109  12.748 -16.132  17.033
  813   1HB   LEU 109           HB2      LEU 109  13.169 -13.378  16.687
  814   2HB   LEU 109           HB1      LEU 109  13.911 -13.693  18.249
  815    HG   LEU 109           HG       LEU 109  14.842 -15.833  16.831
  816   1HD1  LEU 109          HD13      LEU 109  14.598 -13.507  14.889
  817   2HD1  LEU 109          HD11      LEU 109  15.553 -14.959  14.607
  818   3HD1  LEU 109          HD12      LEU 109  13.801 -15.070  14.735
  819   1HD2  LEU 109          HD21      LEU 109  16.051 -13.985  18.181
  820   2HD2  LEU 109          HD22      LEU 109  16.941 -14.714  16.848
  821   3HD2  LEU 109          HD23      LEU 109  16.194 -13.134  16.648
  822    H    GLU 110           HN       GLU 110  11.717 -17.338  18.639
  823    HA   GLU 110           HA       GLU 110  12.287 -16.414  21.423
  824   1HB   GLU 110           HB2      GLU 110  10.497 -18.090  22.060
  825   2HB   GLU 110           HB1      GLU 110   9.888 -16.812  21.017
  826   1HG   GLU 110           HG1      GLU 110   9.137 -18.448  19.633
  827   2HG   GLU 110           HG2      GLU 110  10.820 -18.770  19.231
  828    H    ILE 111           HN       ILE 111  13.084 -17.937  22.899
  829    HA   ILE 111           HA       ILE 111  15.091 -19.696  21.820
  830    HB   ILE 111           HB       ILE 111  13.923 -19.737  24.641
  831   1HG1  ILE 111          HG11      ILE 111  16.247 -18.053  23.657
  832   2HG1  ILE 111          HG12      ILE 111  14.618 -17.423  23.872
  833   1HG2  ILE 111          HG21      ILE 111  15.503 -21.588  23.972
  834   2HG2  ILE 111          HG22      ILE 111  16.710 -20.376  23.552
  835   3HG2  ILE 111          HG23      ILE 111  16.193 -20.562  25.225
  836   1HD1  ILE 111          HD12      ILE 111  14.790 -18.430  26.276
  837   2HD1  ILE 111          HD13      ILE 111  16.524 -18.459  25.970
  838   3HD1  ILE 111          HD11      ILE 111  15.649 -16.932  25.938
  839    H    LYS 112           HN       LYS 112  14.988 -21.807  21.337
  840    HA   LYS 112           HA       LYS 112  12.462 -23.123  21.094
  841   1HB   LYS 112           HB2      LYS 112  14.460 -23.694  19.706
  842   2HB   LYS 112           HB1      LYS 112  15.279 -24.309  21.137
  843   1HG   LYS 112           HG1      LYS 112  13.747 -26.115  21.373
  844   2HG   LYS 112           HG2      LYS 112  12.574 -25.369  20.293
  845   1HD   LYS 112           HD1      LYS 112  14.420 -25.562  18.479
  846   2HD   LYS 112           HD2      LYS 112  15.200 -26.687  19.586
  847   1HE   LYS 112           HE1      LYS 112  12.444 -26.928  18.346
  848   2HE   LYS 112           HE2      LYS 112  13.815 -28.009  18.126
  849   1HZ   LYS 112           HZ1      LYS 112  13.666 -28.652  20.430
  850   2HZ   LYS 112           HZ2      LYS 112  12.389 -27.563  20.696
  851    NH1  ARG 113           NH1      ARG 113  11.934 -23.722  29.533
  852    NH2  ARG 113           NH2      ARG 113  13.079 -21.845  28.947
  853    H    ARG 113           HN       ARG 113  11.762 -25.066  22.131
  854    HA   ARG 113           HA       ARG 113  12.847 -25.461  24.881
  855   1HB   ARG 113           HB2      ARG 113   9.952 -25.054  24.009
  856   2HB   ARG 113           HB1      ARG 113  10.365 -25.767  25.563
  857   1HG   ARG 113           HG1      ARG 113  11.284 -23.035  24.595
  858   2HG   ARG 113           HG2      ARG 113   9.987 -23.313  25.750
  859   1HD   ARG 113           HD1      ARG 113  11.939 -24.757  26.945
  860   2HD   ARG 113           HD2      ARG 113  12.937 -23.561  26.120
  861    HE   ARG 113           HE       ARG 113  10.905 -22.088  27.364
  862   1HH1  ARG 113          HH11      ARG 113  11.259 -24.419  29.294
  863   2HH1  ARG 113          HH12      ARG 113  12.395 -23.754  30.418
  864   1HH2  ARG 113          HH21      ARG 113  13.264 -21.135  28.269
  865   2HH2  ARG 113          HH22      ARG 113  13.561 -21.839  29.821
   
  Start of MODEL           3
 Raw file had  865 H/Q atoms
  Start of MODEL    3
    1   1H    ASP   1           HT3      ASP   1   2.681   0.499   0.103
    2   2H    ASP   1           HT1      ASP   1   1.641   1.678  -0.538
    3   3H    ASP   1           HT2      ASP   1   1.064   0.109  -0.240
    4    HA   ASP   1           HA       ASP   1   1.381   0.082  -2.503
    5   1HB   ASP   1           HB2      ASP   1   3.909   0.903  -3.187
    6   2HB   ASP   1           HB1      ASP   1   2.524   1.991  -3.195
    7    H    VAL   2           HN       VAL   2   3.336  -0.919  -3.851
    8    HA   VAL   2           HA       VAL   2   3.650  -3.482  -2.709
    9    HB   VAL   2           HB       VAL   2   5.159  -2.115  -4.988
   10   1HG1  VAL   2          HG12      VAL   2   6.380  -4.109  -4.105
   11   2HG1  VAL   2          HG13      VAL   2   4.931  -5.078  -4.355
   12   3HG1  VAL   2          HG11      VAL   2   5.765  -4.373  -5.734
   13   1HG2  VAL   2          HG23      VAL   2   2.703  -3.891  -4.874
   14   2HG2  VAL   2          HG21      VAL   2   2.794  -2.229  -5.450
   15   3HG2  VAL   2          HG22      VAL   2   3.558  -3.522  -6.368
   16    H    VAL   3           HN       VAL   3   4.855  -3.919  -0.972
   17    HA   VAL   3           HA       VAL   3   7.046  -2.265  -0.095
   18    HB   VAL   3           HB       VAL   3   6.331  -5.135   0.681
   19   1HG1  VAL   3          HG12      VAL   3   8.087  -3.004   1.923
   20   2HG1  VAL   3          HG13      VAL   3   7.406  -4.308   2.890
   21   3HG1  VAL   3          HG11      VAL   3   8.498  -4.678   1.559
   22   1HG2  VAL   3          HG22      VAL   3   5.339  -2.435   1.620
   23   2HG2  VAL   3          HG23      VAL   3   4.389  -3.823   1.098
   24   3HG2  VAL   3          HG21      VAL   3   5.227  -3.861   2.646
   25    H    MET   4           HN       MET   4   9.258  -2.808   0.056
   26    HA   MET   4           HA       MET   4  10.198  -4.943  -1.799
   27   1HB   MET   4           HB2      MET   4  10.873  -1.987  -1.789
   28   2HB   MET   4           HB1      MET   4  12.067  -3.146  -2.362
   29   1HG   MET   4           HG1      MET   4  10.159  -4.100  -3.810
   30   2HG   MET   4           HG2      MET   4   9.301  -2.629  -3.441
   31   1HE   MET   4           HE3      MET   4  12.395  -4.226  -4.710
   32   2HE   MET   4           HE1      MET   4  11.404  -4.300  -6.167
   33   3HE   MET   4           HE2      MET   4  12.867  -3.315  -6.145
   34    H    THR   5           HN       THR   5  10.821  -6.227  -0.089
   35    HA   THR   5           HA       THR   5  12.509  -5.177   2.054
   36    HB   THR   5           HB       THR   5  11.638  -8.012   1.254
   37    HG1  THR   5           HG1      THR   5  11.090  -6.458   3.553
   38   1HG2  THR   5          HG22      THR   5  13.310  -6.952   3.596
   39   2HG2  THR   5          HG23      THR   5  12.391  -8.449   3.719
   40   3HG2  THR   5          HG21      THR   5  13.701  -8.314   2.551
   41    H    GLN   6           HN       GLN   6  14.606  -4.848   1.890
   42    HA   GLN   6           HA       GLN   6  16.108  -6.174  -0.295
   43   1HB   GLN   6           HB2      GLN   6  16.088  -3.572   0.646
   44   2HB   GLN   6           HB1      GLN   6  17.500  -4.222   1.464
   45   1HG   GLN   6           HG1      GLN   6  18.584  -3.763  -0.486
   46   2HG   GLN   6           HG2      GLN   6  17.810  -5.225  -1.083
   47   1HE2  GLN   6          HE22      GLN   6  17.040  -2.108  -3.181
   48   2HE2  GLN   6          HE21      GLN   6  18.499  -2.613  -2.477
   49    H    THR   7           HN       THR   7  17.487  -7.752   0.084
   50    HA   THR   7           HA       THR   7  18.771  -8.033   2.734
   51    HB   THR   7           HB       THR   7  17.978 -10.694   2.087
   52    HG1  THR   7           HG1      THR   7  15.642  -9.198   2.097
   53   1HG2  THR   7          HG23      THR   7  16.517  -8.670   3.878
   54   2HG2  THR   7          HG21      THR   7  16.398 -10.421   4.012
   55   3HG2  THR   7          HG22      THR   7  17.912  -9.610   4.397
   56    HA   PRO   8           HA       PRO   8  19.925  -9.785   3.634
   57   1HB   PRO   8           HB2      PRO   8  22.728  -9.536   4.054
   58   2HB   PRO   8           HB1      PRO   8  21.831 -11.050   3.935
   59   1HG   PRO   8           HG1      PRO   8  23.685  -9.882   2.005
   60   2HG   PRO   8           HG2      PRO   8  22.948 -11.484   1.984
   61   1HD   PRO   8           HD1      PRO   8  22.252  -9.195   0.353
   62   2HD   PRO   8           HD2      PRO   8  21.508 -10.808   0.343
   63    H    LEU   9           HN       LEU   9  21.081  -8.488   5.484
   64    HA   LEU   9           HA       LEU   9  20.609  -5.664   4.910
   65   1HB   LEU   9           HB2      LEU   9  21.169  -7.374   7.309
   66   2HB   LEU   9           HB1      LEU   9  21.688  -5.699   7.436
   67    HG   LEU   9           HG       LEU   9  19.337  -5.060   6.619
   68   1HD1  LEU   9          HD12      LEU   9  18.934  -8.001   7.267
   69   2HD1  LEU   9          HD13      LEU   9  17.614  -6.847   7.114
   70   3HD1  LEU   9          HD11      LEU   9  18.633  -7.207   5.724
   71   1HD2  LEU   9          HD21      LEU   9  19.638  -6.525   9.266
   72   2HD2  LEU   9          HD22      LEU   9  20.047  -4.837   8.976
   73   3HD2  LEU   9          HD23      LEU   9  18.370  -5.364   8.886
   74    H    SER  10           HN       SER  10  23.373  -7.742   5.414
   75    HA   SER  10           HA       SER  10  25.150  -5.460   4.658
   76   1HB   SER  10           HB2      SER  10  25.751  -7.665   6.708
   77   2HB   SER  10           HB1      SER  10  26.854  -6.350   6.254
   78    HG   SER  10           HG       SER  10  25.071  -6.209   8.100
   79    H    LEU  11           HN       LEU  11  27.038  -6.071   3.458
   80    HA   LEU  11           HA       LEU  11  27.108  -8.893   2.532
   81   1HB   LEU  11           HB2      LEU  11  25.692  -7.201   1.050
   82   2HB   LEU  11           HB1      LEU  11  27.270  -6.661   0.499
   83    HG   LEU  11           HG       LEU  11  27.753  -9.202   0.117
   84   1HD1  LEU  11          HD12      LEU  11  25.681  -9.926   1.343
   85   2HD1  LEU  11          HD13      LEU  11  24.715  -9.189   0.070
   86   3HD1  LEU  11          HD11      LEU  11  25.760 -10.556  -0.298
   87   1HD2  LEU  11          HD23      LEU  11  25.897  -7.478  -1.538
   88   2HD2  LEU  11          HD21      LEU  11  27.613  -7.781  -1.789
   89   3HD2  LEU  11          HD22      LEU  11  26.438  -9.054  -2.107
   90    HA   PRO  12           HA       PRO  12  31.295  -7.064   3.246
   91   1HB   PRO  12           HB2      PRO  12  32.044  -9.503   4.573
   92   2HB   PRO  12           HB1      PRO  12  31.764  -7.933   5.326
   93   1HG   PRO  12           HG1      PRO  12  30.088 -10.301   5.446
   94   2HG   PRO  12           HG2      PRO  12  29.860  -8.764   6.279
   95   1HD   PRO  12           HD1      PRO  12  28.380  -9.782   4.020
   96   2HD   PRO  12           HD2      PRO  12  28.164  -8.227   4.846
   97    H    VAL  13           HN       VAL  13  32.131  -7.271   1.233
   98    HA   VAL  13           HA       VAL  13  32.969 -10.015   0.377
   99    HB   VAL  13           HB       VAL  13  32.460  -9.257  -1.998
  100   1HG1  VAL  13          HG13      VAL  13  30.211  -9.312   0.040
  101   2HG1  VAL  13          HG11      VAL  13  29.933  -9.352  -1.698
  102   3HG1  VAL  13          HG12      VAL  13  30.817 -10.659  -0.919
  103   1HG2  VAL  13          HG23      VAL  13  32.565  -6.783  -1.298
  104   2HG2  VAL  13          HG21      VAL  13  31.247  -7.230  -2.381
  105   3HG2  VAL  13          HG22      VAL  13  30.936  -7.004  -0.663
  106    H    SER  14           HN       SER  14  34.628  -9.886  -1.427
  107    HA   SER  14           HA       SER  14  36.620  -7.818  -0.657
  108   1HB   SER  14           HB2      SER  14  37.501  -9.936  -2.546
  109   2HB   SER  14           HB1      SER  14  38.190  -9.494  -0.972
  110    HG   SER  14           HG       SER  14  36.487 -11.488  -1.573
  111    H    LEU  15           HN       LEU  15  37.741  -6.610  -2.222
  112    HA   LEU  15           HA       LEU  15  36.128  -5.848  -4.499
  113   1HB   LEU  15           HB2      LEU  15  38.983  -5.084  -3.731
  114   2HB   LEU  15           HB1      LEU  15  38.020  -4.274  -4.961
  115    HG   LEU  15           HG       LEU  15  37.454  -4.414  -1.983
  116   1HD1  LEU  15          HD12      LEU  15  37.999  -2.154  -3.936
  117   2HD1  LEU  15          HD13      LEU  15  37.492  -1.911  -2.268
  118   3HD1  LEU  15          HD11      LEU  15  39.039  -2.677  -2.614
  119   1HD2  LEU  15          HD23      LEU  15  35.677  -3.806  -4.316
  120   2HD2  LEU  15          HD21      LEU  15  35.275  -4.549  -2.772
  121   3HD2  LEU  15          HD22      LEU  15  35.505  -2.808  -2.877
  122    H    GLY  16           HN       GLY  16  35.974  -7.631  -5.769
  123   1HA   GLY  16           HA1      GLY  16  37.394  -7.986  -8.036
  124   2HA   GLY  16           HA2      GLY  16  38.404  -8.879  -6.898
  125    H    ASP  17           HN       ASP  17  35.881  -9.466  -5.358
  126    HA   ASP  17           HA       ASP  17  35.253 -11.974  -6.744
  127   1HB   ASP  17           HB2      ASP  17  34.666 -10.724  -4.046
  128   2HB   ASP  17           HB1      ASP  17  33.707 -12.105  -4.564
  129    H    GLN  18           HN       GLN  18  32.558 -12.179  -5.713
  130    HA   GLN  18           HA       GLN  18  31.169 -10.206  -7.477
  131   1HB   GLN  18           HB2      GLN  18  30.474 -13.154  -7.063
  132   2HB   GLN  18           HB1      GLN  18  29.653 -12.044  -8.157
  133   1HG   GLN  18           HG1      GLN  18  32.121 -11.677  -9.090
  134   2HG   GLN  18           HG2      GLN  18  32.382 -13.274  -8.398
  135   1HE2  GLN  18          HE22      GLN  18  31.027 -13.388 -11.974
  136   2HE2  GLN  18          HE21      GLN  18  32.235 -12.415 -11.283
  137    H    ALA  19           HN       ALA  19  28.845  -9.989  -6.973
  138    HA   ALA  19           HA       ALA  19  28.219 -10.548  -4.110
  139   1HB   ALA  19           HB2      ALA  19  28.565  -7.914  -5.461
  140   2HB   ALA  19           HB3      ALA  19  27.105  -8.045  -4.486
  141   3HB   ALA  19           HB1      ALA  19  28.683  -8.309  -3.749
  142    H    SER  20           HN       SER  20  25.923 -10.317  -3.601
  143    HA   SER  20           HA       SER  20  24.073 -10.279  -5.906
  144   1HB   SER  20           HB2      SER  20  24.540 -12.710  -4.110
  145   2HB   SER  20           HB1      SER  20  23.078 -12.521  -5.098
  146    HG   SER  20           HG       SER  20  25.086 -11.842  -6.635
  147    H    ILE  21           HN       ILE  21  23.039  -8.532  -5.039
  148    HA   ILE  21           HA       ILE  21  22.007  -8.695  -2.263
  149    HB   ILE  21           HB       ILE  21  21.730  -6.533  -4.403
  150   1HG1  ILE  21          HG11      ILE  21  23.377  -5.709  -2.230
  151   2HG1  ILE  21          HG12      ILE  21  23.953  -7.295  -2.727
  152   1HG2  ILE  21          HG23      ILE  21  21.013  -6.713  -1.454
  153   2HG2  ILE  21          HG21      ILE  21  21.288  -5.153  -2.221
  154   3HG2  ILE  21          HG22      ILE  21  19.990  -6.195  -2.789
  155   1HD1  ILE  21          HD12      ILE  21  23.742  -6.320  -5.159
  156   2HD1  ILE  21          HD13      ILE  21  23.767  -4.759  -4.342
  157   3HD1  ILE  21          HD11      ILE  21  25.128  -5.864  -4.174
  158    H    SER  22           HN       SER  22  19.980  -9.144  -1.792
  159    HA   SER  22           HA       SER  22  18.148  -9.915  -3.975
  160   1HB   SER  22           HB2      SER  22  18.606 -11.365  -1.870
  161   2HB   SER  22           HB1      SER  22  17.617 -10.189  -0.981
  162    HG   SER  22           HG       SER  22  15.922 -11.018  -1.894
  163    H    CYS  23           HN       CYS  23  15.935  -9.373  -3.920
  164    HA   CYS  23           HA       CYS  23  15.018  -7.028  -2.402
  165   1HB   CYS  23           HB2      CYS  23  15.720  -7.016  -5.340
  166   2HB   CYS  23           HB1      CYS  23  14.342  -6.082  -4.823
  167    NH1  ARG  24           NH1      ARG  24   8.427 -11.402   0.126
  168    NH2  ARG  24           NH2      ARG  24   7.463 -10.754  -1.833
  169    H    ARG  24           HN       ARG  24  13.156  -8.007  -1.721
  170    HA   ARG  24           HA       ARG  24  11.571  -9.538  -3.727
  171   1HB   ARG  24           HB2      ARG  24  12.035  -9.725  -0.841
  172   2HB   ARG  24           HB1      ARG  24  10.313  -9.707  -1.200
  173   1HG   ARG  24           HG1      ARG  24  12.217 -11.488  -2.733
  174   2HG   ARG  24           HG2      ARG  24  11.502 -12.008  -1.212
  175   1HD   ARG  24           HD1      ARG  24   9.663 -10.859  -3.275
  176   2HD   ARG  24           HD2      ARG  24  10.288 -12.481  -3.557
  177    HE   ARG  24           HE       ARG  24   9.036 -13.249  -1.670
  178   1HH1  ARG  24          HH11      ARG  24   9.096 -11.971   0.603
  179   2HH1  ARG  24          HH12      ARG  24   7.841 -10.780   0.643
  180   1HH2  ARG  24          HH21      ARG  24   7.407 -10.839  -2.828
  181   2HH2  ARG  24          HH22      ARG  24   6.861 -10.118  -1.353
  182    H    SER  25           HN       SER  25   9.841  -8.686  -4.630
  183    HA   SER  25           HA       SER  25   8.785  -6.118  -3.628
  184   1HB   SER  25           HB2      SER  25   7.411  -6.223  -5.757
  185   2HB   SER  25           HB1      SER  25   9.132  -6.484  -6.099
  186    HG   SER  25           HG       SER  25   8.101  -8.799  -5.343
  187    H    SER  26           HN       SER  26   6.663  -5.798  -2.948
  188    HA   SER  26           HA       SER  26   5.463  -7.706  -1.311
  189   1HB   SER  26           HB2      SER  26   4.771  -5.099  -2.359
  190   2HB   SER  26           HB1      SER  26   3.329  -6.127  -2.412
  191    HG   SER  26           HG       SER  26   3.703  -6.688  -0.261
  192    H    GLN  27           HN       GLN  27   3.978  -6.785  -4.432
  193    HA   GLN  27           HA       GLN  27   3.249  -9.661  -4.765
  194   1HB   GLN  27           HB2      GLN  27   1.486  -7.601  -4.152
  195   2HB   GLN  27           HB1      GLN  27   1.363  -7.668  -5.905
  196   1HG   GLN  27           HG1      GLN  27   1.194 -10.142  -4.166
  197   2HG   GLN  27           HG2      GLN  27  -0.227  -9.205  -4.614
  198   1HE2  GLN  27          HE22      GLN  27   0.233 -10.013  -8.168
  199   2HE2  GLN  27          HE21      GLN  27  -0.041  -8.638  -7.211
  200    H    SER  28           HN       SER  28   5.430  -9.084  -6.011
  201    HA   SER  28           HA       SER  28   6.471  -9.057  -8.106
  202   1HB   SER  28           HB2      SER  28   4.578 -10.692  -8.640
  203   2HB   SER  28           HB1      SER  28   3.639  -9.313  -9.239
  204    HG   SER  28           HG       SER  28   6.147 -10.274 -10.142
  205    H    LEU  29           HN       LEU  29   6.397  -7.940 -10.307
  206    HA   LEU  29           HA       LEU  29   5.225  -5.207 -10.034
  207   1HB   LEU  29           HB2      LEU  29   8.002  -5.812 -11.134
  208   2HB   LEU  29           HB1      LEU  29   7.327  -4.226 -10.784
  209    HG   LEU  29           HG       LEU  29   7.711  -6.355  -8.663
  210   1HD1  LEU  29          HD12      LEU  29   9.533  -4.089  -9.532
  211   2HD1  LEU  29          HD13      LEU  29   9.704  -4.940  -8.000
  212   3HD1  LEU  29          HD11      LEU  29   9.915  -5.809  -9.519
  213   1HD2  LEU  29          HD22      LEU  29   6.056  -4.417  -8.354
  214   2HD2  LEU  29          HD23      LEU  29   7.301  -4.574  -7.122
  215   3HD2  LEU  29          HD21      LEU  29   7.457  -3.352  -8.378
  216    H    VAL  30           HN       VAL  30   4.658  -7.729 -11.624
  217    HA   VAL  30           HA       VAL  30   5.211  -6.967 -14.392
  218    HB   VAL  30           HB       VAL  30   3.294  -9.063 -13.254
  219   1HG1  VAL  30          HG11      VAL  30   4.456  -8.559 -16.008
  220   2HG1  VAL  30          HG12      VAL  30   3.765 -10.112 -15.548
  221   3HG1  VAL  30          HG13      VAL  30   2.757  -8.669 -15.558
  222   1HG2  VAL  30          HG21      VAL  30   5.946  -9.087 -12.793
  223   2HG2  VAL  30          HG22      VAL  30   5.054 -10.565 -13.130
  224   3HG2  VAL  30          HG23      VAL  30   5.960  -9.773 -14.413
  225    H    HIS  31           HN       HIS  31   4.057  -5.556 -15.522
  226    HA   HIS  31           HA       HIS  31   1.697  -4.296 -14.481
  227   1HB   HIS  31           HB2      HIS  31   3.483  -3.531 -16.314
  228   2HB   HIS  31           HB1      HIS  31   2.353  -4.287 -17.433
  229    HD2  HIS  31           HD2      HIS  31   2.665  -1.128 -15.197
  230    HE1  HIS  31           HE1      HIS  31  -1.044  -1.002 -17.022
  231    H    SER  32           HN       SER  32  -0.266  -4.107 -16.125
  232    HA   SER  32           HA       SER  32  -1.505  -6.740 -16.113
  233   1HB   SER  32           HB2      SER  32  -2.434  -4.014 -17.153
  234   2HB   SER  32           HB1      SER  32  -3.471  -5.453 -17.091
  235    HG   SER  32           HG       SER  32  -1.960  -4.573 -14.867
  236    H    ASN  33           HN       ASN  33   0.436  -7.351 -17.659
  237    HA   ASN  33           HA       ASN  33  -0.696  -8.164 -20.125
  238   1HB   ASN  33           HB2      ASN  33   0.720  -6.693 -21.670
  239   2HB   ASN  33           HB1      ASN  33  -0.559  -5.819 -20.835
  240   1HD2  ASN  33          HD22      ASN  33   3.319  -4.911 -20.105
  241   2HD2  ASN  33          HD21      ASN  33   2.895  -6.157 -21.175
  242    H    GLY  34           HN       GLY  34   2.171  -7.400 -18.285
  243   1HA   GLY  34           HA1      GLY  34   3.603  -9.495 -17.922
  244   2HA   GLY  34           HA2      GLY  34   3.599  -9.636 -19.676
  245    H    ASN  35           HN       ASN  35   3.917  -6.694 -17.745
  246    HA   ASN  35           HA       ASN  35   6.662  -6.376 -18.895
  247   1HB   ASN  35           HB2      ASN  35   4.328  -4.499 -18.648
  248   2HB   ASN  35           HB1      ASN  35   5.928  -3.809 -18.398
  249   1HD2  ASN  35          HD22      ASN  35   6.321  -3.529 -21.869
  250   2HD2  ASN  35          HD21      ASN  35   6.430  -2.798 -20.341
  251    H    THR  36           HN       THR  36   7.996  -6.865 -17.265
  252    HA   THR  36           HA       THR  36   7.368  -5.930 -14.523
  253    HB   THR  36           HB       THR  36   9.538  -7.768 -15.685
  254    HG1  THR  36           HG1      THR  36   7.267  -7.959 -13.990
  255   1HG2  THR  36          HG22      THR  36   9.099  -6.643 -12.875
  256   2HG2  THR  36          HG23      THR  36   9.827  -8.229 -13.103
  257   3HG2  THR  36          HG21      THR  36  10.625  -6.794 -13.738
  258    OH   TYR  37           OH       TYR  37   6.342  -1.396 -18.983
  259    H    TYR  37           HN       TYR  37   8.536  -4.417 -13.437
  260    HA   TYR  37           HA       TYR  37  10.754  -3.083 -14.939
  261   1HB   TYR  37           HB2      TYR  37   8.550  -1.778 -13.272
  262   2HB   TYR  37           HB1      TYR  37   9.895  -0.916 -14.006
  263    HD1  TYR  37           HD2      TYR  37  10.200  -1.390 -16.616
  264    HD2  TYR  37           HD1      TYR  37   6.555  -1.920 -14.490
  265    HE1  TYR  37           HE2      TYR  37   8.950  -1.232 -18.720
  266    HE2  TYR  37           HE1      TYR  37   5.304  -1.764 -16.595
  267    HH   TYR  37           HH       TYR  37   5.704  -0.682 -18.895
  268    H    LEU  38           HN       LEU  38  12.314  -1.983 -13.612
  269    HA   LEU  38           HA       LEU  38  12.288  -2.155 -10.739
  270   1HB   LEU  38           HB2      LEU  38  12.866  -4.576 -12.037
  271   2HB   LEU  38           HB1      LEU  38  14.457  -3.940 -11.640
  272    HG   LEU  38           HG       LEU  38  12.204  -4.080  -9.618
  273   1HD1  LEU  38          HD13      LEU  38  14.315  -6.104 -10.394
  274   2HD1  LEU  38          HD11      LEU  38  13.590  -6.096  -8.788
  275   3HD1  LEU  38          HD12      LEU  38  12.582  -6.352 -10.208
  276   1HD2  LEU  38          HD22      LEU  38  15.024  -3.192  -9.652
  277   2HD2  LEU  38          HD23      LEU  38  13.729  -2.761  -8.541
  278   3HD2  LEU  38          HD21      LEU  38  14.625  -4.258  -8.310
  279    H    ASN  39           HN       ASN  39  13.246  -0.209 -10.507
  280    HA   ASN  39           HA       ASN  39  15.694   0.388 -12.081
  281   1HB   ASN  39           HB2      ASN  39  13.530   1.952 -10.849
  282   2HB   ASN  39           HB1      ASN  39  15.108   2.571 -10.381
  283   1HD2  ASN  39          HD22      ASN  39  15.232   4.331 -13.415
  284   2HD2  ASN  39          HD21      ASN  39  15.349   4.377 -11.722
  285    CH2  TRP  40           CH2      TRP  40  18.786  -5.431  -6.002
  286    H    TRP  40           HN       TRP  40  17.448  -0.501 -11.165
  287    HA   TRP  40           HA       TRP  40  17.710  -0.626  -8.240
  288   1HB   TRP  40           HB2      TRP  40  19.349  -1.569 -10.599
  289   2HB   TRP  40           HB1      TRP  40  20.073  -1.538  -8.999
  290    HD1  TRP  40           HD1      TRP  40  17.171  -3.223 -10.946
  291    HE1  TRP  40           HE1      TRP  40  16.590  -5.297  -9.625
  292    HE3  TRP  40           HE3      TRP  40  20.082  -2.482  -6.998
  293    HZ2  TRP  40           HZ2      TRP  40  17.349  -6.575  -7.092
  294    HZ3  TRP  40           HZ3      TRP  40  20.211  -4.093  -5.142
  295    HH2  TRP  40           HH2      TRP  40  18.849  -6.142  -5.191
  296    OH   TYR  41           OH       TYR  41  15.106   4.840  -9.860
  297    H    TYR  41           HN       TYR  41  19.291   0.382  -7.036
  298    HA   TYR  41           HA       TYR  41  20.801   2.590  -8.348
  299   1HB   TYR  41           HB2      TYR  41  19.183   2.822  -5.765
  300   2HB   TYR  41           HB1      TYR  41  20.150   4.106  -6.481
  301    HD1  TYR  41           HD2      TYR  41  19.549   4.280  -9.209
  302    HD2  TYR  41           HD1      TYR  41  16.901   3.116  -6.089
  303    HE1  TYR  41           HE2      TYR  41  17.634   4.995 -10.562
  304    HE2  TYR  41           HE1      TYR  41  15.000   3.855  -7.440
  305    HH   TYR  41           HH       TYR  41  14.365   4.270  -9.632
  306    H    LEU  42           HN       LEU  42  22.597   3.347  -7.126
  307    HA   LEU  42           HA       LEU  42  23.446   1.601  -4.873
  308   1HB   LEU  42           HB2      LEU  42  24.671   0.587  -6.635
  309   2HB   LEU  42           HB1      LEU  42  24.850   2.093  -7.516
  310    HG   LEU  42           HG       LEU  42  26.435   2.909  -5.775
  311   1HD1  LEU  42          HD12      LEU  42  25.468   0.445  -4.450
  312   2HD1  LEU  42          HD13      LEU  42  27.211   0.676  -4.367
  313   3HD1  LEU  42          HD11      LEU  42  26.128   1.912  -3.737
  314   1HD2  LEU  42          HD23      LEU  42  26.900   0.361  -7.289
  315   2HD2  LEU  42          HD21      LEU  42  27.637   1.943  -7.517
  316   3HD2  LEU  42          HD22      LEU  42  28.152   0.917  -6.184
  317    H    GLN  43           HN       GLN  43  23.619   2.971  -3.243
  318    HA   GLN  43           HA       GLN  43  24.537   5.749  -3.741
  319   1HB   GLN  43           HB2      GLN  43  22.479   5.091  -2.297
  320   2HB   GLN  43           HB1      GLN  43  23.640   4.540  -1.095
  321   1HG   GLN  43           HG1      GLN  43  23.505   6.714  -0.364
  322   2HG   GLN  43           HG2      GLN  43  24.663   7.008  -1.659
  323   1HE2  GLN  43          HE22      GLN  43  21.133   8.810  -1.857
  324   2HE2  GLN  43          HE21      GLN  43  21.798   8.150  -0.443
  325    H    LYS  44           HN       LYS  44  26.592   6.273  -3.445
  326    HA   LYS  44           HA       LYS  44  28.353   4.426  -1.950
  327   1HB   LYS  44           HB2      LYS  44  28.707   5.940  -4.241
  328   2HB   LYS  44           HB1      LYS  44  29.469   6.964  -3.031
  329   1HG   LYS  44           HG1      LYS  44  30.728   4.880  -2.248
  330   2HG   LYS  44           HG2      LYS  44  30.137   4.088  -3.704
  331   1HD   LYS  44           HD1      LYS  44  31.086   6.450  -4.730
  332   2HD   LYS  44           HD2      LYS  44  32.211   6.178  -3.405
  333   1HE   LYS  44           HE1      LYS  44  32.700   3.927  -4.245
  334   2HE   LYS  44           HE2      LYS  44  31.514   4.129  -5.532
  335   1HZ   LYS  44           HZ1      LYS  44  33.409   4.707  -6.622
  336   2HZ   LYS  44           HZ2      LYS  44  32.958   6.234  -6.031
  337    H    ALA  45           HN       ALA  45  30.100   5.604  -0.598
  338    HA   ALA  45           HA       ALA  45  28.858   6.740   1.674
  339   1HB   ALA  45           HB3      ALA  45  31.726   6.795   0.650
  340   2HB   ALA  45           HB1      ALA  45  31.285   7.490   2.206
  341   3HB   ALA  45           HB2      ALA  45  31.056   5.769   1.915
  342    H    GLY  46           HN       GLY  46  27.514   8.435   1.041
  343   1HA   GLY  46           HA1      GLY  46  27.031  10.736   0.885
  344   2HA   GLY  46           HA2      GLY  46  28.753  11.055   1.045
  345    H    GLN  47           HN       GLN  47  26.979   9.200  -1.425
  346    HA   GLN  47           HA       GLN  47  27.812  11.246  -3.426
  347   1HB   GLN  47           HB2      GLN  47  29.194   8.925  -3.130
  348   2HB   GLN  47           HB1      GLN  47  27.935   8.357  -4.215
  349   1HG   GLN  47           HG1      GLN  47  29.354  10.940  -4.845
  350   2HG   GLN  47           HG2      GLN  47  30.168   9.419  -5.192
  351   1HE2  GLN  47          HE22      GLN  47  27.573   8.431  -7.580
  352   2HE2  GLN  47          HE21      GLN  47  28.428   7.756  -6.278
  353    H    SER  48           HN       SER  48  26.672  11.051  -5.472
  354    HA   SER  48           HA       SER  48  23.842  10.796  -5.094
  355   1HB   SER  48           HB2      SER  48  25.425  12.043  -6.953
  356   2HB   SER  48           HB1      SER  48  24.919  10.621  -7.887
  357    HG   SER  48           HG       SER  48  23.478  12.757  -7.269
  358    HA   PRO  49           HA       PRO  49  23.146   6.520  -5.709
  359   1HB   PRO  49           HB2      PRO  49  20.614   6.958  -7.053
  360   2HB   PRO  49           HB1      PRO  49  20.870   6.508  -5.367
  361   1HG   PRO  49           HG1      PRO  49  20.017   9.068  -6.406
  362   2HG   PRO  49           HG2      PRO  49  20.248   8.610  -4.719
  363   1HD   PRO  49           HD1      PRO  49  21.915  10.335  -6.322
  364   2HD   PRO  49           HD2      PRO  49  22.154   9.862  -4.630
  365    H    LYS  50           HN       LYS  50  23.841   5.190  -7.274
  366    HA   LYS  50           HA       LYS  50  23.926   6.226 -10.060
  367   1HB   LYS  50           HB2      LYS  50  25.647   4.582  -8.375
  368   2HB   LYS  50           HB1      LYS  50  25.272   3.719  -9.862
  369   1HG   LYS  50           HG1      LYS  50  26.082   6.620  -9.966
  370   2HG   LYS  50           HG2      LYS  50  27.312   5.370  -9.827
  371   1HD   LYS  50           HD1      LYS  50  27.053   4.736 -11.992
  372   2HD   LYS  50           HD2      LYS  50  25.300   4.714 -11.856
  373   1HE   LYS  50           HE1      LYS  50  26.143   6.422 -13.493
  374   2HE   LYS  50           HE2      LYS  50  25.187   7.123 -12.192
  375   1HZ   LYS  50           HZ1      LYS  50  27.209   7.731 -11.051
  376   2HZ   LYS  50           HZ2      LYS  50  28.152   7.012 -12.267
  377    H    LEU  51           HN       LEU  51  22.711   5.400 -11.642
  378    HA   LEU  51           HA       LEU  51  20.817   3.247 -10.981
  379   1HB   LEU  51           HB2      LEU  51  20.079   5.256 -12.287
  380   2HB   LEU  51           HB1      LEU  51  21.230   4.854 -13.553
  381    HG   LEU  51           HG       LEU  51  20.016   2.573 -13.716
  382   1HD1  LEU  51          HD12      LEU  51  18.810   3.084 -11.457
  383   2HD1  LEU  51          HD13      LEU  51  17.737   4.084 -12.428
  384   3HD1  LEU  51          HD11      LEU  51  17.862   2.359 -12.750
  385   1HD2  LEU  51          HD23      LEU  51  19.777   4.501 -15.330
  386   2HD2  LEU  51          HD21      LEU  51  18.344   3.484 -15.216
  387   3HD2  LEU  51          HD22      LEU  51  18.386   5.042 -14.396
  388    H    LEU  52           HN       LEU  52  20.895   1.211 -11.700
  389    HA   LEU  52           HA       LEU  52  23.130   0.496 -13.562
  390   1HB   LEU  52           HB2      LEU  52  21.937  -1.168 -11.293
  391   2HB   LEU  52           HB1      LEU  52  23.284  -1.651 -12.317
  392    HG   LEU  52           HG       LEU  52  23.341   0.881 -10.646
  393   1HD1  LEU  52          HD13      LEU  52  24.084  -1.963  -9.944
  394   2HD1  LEU  52          HD11      LEU  52  24.881  -0.599  -9.167
  395   3HD1  LEU  52          HD12      LEU  52  23.142  -0.814  -9.001
  396   1HD2  LEU  52          HD23      LEU  52  25.499  -0.825 -11.943
  397   2HD2  LEU  52          HD21      LEU  52  24.949   0.746 -12.517
  398   3HD2  LEU  52          HD22      LEU  52  25.792   0.617 -10.977
  399    H    ILE  53           HN       ILE  53  20.060  -0.754 -12.293
  400    HA   ILE  53           HA       ILE  53  19.430  -1.756 -15.051
  401    HB   ILE  53           HB       ILE  53  18.591  -2.826 -12.319
  402   1HG1  ILE  53          HG11      ILE  53  20.900  -3.364 -12.753
  403   2HG1  ILE  53          HG12      ILE  53  19.931  -4.819 -12.948
  404   1HG2  ILE  53          HG21      ILE  53  17.852  -3.562 -15.158
  405   2HG2  ILE  53          HG22      ILE  53  17.828  -4.797 -13.902
  406   3HG2  ILE  53          HG23      ILE  53  16.792  -3.376 -13.762
  407   1HD1  ILE  53          HD13      ILE  53  19.836  -3.791 -15.471
  408   2HD1  ILE  53          HD11      ILE  53  21.436  -3.271 -14.958
  409   3HD1  ILE  53          HD12      ILE  53  21.021  -4.980 -14.943
  410    OH   TYR  54           OH       TYR  54  17.377  -0.998 -20.994
  411    H    TYR  54           HN       TYR  54  17.103  -1.696 -15.603
  412    HA   TYR  54           HA       TYR  54  15.512   0.125 -13.871
  413   1HB   TYR  54           HB2      TYR  54  14.772   1.352 -15.985
  414   2HB   TYR  54           HB1      TYR  54  16.452   1.615 -15.533
  415    HD1  TYR  54           HD1      TYR  54  14.227  -0.232 -17.845
  416    HD2  TYR  54           HD2      TYR  54  18.248   0.831 -16.937
  417    HE1  TYR  54           HE1      TYR  54  14.933  -1.033 -20.050
  418    HE2  TYR  54           HE2      TYR  54  18.950   0.028 -19.151
  419    HH   TYR  54           HH       TYR  54  17.921  -0.316 -21.394
  420    H    LYS  55           HN       LYS  55  15.549  -2.356 -16.309
  421    HA   LYS  55           HA       LYS  55  12.578  -2.555 -16.155
  422   1HB   LYS  55           HB2      LYS  55  14.526  -2.973 -18.234
  423   2HB   LYS  55           HB1      LYS  55  13.779  -4.531 -17.906
  424   1HG   LYS  55           HG1      LYS  55  11.523  -3.379 -18.065
  425   2HG   LYS  55           HG2      LYS  55  12.370  -1.940 -18.623
  426   1HD   LYS  55           HD1      LYS  55  13.340  -3.258 -20.499
  427   2HD   LYS  55           HD2      LYS  55  12.453  -4.674 -19.950
  428   1HE   LYS  55           HE1      LYS  55  10.993  -3.830 -21.563
  429   2HE   LYS  55           HE2      LYS  55  10.364  -3.066 -20.108
  430   1HZ   LYS  55           HZ1      LYS  55  10.710  -1.124 -21.078
  431   2HZ   LYS  55           HZ2      LYS  55  12.381  -1.425 -21.063
  432    H    VAL  56           HN       VAL  56  15.442  -4.634 -15.957
  433    HA   VAL  56           HA       VAL  56  14.600  -6.035 -13.623
  434    HB   VAL  56           HB       VAL  56  12.845  -6.982 -15.126
  435   1HG1  VAL  56          HG13      VAL  56  14.312  -6.593 -17.221
  436   2HG1  VAL  56          HG11      VAL  56  15.069  -8.133 -16.830
  437   3HG1  VAL  56          HG12      VAL  56  13.348  -8.063 -17.189
  438   1HG2  VAL  56          HG21      VAL  56  14.336  -8.424 -13.454
  439   2HG2  VAL  56          HG22      VAL  56  13.148  -9.201 -14.495
  440   3HG2  VAL  56          HG23      VAL  56  14.850  -9.207 -14.945
  441    H    SER  57           HN       SER  57  16.253  -6.313 -16.716
  442    HA   SER  57           HA       SER  57  18.700  -7.194 -15.266
  443   1HB   SER  57           HB2      SER  57  17.437  -9.169 -16.371
  444   2HB   SER  57           HB1      SER  57  17.835  -8.418 -17.929
  445    HG   SER  57           HG       SER  57  19.568  -9.351 -15.899
  446    H    ASN  58           HN       ASN  58  17.231  -5.729 -18.088
  447    HA   ASN  58           HA       ASN  58  19.562  -5.136 -19.578
  448   1HB   ASN  58           HB2      ASN  58  16.798  -4.002 -19.340
  449   2HB   ASN  58           HB1      ASN  58  18.003  -2.948 -20.073
  450   1HD2  ASN  58          HD22      ASN  58  17.292  -6.544 -21.940
  451   2HD2  ASN  58          HD21      ASN  58  17.222  -6.465 -20.246
  452    NH1  ARG  59           NH1      ARG  59  23.632  -4.661 -20.757
  453    NH2  ARG  59           NH2      ARG  59  25.032  -6.355 -20.164
  454    H    ARG  59           HN       ARG  59  21.280  -4.016 -19.044
  455    HA   ARG  59           HA       ARG  59  21.318  -2.301 -16.693
  456   1HB   ARG  59           HB2      ARG  59  23.464  -2.543 -18.834
  457   2HB   ARG  59           HB1      ARG  59  23.680  -2.124 -17.140
  458   1HG   ARG  59           HG1      ARG  59  22.996  -4.372 -16.452
  459   2HG   ARG  59           HG2      ARG  59  22.666  -4.810 -18.125
  460   1HD   ARG  59           HD1      ARG  59  25.365  -3.947 -17.050
  461   2HD   ARG  59           HD2      ARG  59  24.900  -5.611 -17.400
  462    HE   ARG  59           HE       ARG  59  25.751  -3.677 -19.357
  463   1HH1  ARG  59          HH11      ARG  59  23.322  -3.721 -20.620
  464   2HH1  ARG  59          HH12      ARG  59  23.209  -5.231 -21.460
  465   1HH2  ARG  59          HH21      ARG  59  25.774  -6.689 -19.582
  466   2HH2  ARG  59          HH22      ARG  59  24.637  -6.953 -20.860
  467    H    PHE  60           HN       PHE  60  21.990  -0.080 -16.699
  468    HA   PHE  60           HA       PHE  60  20.572   1.485 -18.692
  469   1HB   PHE  60           HB2      PHE  60  20.693   2.259 -16.357
  470   2HB   PHE  60           HB1      PHE  60  22.451   2.263 -16.410
  471    HD1  PHE  60           HD1      PHE  60  19.435   3.861 -17.906
  472    HD2  PHE  60           HD2      PHE  60  23.634   4.152 -17.247
  473    HE1  PHE  60           HE1      PHE  60  19.414   6.159 -18.768
  474    HE2  PHE  60           HE2      PHE  60  23.607   6.451 -18.111
  475    HZ   PHE  60           HZ       PHE  60  21.498   7.457 -18.871
  476    H    SER  61           HN       SER  61  21.553   3.226 -19.933
  477    HA   SER  61           HA       SER  61  23.699   2.308 -21.581
  478   1HB   SER  61           HB2      SER  61  22.029   3.944 -22.408
  479   2HB   SER  61           HB1      SER  61  22.558   5.129 -21.198
  480    HG   SER  61           HG       SER  61  24.567   5.183 -22.142
  481    H    GLY  62           HN       GLY  62  25.502   1.845 -20.332
  482   1HA   GLY  62           HA1      GLY  62  27.699   3.260 -20.126
  483   2HA   GLY  62           HA2      GLY  62  26.783   4.132 -18.901
  484    H    VAL  63           HN       VAL  63  25.462   1.439 -18.287
  485    HA   VAL  63           HA       VAL  63  27.356   0.704 -16.183
  486    HB   VAL  63           HB       VAL  63  24.695  -0.557 -16.985
  487   1HG1  VAL  63          HG12      VAL  63  26.214  -1.912 -15.483
  488   2HG1  VAL  63          HG13      VAL  63  26.145  -0.594 -14.317
  489   3HG1  VAL  63          HG11      VAL  63  24.681  -1.477 -14.735
  490   1HG2  VAL  63          HG22      VAL  63  24.664   1.934 -16.417
  491   2HG2  VAL  63          HG23      VAL  63  23.646   0.915 -15.408
  492   3HG2  VAL  63          HG21      VAL  63  25.197   1.482 -14.801
  493    HA   PRO  64           HA       PRO  64  29.372  -2.266 -18.812
  494   1HB   PRO  64           HB2      PRO  64  30.677  -3.350 -16.452
  495   2HB   PRO  64           HB1      PRO  64  31.385  -2.338 -17.710
  496   1HG   PRO  64           HG1      PRO  64  30.711  -1.575 -15.011
  497   2HG   PRO  64           HG2      PRO  64  31.403  -0.558 -16.275
  498   1HD   PRO  64           HD1      PRO  64  28.710  -0.498 -15.232
  499   2HD   PRO  64           HD2      PRO  64  29.407   0.526 -16.501
  500    H    ASP  65           HN       ASP  65  29.396  -4.552 -19.058
  501    HA   ASP  65           HA       ASP  65  27.011  -5.886 -18.369
  502   1HB   ASP  65           HB2      ASP  65  28.674  -6.525 -20.196
  503   2HB   ASP  65           HB1      ASP  65  29.710  -7.197 -18.941
  504    NH1  ARG  66           NH1      ARG  66  36.170  -5.920 -14.576
  505    NH2  ARG  66           NH2      ARG  66  35.565  -4.187 -13.231
  506    H    ARG  66           HN       ARG  66  29.832  -5.384 -16.487
  507    HA   ARG  66           HA       ARG  66  29.924  -7.583 -14.775
  508   1HB   ARG  66           HB2      ARG  66  30.231  -4.607 -14.176
  509   2HB   ARG  66           HB1      ARG  66  30.629  -5.857 -13.004
  510   1HG   ARG  66           HG1      ARG  66  32.288  -6.819 -14.530
  511   2HG   ARG  66           HG2      ARG  66  31.841  -5.668 -15.786
  512   1HD   ARG  66           HD1      ARG  66  32.508  -3.801 -14.231
  513   2HD   ARG  66           HD2      ARG  66  33.082  -5.012 -13.088
  514    HE   ARG  66           HE       ARG  66  34.214  -4.848 -15.858
  515   1HH1  ARG  66          HH11      ARG  66  35.954  -6.521 -15.344
  516   2HH1  ARG  66          HH12      ARG  66  37.035  -6.022 -14.086
  517   1HH2  ARG  66          HH21      ARG  66  34.896  -3.486 -12.991
  518   2HH2  ARG  66          HH22      ARG  66  36.418  -4.264 -12.711
  519    H    PHE  67           HN       PHE  67  27.461  -5.126 -14.975
  520    HA   PHE  67           HA       PHE  67  26.211  -6.132 -12.462
  521   1HB   PHE  67           HB2      PHE  67  25.721  -3.697 -14.224
  522   2HB   PHE  67           HB1      PHE  67  24.605  -4.156 -12.946
  523    HD1  PHE  67           HD2      PHE  67  28.134  -3.174 -13.605
  524    HD2  PHE  67           HD1      PHE  67  25.114  -3.731 -10.657
  525    HE1  PHE  67           HE2      PHE  67  29.555  -2.065 -11.935
  526    HE2  PHE  67           HE1      PHE  67  26.531  -2.618  -8.997
  527    HZ   PHE  67           HZ       PHE  67  28.757  -1.789  -9.627
  528    H    SER  68           HN       SER  68  24.540  -7.462 -12.507
  529    HA   SER  68           HA       SER  68  22.782  -7.525 -14.901
  530   1HB   SER  68           HB2      SER  68  22.928 -10.031 -14.969
  531   2HB   SER  68           HB1      SER  68  24.550  -9.339 -15.158
  532    HG   SER  68           HG       SER  68  24.506  -9.409 -12.718
  533    H    GLY  69           HN       GLY  69  20.713  -7.590 -14.337
  534   1HA   GLY  69           HA1      GLY  69  20.042  -8.463 -11.548
  535   2HA   GLY  69           HA2      GLY  69  19.203  -7.153 -12.375
  536    H    SER  70           HN       SER  70  18.124  -9.647 -11.252
  537    HA   SER  70           HA       SER  70  16.438 -10.341 -13.523
  538   1HB   SER  70           HB2      SER  70  18.799 -11.831 -13.289
  539   2HB   SER  70           HB1      SER  70  17.600 -12.851 -12.470
  540    HG   SER  70           HG       SER  70  17.728 -12.980 -14.869
  541    H    GLY  71           HN       GLY  71  14.571 -11.412 -12.942
  542   1HA   GLY  71           HA1      GLY  71  14.188 -12.576 -10.312
  543   2HA   GLY  71           HA2      GLY  71  13.456 -10.980 -10.426
  544    H    SER  72           HN       SER  72  12.667 -14.080 -10.550
  545    HA   SER  72           HA       SER  72  10.905 -13.917 -12.931
  546   1HB   SER  72           HB2      SER  72  11.830 -16.137 -11.087
  547   2HB   SER  72           HB1      SER  72  10.393 -16.379 -12.101
  548    HG   SER  72           HG       SER  72  12.950 -16.399 -12.844
  549    H    GLY  73           HN       GLY  73   9.715 -12.141 -11.611
  550   1HA   GLY  73           HA1      GLY  73   7.229 -12.201 -11.134
  551   2HA   GLY  73           HA2      GLY  73   7.575 -13.507 -10.010
  552    H    THR  74           HN       THR  74   8.503 -13.021  -7.992
  553    HA   THR  74           HA       THR  74   8.515 -10.106  -7.322
  554    HB   THR  74           HB       THR  74   7.527 -10.682  -5.119
  555    HG1  THR  74           HG1      THR  74   7.688 -13.355  -6.075
  556   1HG2  THR  74          HG21      THR  74   6.165 -11.239  -7.558
  557   2HG2  THR  74          HG22      THR  74   5.916 -12.678  -6.578
  558   3HG2  THR  74          HG23      THR  74   5.407 -11.105  -5.976
  559    H    ASP  75           HN       ASP  75  10.403 -12.642  -7.691
  560    HA   ASP  75           HA       ASP  75  12.193 -11.985  -5.397
  561   1HB   ASP  75           HB2      ASP  75  13.336 -14.190  -6.464
  562   2HB   ASP  75           HB1      ASP  75  11.959 -14.324  -5.375
  563    H    PHE  76           HN       PHE  76  13.309 -10.218  -6.131
  564    HA   PHE  76           HA       PHE  76  14.826 -10.571  -8.689
  565   1HB   PHE  76           HB2      PHE  76  14.125  -7.991  -7.207
  566   2HB   PHE  76           HB1      PHE  76  14.898  -8.099  -8.785
  567    HD1  PHE  76           HD2      PHE  76  13.610  -8.913 -10.748
  568    HD2  PHE  76           HD1      PHE  76  11.736  -8.354  -6.964
  569    HE1  PHE  76           HE2      PHE  76  11.408  -8.975 -11.828
  570    HE2  PHE  76           HE1      PHE  76   9.536  -8.398  -8.052
  571    HZ   PHE  76           HZ       PHE  76   9.370  -8.701 -10.484
  572    H    THR  77           HN       THR  77  17.022 -10.090  -8.715
  573    HA   THR  77           HA       THR  77  18.318  -9.237  -6.202
  574    HB   THR  77           HB       THR  77  18.779 -11.974  -7.519
  575    HG1  THR  77           HG1      THR  77  17.225 -11.163  -5.665
  576   1HG2  THR  77          HG23      THR  77  20.788 -10.345  -6.346
  577   2HG2  THR  77          HG21      THR  77  20.220 -11.338  -5.010
  578   3HG2  THR  77          HG22      THR  77  20.853 -12.098  -6.464
  579    H    LEU  78           HN       LEU  78  20.074  -8.056  -6.559
  580    HA   LEU  78           HA       LEU  78  20.958  -7.670  -9.358
  581   1HB   LEU  78           HB2      LEU  78  20.437  -5.719  -7.828
  582   2HB   LEU  78           HB1      LEU  78  21.767  -6.214  -6.793
  583    HG   LEU  78           HG       LEU  78  22.424  -5.896  -9.681
  584   1HD1  LEU  78          HD13      LEU  78  20.887  -3.982  -9.228
  585   2HD1  LEU  78          HD11      LEU  78  21.911  -3.510  -7.876
  586   3HD1  LEU  78          HD12      LEU  78  22.541  -3.455  -9.519
  587   1HD2  LEU  78          HD21      LEU  78  23.695  -5.086  -7.043
  588   2HD2  LEU  78          HD22      LEU  78  24.163  -6.443  -8.061
  589   3HD2  LEU  78          HD23      LEU  78  24.427  -4.795  -8.617
  590    H    LYS  79           HN       LYS  79  22.505  -9.002 -10.030
  591    HA   LYS  79           HA       LYS  79  24.576  -9.872  -8.066
  592   1HB   LYS  79           HB2      LYS  79  23.436 -11.062 -10.606
  593   2HB   LYS  79           HB1      LYS  79  25.021 -11.576 -10.037
  594   1HG   LYS  79           HG1      LYS  79  24.098 -12.857  -8.420
  595   2HG   LYS  79           HG2      LYS  79  23.136 -11.507  -7.829
  596   1HD   LYS  79           HD1      LYS  79  21.322 -12.016  -9.232
  597   2HD   LYS  79           HD2      LYS  79  22.322 -12.924 -10.361
  598   1HE   LYS  79           HE1      LYS  79  22.606 -14.723  -8.738
  599   2HE   LYS  79           HE2      LYS  79  21.751 -13.798  -7.510
  600   1HZ   LYS  79           HZ1      LYS  79  19.861 -13.783  -9.235
  601   2HZ   LYS  79           HZ2      LYS  79  20.687 -15.098  -9.924
  602    H    ILE  80           HN       ILE  80  26.576  -9.211  -8.253
  603    HA   ILE  80           HA       ILE  80  27.398  -7.815 -10.763
  604    HB   ILE  80           HB       ILE  80  28.356  -7.544  -7.872
  605   1HG1  ILE  80          HG11      ILE  80  27.475  -5.142  -9.316
  606   2HG1  ILE  80          HG12      ILE  80  26.204  -6.349  -9.169
  607   1HG2  ILE  80          HG21      ILE  80  29.378  -6.370 -10.495
  608   2HG2  ILE  80          HG22      ILE  80  29.684  -5.568  -8.956
  609   3HG2  ILE  80          HG23      ILE  80  30.307  -7.188  -9.242
  610   1HD1  ILE  80          HD12      ILE  80  27.910  -5.550  -6.800
  611   2HD1  ILE  80          HD13      ILE  80  26.445  -4.670  -7.222
  612   3HD1  ILE  80          HD11      ILE  80  26.354  -6.374  -6.790
  613    H    SER  81           HN       SER  81  29.070  -8.502 -11.875
  614    HA   SER  81           HA       SER  81  30.184 -11.052 -11.065
  615   1HB   SER  81           HB2      SER  81  30.515  -9.309 -13.535
  616   2HB   SER  81           HB1      SER  81  31.435 -10.811 -13.316
  617    HG   SER  81           HG       SER  81  28.935 -10.575 -14.112
  618    NH1  ARG  82           NH2      ARG  82  36.799 -11.080 -11.655
  619    NH2  ARG  82           NH1      ARG  82  38.586 -10.531 -12.948
  620    H    ARG  82           HN       ARG  82  31.136  -7.775 -10.838
  621    HA   ARG  82           HA       ARG  82  33.737  -8.656  -9.712
  622   1HB   ARG  82           HB2      ARG  82  33.345  -6.710 -12.015
  623   2HB   ARG  82           HB1      ARG  82  34.788  -6.653 -11.013
  624   1HG   ARG  82           HG1      ARG  82  34.341  -9.386 -11.731
  625   2HG   ARG  82           HG2      ARG  82  34.215  -8.424 -13.197
  626   1HD   ARG  82           HD1      ARG  82  36.392  -7.332 -12.615
  627   2HD   ARG  82           HD2      ARG  82  36.521  -8.403 -11.219
  628    HE   ARG  82           HE       ARG  82  36.528  -9.351 -14.060
  629   1HH1  ARG  82          HH21      ARG  82  35.854 -10.897 -11.380
  630   2HH1  ARG  82          HH22      ARG  82  37.307 -11.828 -11.230
  631   1HH2  ARG  82          HH11      ARG  82  38.985  -9.936 -13.645
  632   2HH2  ARG  82          HH12      ARG  82  39.129 -11.269 -12.550
  633    H    VAL  83           HN       VAL  83  33.166  -7.997  -7.674
  634    HA   VAL  83           HA       VAL  83  31.986  -5.381  -7.180
  635    HB   VAL  83           HB       VAL  83  33.383  -7.324  -5.269
  636   1HG1  VAL  83          HG11      VAL  83  32.758  -4.743  -4.731
  637   2HG1  VAL  83          HG12      VAL  83  31.202  -5.489  -4.388
  638   3HG1  VAL  83          HG13      VAL  83  32.643  -6.015  -3.523
  639   1HG2  VAL  83          HG22      VAL  83  30.632  -7.205  -6.446
  640   2HG2  VAL  83          HG23      VAL  83  31.599  -8.608  -6.000
  641   3HG2  VAL  83          HG21      VAL  83  30.774  -7.677  -4.756
  642    H    GLU  84           HN       GLU  84  33.101  -3.547  -7.322
  643    HA   GLU  84           HA       GLU  84  36.028  -3.617  -6.687
  644   1HB   GLU  84           HB2      GLU  84  34.475  -1.699  -8.492
  645   2HB   GLU  84           HB1      GLU  84  36.216  -1.671  -8.238
  646   1HG   GLU  84           HG1      GLU  84  35.071  -4.288  -9.088
  647   2HG   GLU  84           HG2      GLU  84  35.036  -3.009 -10.294
  648    H    ALA  85           HN       ALA  85  36.844  -1.368  -6.033
  649    HA   ALA  85           HA       ALA  85  35.798  -0.638  -3.543
  650   1HB   ALA  85           HB2      ALA  85  37.477   0.784  -5.617
  651   2HB   ALA  85           HB3      ALA  85  36.924   1.698  -4.217
  652   3HB   ALA  85           HB1      ALA  85  37.930   0.270  -3.994
  653    H    GLU  86           HN       GLU  86  34.829   0.445  -6.725
  654    HA   GLU  86           HA       GLU  86  33.216   2.674  -5.870
  655   1HB   GLU  86           HB2      GLU  86  33.162   0.889  -8.343
  656   2HB   GLU  86           HB1      GLU  86  32.114   2.291  -8.163
  657   1HG   GLU  86           HG1      GLU  86  34.742   3.150  -7.493
  658   2HG   GLU  86           HG2      GLU  86  34.879   2.208  -8.974
  659    H    ASP  87           HN       ASP  87  32.609  -0.729  -6.372
  660    HA   ASP  87           HA       ASP  87  29.775  -0.729  -6.181
  661   1HB   ASP  87           HB2      ASP  87  31.645  -2.627  -6.644
  662   2HB   ASP  87           HB1      ASP  87  31.354  -2.972  -4.943
  663    H    LEU  88           HN       LEU  88  32.098  -0.059  -3.773
  664    HA   LEU  88           HA       LEU  88  30.627  -1.020  -1.485
  665   1HB   LEU  88           HB2      LEU  88  32.644   1.261  -1.669
  666   2HB   LEU  88           HB1      LEU  88  32.170   0.433  -0.193
  667    HG   LEU  88           HG       LEU  88  33.521  -0.877  -2.581
  668   1HD1  LEU  88          HD11      LEU  88  35.007   0.630  -1.269
  669   2HD1  LEU  88          HD12      LEU  88  34.568  -0.237   0.201
  670   3HD1  LEU  88          HD13      LEU  88  35.462  -1.060  -1.073
  671   1HD2  LEU  88          HD22      LEU  88  32.295  -1.893  -0.045
  672   2HD2  LEU  88          HD23      LEU  88  32.363  -2.651  -1.633
  673   3HD2  LEU  88          HD21      LEU  88  33.783  -2.657  -0.591
  674    H    GLY  89           HN       GLY  89  29.105  -0.116  -0.285
  675   1HA   GLY  89           HA1      GLY  89  28.319   2.336   0.397
  676   2HA   GLY  89           HA2      GLY  89  27.832   2.364  -1.296
  677    H    ILE  90           HN       ILE  90  25.687   2.714  -0.206
  678    HA   ILE  90           HA       ILE  90  24.480   0.195   0.827
  679    HB   ILE  90           HB       ILE  90  23.083   2.883   0.585
  680   1HG1  ILE  90          HG11      ILE  90  25.205   3.382   1.694
  681   2HG1  ILE  90          HG12      ILE  90  23.898   3.439   2.866
  682   1HG2  ILE  90          HG23      ILE  90  22.914   0.517   2.516
  683   2HG2  ILE  90          HG21      ILE  90  21.959   1.987   2.677
  684   3HG2  ILE  90          HG22      ILE  90  21.732   0.937   1.283
  685   1HD1  ILE  90          HD12      ILE  90  25.648   0.995   2.424
  686   2HD1  ILE  90          HD13      ILE  90  25.942   2.195   3.677
  687   3HD1  ILE  90          HD11      ILE  90  24.469   1.233   3.710
  688    OH   TYR  91           OH       TYR  91  26.673  -2.002  -6.957
  689    H    TYR  91           HN       TYR  91  23.492  -1.069  -0.614
  690    HA   TYR  91           HA       TYR  91  22.746   0.012  -3.236
  691   1HB   TYR  91           HB2      TYR  91  23.119  -2.667  -2.002
  692   2HB   TYR  91           HB1      TYR  91  21.846  -2.599  -3.219
  693    HD1  TYR  91           HD2      TYR  91  25.451  -2.165  -2.609
  694    HD2  TYR  91           HD1      TYR  91  22.377  -2.046  -5.547
  695    HE1  TYR  91           HE2      TYR  91  27.144  -2.104  -4.382
  696    HE2  TYR  91           HE1      TYR  91  24.075  -1.976  -7.316
  697    HH   TYR  91           HH       TYR  91  27.445  -2.483  -6.645
  698    H    PHE  92           HN       PHE  92  20.743   0.043  -4.136
  699    HA   PHE  92           HA       PHE  92  18.391  -0.500  -2.402
  700   1HB   PHE  92           HB2      PHE  92  19.094   2.132  -3.779
  701   2HB   PHE  92           HB1      PHE  92  17.459   1.763  -3.239
  702    HD1  PHE  92           HD1      PHE  92  17.141   1.147  -0.750
  703    HD2  PHE  92           HD2      PHE  92  20.698   2.960  -2.238
  704    HE1  PHE  92           HE1      PHE  92  17.724   1.872   1.522
  705    HE2  PHE  92           HE2      PHE  92  21.277   3.681   0.036
  706    HZ   PHE  92           HZ       PHE  92  19.797   3.132   1.919
  707    H    CYS  93           HN       CYS  93  16.333  -0.343  -3.733
  708    HA   CYS  93           HA       CYS  93  16.688  -0.609  -6.632
  709   1HB   CYS  93           HB2      CYS  93  15.889  -2.889  -6.779
  710   2HB   CYS  93           HB1      CYS  93  17.255  -2.866  -5.699
  711    H    SER  94           HN       SER  94  15.165   0.877  -7.093
  712    HA   SER  94           HA       SER  94  12.559   0.752  -5.723
  713   1HB   SER  94           HB2      SER  94  12.080   2.860  -6.897
  714   2HB   SER  94           HB1      SER  94  13.760   2.959  -6.342
  715    HG   SER  94           HG       SER  94  14.098   1.769  -8.504
  716    H    GLN  95           HN       GLN  95  10.613   1.055  -7.155
  717    HA   GLN  95           HA       GLN  95  10.805  -0.744  -9.539
  718   1HB   GLN  95           HB2      GLN  95   8.308  -1.284  -8.671
  719   2HB   GLN  95           HB1      GLN  95   9.696  -2.141  -8.007
  720   1HG   GLN  95           HG1      GLN  95   9.830  -0.388  -6.193
  721   2HG   GLN  95           HG2      GLN  95   8.337   0.304  -6.814
  722   1HE2  GLN  95          HE22      GLN  95   6.807  -1.810  -4.426
  723   2HE2  GLN  95          HE21      GLN  95   7.253  -0.217  -4.793
  724    H    THR  96           HN       THR  96  10.370   0.497 -11.267
  725    HA   THR  96           HA       THR  96   8.647   2.857 -11.020
  726    HB   THR  96           HB       THR  96   9.144   3.043 -13.542
  727    HG1  THR  96           HG1      THR  96   9.302   0.870 -13.979
  728   1HG2  THR  96          HG23      THR  96  10.859   3.811 -11.712
  729   2HG2  THR  96          HG21      THR  96  11.664   2.269 -11.985
  730   3HG2  THR  96          HG22      THR  96  11.543   3.441 -13.292
  731    H    THR  97           HN       THR  97   7.092   0.925 -10.236
  732    HA   THR  97           HA       THR  97   5.278   0.409 -12.563
  733    HB   THR  97           HB       THR  97   5.472  -1.465 -10.151
  734    HG1  THR  97           HG1      THR  97   6.837  -2.519 -12.018
  735   1HG2  THR  97          HG22      THR  97   4.766  -1.773 -13.124
  736   2HG2  THR  97          HG23      THR  97   4.879  -3.125 -12.001
  737   3HG2  THR  97          HG21      THR  97   3.631  -1.902 -11.784
  738    H    HIS  98           HN       HIS  98   5.374   0.432  -9.000
  739    HA   HIS  98           HA       HIS  98   2.558   1.394  -8.999
  740   1HB   HIS  98           HB2      HIS  98   4.386   0.136  -6.919
  741   2HB   HIS  98           HB1      HIS  98   2.896   0.942  -6.436
  742    HD2  HIS  98           HD2      HIS  98   3.970  -2.055  -8.799
  743    HE1  HIS  98           HE1      HIS  98   0.044  -2.598  -7.624
  744    H    VAL  99           HN       VAL  99   2.148   2.886  -6.996
  745    HA   VAL  99           HA       VAL  99   4.302   4.891  -6.677
  746    HB   VAL  99           HB       VAL  99   1.499   5.512  -7.729
  747   1HG1  VAL  99          HG11      VAL  99   2.455   7.218  -6.118
  748   2HG1  VAL  99          HG12      VAL  99   3.804   7.426  -7.231
  749   3HG1  VAL  99          HG13      VAL  99   2.171   7.843  -7.738
  750   1HG2  VAL  99          HG23      VAL  99   4.259   5.602  -8.982
  751   2HG2  VAL  99          HG21      VAL  99   2.854   4.696  -9.535
  752   3HG2  VAL  99          HG22      VAL  99   2.879   6.451  -9.671
  753    HA   PRO 100           HA       PRO 100   4.757   6.604  -5.587
  754   1HB   PRO 100           HB2      PRO 100   6.086   6.422  -3.052
  755   2HB   PRO 100           HB1      PRO 100   5.252   7.833  -3.706
  756   1HG   PRO 100           HG1      PRO 100   4.406   6.097  -1.533
  757   2HG   PRO 100           HG2      PRO 100   3.631   7.571  -2.113
  758   1HD   PRO 100           HD1      PRO 100   2.774   4.841  -2.520
  759   2HD   PRO 100           HD2      PRO 100   1.987   6.322  -3.091
  760    HA   PRO 101           HA       PRO 101   7.148   2.956  -6.301
  761   1HB   PRO 101           HB2      PRO 101   9.455   4.466  -7.140
  762   2HB   PRO 101           HB1      PRO 101   8.232   3.734  -8.179
  763   1HG   PRO 101           HG1      PRO 101   8.632   6.552  -7.591
  764   2HG   PRO 101           HG2      PRO 101   7.480   5.827  -8.713
  765   1HD   PRO 101           HD1      PRO 101   6.925   7.011  -6.144
  766   2HD   PRO 101           HD2      PRO 101   5.774   6.245  -7.255
  767    H    THR 102           HN       THR 102   8.057   1.874  -4.640
  768    HA   THR 102           HA       THR 102   9.393   3.168  -2.448
  769    HB   THR 102           HB       THR 102  10.018   0.737  -1.831
  770    HG1  THR 102           HG1      THR 102   9.297  -0.788  -3.334
  771   1HG2  THR 102          HG21      THR 102   7.152   1.073  -2.895
  772   2HG2  THR 102          HG22      THR 102   7.668  -0.089  -1.677
  773   3HG2  THR 102          HG23      THR 102   7.671   1.631  -1.307
  774    H    PHE 103           HN       PHE 103  11.626   2.787  -1.772
  775    HA   PHE 103           HA       PHE 103  13.467   2.714  -4.133
  776   1HB   PHE 103           HB2      PHE 103  13.124   4.730  -2.260
  777   2HB   PHE 103           HB1      PHE 103  14.473   3.838  -1.566
  778    HD1  PHE 103           HD1      PHE 103  13.302   5.506  -4.685
  779    HD2  PHE 103           HD2      PHE 103  16.655   4.002  -2.529
  780    HE1  PHE 103           HE1      PHE 103  14.819   6.563  -6.302
  781    HE2  PHE 103           HE2      PHE 103  18.167   5.056  -4.152
  782    HZ   PHE 103           HZ       PHE 103  17.251   6.336  -6.039
  783    H    GLY 104           HN       GLY 104  12.594   0.346  -2.848
  784   1HA   GLY 104           HA1      GLY 104  13.581  -1.679  -2.162
  785   2HA   GLY 104           HA2      GLY 104  15.149  -0.893  -2.313
  786    H    GLY 105           HN       GLY 105  15.172  -2.454  -0.292
  787   1HA   GLY 105           HA1      GLY 105  14.160  -1.129   2.149
  788   2HA   GLY 105           HA2      GLY 105  14.950  -2.701   2.084
  789    H    GLY 106           HN       GLY 106  17.304  -2.199   0.851
  790   1HA   GLY 106           HA1      GLY 106  19.086  -0.362   1.004
  791   2HA   GLY 106           HA2      GLY 106  18.607  -0.230   2.692
  792    H    THR 107           HN       THR 107  20.401  -2.043   0.360
  793    HA   THR 107           HA       THR 107  21.219  -4.024   2.436
  794    HB   THR 107           HB       THR 107  21.793  -3.929  -0.592
  795    HG1  THR 107           HG1      THR 107  20.163  -5.669   0.942
  796   1HG2  THR 107          HG22      THR 107  22.728  -5.664   1.656
  797   2HG2  THR 107          HG23      THR 107  21.957  -6.568   0.356
  798   3HG2  THR 107          HG21      THR 107  23.361  -5.560   0.018
  799    H    LYS 108           HN       LYS 108  23.015  -3.636   3.537
  800    HA   LYS 108           HA       LYS 108  24.845  -1.516   2.730
  801   1HB   LYS 108           HB2      LYS 108  24.099  -2.544   5.145
  802   2HB   LYS 108           HB1      LYS 108  25.587  -3.449   4.901
  803   1HG   LYS 108           HG1      LYS 108  25.754  -0.547   4.293
  804   2HG   LYS 108           HG2      LYS 108  25.504  -0.949   5.988
  805   1HD   LYS 108           HD1      LYS 108  27.489  -2.262   6.082
  806   2HD   LYS 108           HD2      LYS 108  27.624  -2.334   4.329
  807   1HE   LYS 108           HE1      LYS 108  27.850   0.216   5.963
  808   2HE   LYS 108           HE2      LYS 108  29.226  -0.707   5.370
  809   1HZ   LYS 108           HZ1      LYS 108  29.046   0.592   3.585
  810   2HZ   LYS 108           HZ2      LYS 108  27.734  -0.395   3.148
  811    H    LEU 109           HN       LEU 109  26.438  -1.791   1.326
  812    HA   LEU 109           HA       LEU 109  27.683  -4.499   1.089
  813   1HB   LEU 109           HB2      LEU 109  26.437  -3.285  -0.932
  814   2HB   LEU 109           HB1      LEU 109  27.930  -2.359  -1.039
  815    HG   LEU 109           HG       LEU 109  28.167  -5.336  -0.798
  816   1HD1  LEU 109          HD12      LEU 109  26.345  -4.830  -2.517
  817   2HD1  LEU 109          HD13      LEU 109  27.580  -3.988  -3.448
  818   3HD1  LEU 109          HD11      LEU 109  27.739  -5.712  -3.133
  819   1HD2  LEU 109          HD22      LEU 109  29.635  -3.108  -2.234
  820   2HD2  LEU 109          HD23      LEU 109  30.210  -4.075  -0.880
  821   3HD2  LEU 109          HD21      LEU 109  30.023  -4.809  -2.469
  822    H    GLU 110           HN       GLU 110  29.308  -4.405   2.428
  823    HA   GLU 110           HA       GLU 110  31.280  -2.201   2.033
  824   1HB   GLU 110           HB2      GLU 110  31.925  -2.543   4.383
  825   2HB   GLU 110           HB1      GLU 110  30.182  -2.323   4.313
  826   1HG   GLU 110           HG1      GLU 110  31.101  -5.135   4.038
  827   2HG   GLU 110           HG2      GLU 110  31.389  -4.404   5.610
  828    H    ILE 111           HN       ILE 111  33.480  -2.781   2.299
  829    HA   ILE 111           HA       ILE 111  34.220  -5.113   0.829
  830    HB   ILE 111           HB       ILE 111  35.497  -2.883   1.150
  831   1HG1  ILE 111          HG11      ILE 111  37.317  -5.224   1.665
  832   2HG1  ILE 111          HG12      ILE 111  36.367  -5.181   0.183
  833   1HG2  ILE 111          HG23      ILE 111  35.304  -3.297   3.737
  834   2HG2  ILE 111          HG21      ILE 111  36.692  -4.355   3.517
  835   3HG2  ILE 111          HG22      ILE 111  36.819  -2.643   3.121
  836   1HD1  ILE 111          HD11      ILE 111  38.224  -2.970   1.138
  837   2HD1  ILE 111          HD12      ILE 111  38.592  -4.123  -0.141
  838   3HD1  ILE 111          HD13      ILE 111  37.292  -2.953  -0.357
  839    H    LYS 112           HN       LYS 112  35.837  -6.744   1.695
  840    HA   LYS 112           HA       LYS 112  34.648  -8.003   4.058
  841   1HB   LYS 112           HB2      LYS 112  35.531  -9.180   1.908
  842   2HB   LYS 112           HB1      LYS 112  37.141  -8.917   2.563
  843   1HG   LYS 112           HG1      LYS 112  35.183 -10.078   4.468
  844   2HG   LYS 112           HG2      LYS 112  35.610 -11.118   3.115
  845   1HD   LYS 112           HD1      LYS 112  37.854 -11.241   3.738
  846   2HD   LYS 112           HD2      LYS 112  37.817  -9.693   4.573
  847   1HE   LYS 112           HE1      LYS 112  36.134 -10.909   6.188
  848   2HE   LYS 112           HE2      LYS 112  36.841 -12.377   5.526
  849   1HZ   LYS 112           HZ1      LYS 112  38.883 -10.550   6.188
  850   2HZ   LYS 112           HZ2      LYS 112  37.863 -10.758   7.527
  851    NH1  ARG 113           NH2      ARG 113  39.409  -1.699   7.024
  852    NH2  ARG 113           NH1      ARG 113  41.098  -2.778   5.950
  853    H    ARG 113           HN       ARG 113  35.789  -8.597   5.943
  854    HA   ARG 113           HA       ARG 113  38.464  -7.497   6.420
  855   1HB   ARG 113           HB2      ARG 113  36.491  -5.707   6.827
  856   2HB   ARG 113           HB1      ARG 113  36.343  -6.568   8.354
  857   1HG   ARG 113           HG1      ARG 113  37.912  -4.847   8.817
  858   2HG   ARG 113           HG2      ARG 113  38.910  -6.273   8.554
  859   1HD   ARG 113           HD1      ARG 113  39.511  -5.577   6.352
  860   2HD   ARG 113           HD2      ARG 113  38.219  -4.379   6.293
  861    HE   ARG 113           HE       ARG 113  40.286  -3.974   8.373
  862   1HH1  ARG 113          HH21      ARG 113  38.672  -1.724   7.697
  863   2HH1  ARG 113          HH22      ARG 113  39.590  -0.861   6.512
  864   1HH2  ARG 113          HH11      ARG 113  41.629  -3.614   5.817
  865   2HH2  ARG 113          HH12      ARG 113  41.312  -1.960   5.419
   
  Start of MODEL           4
 Raw file had  864 H/Q atoms
  Start of MODEL    4
    1   1H    ASP   1           HT2      ASP   1   0.719  -0.254   0.646
    2   2H    ASP   1           HT3      ASP   1   2.146   0.113   1.486
    3   3H    ASP   1           HT1      ASP   1   0.972   1.317   1.243
    4    HA   ASP   1           HA       ASP   1   2.439   1.877  -0.380
    5   1HB   ASP   1           HB2      ASP   1   3.424  -0.117  -1.836
    6   2HB   ASP   1           HB1      ASP   1   4.143   0.231  -0.268
    7    H    VAL   2           HN       VAL   2   1.541   2.704  -2.039
    8    HA   VAL   2           HA       VAL   2  -0.156   0.980  -3.711
    9    HB   VAL   2           HB       VAL   2  -0.981   3.696  -2.602
   10   1HG1  VAL   2          HG12      VAL   2  -1.789   3.292  -4.925
   11   2HG1  VAL   2          HG13      VAL   2  -2.507   1.775  -4.391
   12   3HG1  VAL   2          HG11      VAL   2  -3.115   3.304  -3.765
   13   1HG2  VAL   2          HG21      VAL   2  -1.921   0.866  -2.045
   14   2HG2  VAL   2          HG22      VAL   2  -1.237   2.010  -0.894
   15   3HG2  VAL   2          HG23      VAL   2  -2.839   2.291  -1.568
   16    H    VAL   3           HN       VAL   3   0.013   1.398  -5.863
   17    HA   VAL   3           HA       VAL   3   2.124   3.153  -6.751
   18    HB   VAL   3           HB       VAL   3  -0.103   1.812  -8.358
   19   1HG1  VAL   3          HG12      VAL   3   2.583   3.004  -9.117
   20   2HG1  VAL   3          HG13      VAL   3   1.680   1.926 -10.177
   21   3HG1  VAL   3          HG11      VAL   3   0.996   3.480  -9.714
   22   1HG2  VAL   3          HG23      VAL   3   2.653   0.860  -7.511
   23   2HG2  VAL   3          HG21      VAL   3   1.106   0.129  -7.095
   24   3HG2  VAL   3          HG22      VAL   3   1.691   0.067  -8.754
   25    H    MET   4           HN       MET   4   2.072   5.190  -7.438
   26    HA   MET   4           HA       MET   4  -0.599   6.483  -7.842
   27   1HB   MET   4           HB2      MET   4   1.901   7.521  -6.428
   28   2HB   MET   4           HB1      MET   4   0.577   8.576  -6.908
   29   1HG   MET   4           HG1      MET   4   0.046   6.101  -5.293
   30   2HG   MET   4           HG2      MET   4   0.615   7.546  -4.502
   31   1HE   MET   4           HE3      MET   4  -0.325   9.681  -4.600
   32   2HE   MET   4           HE1      MET   4  -1.191   9.944  -6.115
   33   3HE   MET   4           HE2      MET   4  -2.051  10.044  -4.579
   34    H    THR   5           HN       THR   5  -0.509   6.370 -10.074
   35    HA   THR   5           HA       THR   5   1.847   7.279 -11.548
   36    HB   THR   5           HB       THR   5  -1.010   6.522 -12.385
   37    HG1  THR   5           HG1      THR   5   1.346   5.279 -13.193
   38   1HG2  THR   5          HG23      THR   5   1.446   7.370 -14.015
   39   2HG2  THR   5          HG21      THR   5   0.167   6.375 -14.705
   40   3HG2  THR   5          HG22      THR   5  -0.187   8.012 -14.162
   41    H    GLN   6           HN       GLN   6   2.348   9.353 -11.731
   42    HA   GLN   6           HA       GLN   6   0.159  11.366 -11.613
   43   1HB   GLN   6           HB2      GLN   6   3.009  11.262 -10.814
   44   2HB   GLN   6           HB1      GLN   6   2.551  12.772 -11.593
   45   1HG   GLN   6           HG1      GLN   6   2.145  12.989  -9.194
   46   2HG   GLN   6           HG2      GLN   6   0.593  12.921 -10.019
   47   1HE2  GLN   6          HE22      GLN   6   1.568  10.033  -7.360
   48   2HE2  GLN   6          HE21      GLN   6   2.581  11.360  -7.648
   49    H    THR   7           HN       THR   7  -0.033  12.993 -13.088
   50    HA   THR   7           HA       THR   7   1.667  13.194 -15.455
   51    HB   THR   7           HB       THR   7  -0.825  12.771 -16.722
   52    HG1  THR   7           HG1      THR   7  -1.089  11.863 -14.363
   53   1HG2  THR   7          HG22      THR   7   1.647  11.692 -17.057
   54   2HG2  THR   7          HG23      THR   7   0.929  10.366 -16.149
   55   3HG2  THR   7          HG21      THR   7   0.226  10.865 -17.684
   56    HA   PRO   8           HA       PRO   8   0.940  13.836 -17.609
   57   1HB   PRO   8           HB2      PRO   8   1.773  16.274 -18.815
   58   2HB   PRO   8           HB1      PRO   8   0.327  15.358 -19.239
   59   1HG   PRO   8           HG1      PRO   8   0.508  17.912 -17.841
   60   2HG   PRO   8           HG2      PRO   8  -0.936  17.087 -18.429
   61   1HD   PRO   8           HD1      PRO   8  -0.002  17.293 -15.694
   62   2HD   PRO   8           HD2      PRO   8  -1.462  16.482 -16.289
   63    H    LEU   9           HN       LEU   9   3.219  14.238 -18.626
   64    HA   LEU   9           HA       LEU   9   5.113  14.286 -16.439
   65   1HB   LEU   9           HB2      LEU   9   5.172  13.871 -19.398
   66   2HB   LEU   9           HB1      LEU   9   6.667  14.485 -18.704
   67    HG   LEU   9           HG       LEU   9   6.587  12.628 -17.012
   68   1HD1  LEU   9          HD12      LEU   9   4.268  11.707 -18.751
   69   2HD1  LEU   9          HD13      LEU   9   5.028  10.737 -17.493
   70   3HD1  LEU   9          HD11      LEU   9   4.160  12.209 -17.065
   71   1HD2  LEU   9          HD21      LEU   9   7.903  12.420 -19.113
   72   2HD2  LEU   9          HD22      LEU   9   7.263  10.863 -18.596
   73   3HD2  LEU   9          HD23      LEU   9   6.493  11.737 -19.916
   74    H    SER  10           HN       SER  10   3.944  16.643 -18.701
   75    HA   SER  10           HA       SER  10   5.530  18.707 -17.292
   76   1HB   SER  10           HB2      SER  10   6.281  19.709 -19.461
   77   2HB   SER  10           HB1      SER  10   6.840  18.028 -19.363
   78    HG   SER  10           HG       SER  10   5.763  17.959 -21.217
   79    H    LEU  11           HN       LEU  11   4.599  20.735 -17.289
   80    HA   LEU  11           HA       LEU  11   1.937  20.960 -18.625
   81   1HB   LEU  11           HB2      LEU  11   2.298  20.570 -15.926
   82   2HB   LEU  11           HB1      LEU  11   2.329  22.322 -15.998
   83    HG   LEU  11           HG       LEU  11   0.192  21.748 -17.640
   84   1HD1  LEU  11          HD13      LEU  11   0.713  19.324 -16.392
   85   2HD1  LEU  11          HD11      LEU  11  -0.530  20.028 -15.364
   86   3HD1  LEU  11          HD12      LEU  11  -0.837  19.796 -17.082
   87   1HD2  LEU  11          HD22      LEU  11   0.287  23.426 -15.809
   88   2HD2  LEU  11          HD23      LEU  11  -1.191  22.474 -15.732
   89   3HD2  LEU  11          HD21      LEU  11   0.134  22.131 -14.625
   90    HA   PRO  12           HA       PRO  12   4.562  24.616 -19.625
   91   1HB   PRO  12           HB2      PRO  12   3.508  24.568 -22.296
   92   2HB   PRO  12           HB1      PRO  12   5.124  24.076 -21.792
   93   1HG   PRO  12           HG1      PRO  12   2.915  22.387 -22.644
   94   2HG   PRO  12           HG2      PRO  12   4.570  21.909 -22.266
   95   1HD   PRO  12           HD1      PRO  12   2.205  21.478 -20.672
   96   2HD   PRO  12           HD2      PRO  12   3.873  21.018 -20.284
   97    H    VAL  13           HN       VAL  13   3.452  26.253 -18.675
   98    HA   VAL  13           HA       VAL  13   1.031  27.266 -20.073
   99    HB   VAL  13           HB       VAL  13  -0.215  27.477 -17.964
  100   1HG1  VAL  13          HG12      VAL  13  -0.183  25.237 -19.187
  101   2HG1  VAL  13          HG13      VAL  13   0.987  24.693 -17.991
  102   3HG1  VAL  13          HG11      VAL  13  -0.635  25.156 -17.489
  103   1HG2  VAL  13          HG21      VAL  13   2.325  26.376 -16.710
  104   2HG2  VAL  13          HG22      VAL  13   1.622  27.969 -16.445
  105   3HG2  VAL  13          HG23      VAL  13   0.796  26.531 -15.851
  106    H    SER  14           HN       SER  14   0.577  29.476 -19.679
  107    HA   SER  14           HA       SER  14   2.986  31.026 -19.062
  108   1HB   SER  14           HB2      SER  14   0.599  32.679 -19.386
  109   2HB   SER  14           HB1      SER  14   1.959  32.503 -20.510
  110    HG   SER  14           HG       SER  14  -0.502  31.389 -20.617
  111    H    LEU  15           HN       LEU  15   3.106  32.646 -17.441
  112    HA   LEU  15           HA       LEU  15   1.931  31.851 -14.934
  113   1HB   LEU  15           HB2      LEU  15   3.449  34.375 -15.736
  114   2HB   LEU  15           HB1      LEU  15   3.065  33.928 -14.078
  115    HG   LEU  15           HG       LEU  15   4.776  32.334 -16.019
  116   1HD1  LEU  15          HD13      LEU  15   5.399  33.805 -13.437
  117   2HD1  LEU  15          HD11      LEU  15   6.541  32.791 -14.311
  118   3HD1  LEU  15          HD12      LEU  15   5.932  34.268 -15.050
  119   1HD2  LEU  15          HD22      LEU  15   3.532  31.685 -13.367
  120   2HD2  LEU  15          HD23      LEU  15   3.807  30.636 -14.754
  121   3HD2  LEU  15          HD21      LEU  15   5.148  31.070 -13.699
  122    H    GLY  16           HN       GLY  16  -0.263  31.954 -15.236
  123   1HA   GLY  16           HA1      GLY  16  -1.735  34.013 -14.219
  124   2HA   GLY  16           HA2      GLY  16  -1.565  34.504 -15.903
  125    H    ASP  17           HN       ASP  17  -1.518  31.677 -16.776
  126    HA   ASP  17           HA       ASP  17  -4.406  31.354 -17.061
  127   1HB   ASP  17           HB2      ASP  17  -2.055  29.618 -17.964
  128   2HB   ASP  17           HB1      ASP  17  -3.723  29.398 -18.487
  129    H    GLN  18           HN       GLN  18  -5.315  29.074 -16.813
  130    HA   GLN  18           HA       GLN  18  -4.795  28.255 -14.035
  131   1HB   GLN  18           HB2      GLN  18  -6.837  27.309 -16.097
  132   2HB   GLN  18           HB1      GLN  18  -6.778  26.742 -14.431
  133   1HG   GLN  18           HG1      GLN  18  -7.134  29.051 -13.621
  134   2HG   GLN  18           HG2      GLN  18  -7.174  29.636 -15.282
  135   1HE2  GLN  18          HE22      GLN  18 -10.231  27.225 -15.479
  136   2HE2  GLN  18          HE21      GLN  18  -8.622  26.895 -15.901
  137    H    ALA  19           HN       ALA  19  -3.825  26.456 -13.403
  138    HA   ALA  19           HA       ALA  19  -2.777  24.623 -15.523
  139   1HB   ALA  19           HB3      ALA  19  -1.670  25.797 -13.047
  140   2HB   ALA  19           HB1      ALA  19  -1.436  24.054 -13.120
  141   3HB   ALA  19           HB2      ALA  19  -0.814  25.081 -14.408
  142    H    SER  20           HN       SER  20  -2.815  22.320 -15.059
  143    HA   SER  20           HA       SER  20  -4.513  21.463 -12.791
  144   1HB   SER  20           HB2      SER  20  -5.250  21.133 -15.735
  145   2HB   SER  20           HB1      SER  20  -5.938  20.088 -14.475
  146    HG   SER  20           HG       SER  20  -5.841  22.856 -14.038
  147    H    ILE  21           HN       ILE  21  -2.899  20.227 -11.954
  148    HA   ILE  21           HA       ILE  21  -1.435  18.321 -13.658
  149    HB   ILE  21           HB       ILE  21  -1.465  18.500 -10.609
  150   1HG1  ILE  21          HG11      ILE  21   0.318  20.040 -12.530
  151   2HG1  ILE  21          HG12      ILE  21  -1.025  20.743 -11.637
  152   1HG2  ILE  21          HG22      ILE  21   0.274  17.271 -12.748
  153   2HG2  ILE  21          HG23      ILE  21   1.068  17.855 -11.291
  154   3HG2  ILE  21          HG21      ILE  21  -0.176  16.616 -11.179
  155   1HD1  ILE  21          HD11      ILE  21   0.467  19.362  -9.698
  156   2HD1  ILE  21          HD12      ILE  21   1.670  20.142 -10.719
  157   3HD1  ILE  21          HD13      ILE  21   0.422  21.106  -9.936
  158    H    SER  22           HN       SER  22  -1.391  16.013 -13.095
  159    HA   SER  22           HA       SER  22  -4.044  15.092 -12.061
  160   1HB   SER  22           HB2      SER  22  -3.424  14.862 -14.654
  161   2HB   SER  22           HB1      SER  22  -2.498  13.455 -14.093
  162    HG   SER  22           HG       SER  22  -4.996  13.409 -14.531
  163    H    CYS  23           HN       CYS  23  -4.118  13.272 -10.847
  164    HA   CYS  23           HA       CYS  23  -1.652  11.759 -10.235
  165   1HB   CYS  23           HB2      CYS  23  -3.105  13.620  -8.364
  166   2HB   CYS  23           HB1      CYS  23  -2.470  12.140  -7.701
  167    NH1  ARG  24           NH1      ARG  24  -4.645   6.639 -15.469
  168    NH2  ARG  24           NH2      ARG  24  -6.908   6.633 -15.685
  169    H    ARG  24           HN       ARG  24  -2.490   9.789 -10.743
  170    HA   ARG  24           HA       ARG  24  -5.130   9.084  -9.521
  171   1HB   ARG  24           HB2      ARG  24  -3.807   8.471 -12.124
  172   2HB   ARG  24           HB1      ARG  24  -4.660   7.120 -11.386
  173   1HG   ARG  24           HG1      ARG  24  -6.734   8.279 -11.385
  174   2HG   ARG  24           HG2      ARG  24  -5.958   9.841 -11.628
  175   1HD   ARG  24           HD1      ARG  24  -7.014   9.001 -13.723
  176   2HD   ARG  24           HD2      ARG  24  -5.266   9.166 -13.897
  177    HE   ARG  24           HE       ARG  24  -5.973   6.498 -13.023
  178   1HH1  ARG  24          HH11      ARG  24  -3.842   6.786 -14.893
  179   2HH1  ARG  24          HH12      ARG  24  -4.534   6.360 -16.421
  180   1HH2  ARG  24          HH21      ARG  24  -7.807   6.774 -15.270
  181   2HH2  ARG  24          HH22      ARG  24  -6.837   6.357 -16.642
  182    H    SER  25           HN       SER  25  -5.278   7.446  -8.146
  183    HA   SER  25           HA       SER  25  -2.775   6.002  -7.434
  184   1HB   SER  25           HB2      SER  25  -4.150   5.360  -5.372
  185   2HB   SER  25           HB1      SER  25  -4.027   7.118  -5.579
  186    HG   SER  25           HG       SER  25  -6.019   6.073  -7.093
  187    H    SER  26           HN       SER  26  -2.766   3.712  -7.200
  188    HA   SER  26           HA       SER  26  -4.351   2.341  -9.212
  189   1HB   SER  26           HB2      SER  26  -3.176   0.275  -8.184
  190   2HB   SER  26           HB1      SER  26  -2.068   1.549  -8.727
  191    HG   SER  26           HG       SER  26  -2.993   0.981  -6.118
  192    H    GLN  27           HN       GLN  27  -4.452   2.605  -5.718
  193    HA   GLN  27           HA       GLN  27  -7.007   1.055  -5.735
  194   1HB   GLN  27           HB2      GLN  27  -5.039  -0.016  -4.513
  195   2HB   GLN  27           HB1      GLN  27  -5.023   1.375  -3.435
  196   1HG   GLN  27           HG1      GLN  27  -6.417  -0.021  -2.222
  197   2HG   GLN  27           HG2      GLN  27  -7.616   0.782  -3.225
  198   1HE2  GLN  27          HE22      GLN  27  -8.078  -2.942  -3.463
  199   2HE2  GLN  27          HE21      GLN  27  -8.027  -1.853  -2.163
  200    H    SER  28           HN       SER  28  -8.691   1.856  -4.459
  201    HA   SER  28           HA       SER  28  -9.075   4.627  -4.358
  202   1HB   SER  28           HB2      SER  28 -10.572   2.361  -3.648
  203   2HB   SER  28           HB1      SER  28 -10.417   3.244  -2.117
  204    HG   SER  28           HG       SER  28 -11.950   4.420  -3.014
  205    H    LEU  29           HN       LEU  29  -8.781   6.226  -2.866
  206    HA   LEU  29           HA       LEU  29  -6.955   5.543  -0.602
  207   1HB   LEU  29           HB2      LEU  29  -7.448   8.225  -1.979
  208   2HB   LEU  29           HB1      LEU  29  -6.230   7.913  -0.748
  209    HG   LEU  29           HG       LEU  29  -6.347   6.471  -3.418
  210   1HD1  LEU  29          HD11      LEU  29  -5.302   9.102  -2.667
  211   2HD1  LEU  29          HD12      LEU  29  -4.046   8.053  -3.315
  212   3HD1  LEU  29          HD13      LEU  29  -5.486   8.392  -4.267
  213   1HD2  LEU  29          HD22      LEU  29  -4.319   6.569  -1.161
  214   2HD2  LEU  29          HD23      LEU  29  -5.216   5.161  -1.721
  215   3HD2  LEU  29          HD21      LEU  29  -3.980   5.880  -2.745
  216    H    VAL  30           HN       VAL  30  -9.667   5.103  -0.226
  217    HA   VAL  30           HA       VAL  30 -10.578   7.434   1.394
  218    HB   VAL  30           HB       VAL  30 -12.048   4.903   0.509
  219   1HG1  VAL  30          HG11      VAL  30 -12.913   7.358   2.063
  220   2HG1  VAL  30          HG12      VAL  30 -14.068   6.324   1.229
  221   3HG1  VAL  30          HG13      VAL  30 -13.081   5.669   2.531
  222   1HG2  VAL  30          HG23      VAL  30 -12.231   7.782  -0.457
  223   2HG2  VAL  30          HG21      VAL  30 -11.516   6.447  -1.356
  224   3HG2  VAL  30          HG22      VAL  30 -13.244   6.454  -1.016
  225    H    HIS  31           HN       HIS  31 -10.728   7.346   3.552
  226    HA   HIS  31           HA       HIS  31  -9.495   5.069   4.923
  227   1HB   HIS  31           HB2      HIS  31  -9.360   7.667   5.456
  228   2HB   HIS  31           HB1      HIS  31 -10.872   7.386   6.313
  229    HD2  HIS  31           HD2      HIS  31  -7.405   5.416   6.291
  230    HE1  HIS  31           HE1      HIS  31  -8.758   5.814  10.179
  231    H    SER  32           HN       SER  32 -10.938   5.119   7.342
  232    HA   SER  32           HA       SER  32 -13.143   3.348   6.610
  233   1HB   SER  32           HB2      SER  32 -12.081   4.382   9.289
  234   2HB   SER  32           HB1      SER  32 -13.401   3.203   9.155
  235    HG   SER  32           HG       SER  32 -12.059   1.761   8.292
  236    H    ASN  33           HN       ASN  33 -13.438   6.097   5.778
  237    HA   ASN  33           HA       ASN  33 -16.161   6.522   6.665
  238   1HB   ASN  33           HB2      ASN  33 -15.774   8.724   7.757
  239   2HB   ASN  33           HB1      ASN  33 -14.850   7.484   8.596
  240   1HD2  ASN  33          HD22      ASN  33 -12.570  10.360   7.969
  241   2HD2  ASN  33          HD21      ASN  33 -14.010  10.129   8.835
  242    H    GLY  34           HN       GLY  34 -16.262   9.313   6.077
  243   1HA   GLY  34           HA1      GLY  34 -15.962   9.150   3.130
  244   2HA   GLY  34           HA2      GLY  34 -16.930  10.338   3.998
  245    H    ASN  35           HN       ASN  35 -13.514   9.342   4.183
  246    HA   ASN  35           HA       ASN  35 -12.735  12.130   3.480
  247   1HB   ASN  35           HB2      ASN  35 -11.974  10.563   5.975
  248   2HB   ASN  35           HB1      ASN  35 -10.974  11.887   5.388
  249   1HD2  ASN  35          HD22      ASN  35 -13.210  14.412   6.441
  250   2HD2  ASN  35          HD21      ASN  35 -11.812  14.052   5.549
  251    H    THR  36           HN       THR  36 -10.776  12.334   2.475
  252    HA   THR  36           HA       THR  36  -9.317   9.787   1.881
  253    HB   THR  36           HB       THR  36 -10.007  12.146   0.034
  254    HG1  THR  36           HG1      THR  36 -10.415   9.328  -0.001
  255   1HG2  THR  36          HG23      THR  36  -7.848  10.063  -0.094
  256   2HG2  THR  36          HG21      THR  36  -8.876  10.134  -1.520
  257   3HG2  THR  36          HG22      THR  36  -7.980  11.559  -1.009
  258    OH   TYR  37           OH       TYR  37  -9.107   9.368   8.111
  259    H    TYR  37           HN       TYR  37  -7.314   9.834   2.634
  260    HA   TYR  37           HA       TYR  37  -6.105  12.408   3.381
  261   1HB   TYR  37           HB2      TYR  37  -4.930   9.606   3.622
  262   2HB   TYR  37           HB1      TYR  37  -4.423  11.041   4.505
  263    HD1  TYR  37           HD1      TYR  37  -7.556  11.894   4.700
  264    HD2  TYR  37           HD2      TYR  37  -5.271   8.498   5.870
  265    HE1  TYR  37           HE1      TYR  37  -9.205  11.379   6.432
  266    HE2  TYR  37           HE2      TYR  37  -6.927   7.990   7.605
  267    HH   TYR  37           HH       TYR  37  -9.155   8.412   8.209
  268    H    LEU  38           HN       LEU  38  -6.027  13.051   1.070
  269    HA   LEU  38           HA       LEU  38  -3.509  12.032  -0.192
  270   1HB   LEU  38           HB2      LEU  38  -5.517  11.533  -1.574
  271   2HB   LEU  38           HB1      LEU  38  -5.992  13.225  -1.515
  272    HG   LEU  38           HG       LEU  38  -3.213  12.846  -2.409
  273   1HD1  LEU  38          HD11      LEU  38  -5.505  11.539  -3.876
  274   2HD1  LEU  38          HD12      LEU  38  -4.074  12.102  -4.734
  275   3HD1  LEU  38          HD13      LEU  38  -3.927  10.863  -3.491
  276   1HD2  LEU  38          HD21      LEU  38  -5.213  14.769  -2.607
  277   2HD2  LEU  38          HD22      LEU  38  -3.704  14.769  -3.517
  278   3HD2  LEU  38          HD23      LEU  38  -5.161  14.083  -4.228
  279    H    ASN  39           HN       ASN  39  -1.954  13.485  -0.554
  280    HA   ASN  39           HA       ASN  39  -2.680  16.371  -0.276
  281   1HB   ASN  39           HB2      ASN  39  -0.252  16.534   0.709
  282   2HB   ASN  39           HB1      ASN  39  -1.507  15.875   1.750
  283   1HD2  ASN  39          HD22      ASN  39   0.983  13.341   2.212
  284   2HD2  ASN  39          HD21      ASN  39   0.426  14.816   2.839
  285    CH2  TRP  40           CH2      TRP  40  -1.441  16.521  -8.502
  286    H    TRP  40           HN       TRP  40  -1.039  17.839  -1.177
  287    HA   TRP  40           HA       TRP  40   0.134  16.666  -3.662
  288   1HB   TRP  40           HB2      TRP  40  -1.297  19.253  -3.059
  289   2HB   TRP  40           HB1      TRP  40  -0.104  19.245  -4.346
  290    HD1  TRP  40           HD1      TRP  40  -3.598  17.927  -3.482
  291    HE1  TRP  40           HE1      TRP  40  -4.505  16.899  -5.599
  292    HE3  TRP  40           HE3      TRP  40   0.542  17.981  -6.203
  293    HZ2  TRP  40           HZ2      TRP  40  -3.515  16.080  -8.238
  294    HZ3  TRP  40           HZ3      TRP  40   0.623  17.066  -8.484
  295    HH2  TRP  40           HH2      TRP  40  -1.405  16.123  -9.504
  296    OH   TYR  41           OH       TYR  41   9.874  18.461  -1.379
  297    H    TYR  41           HN       TYR  41   2.128  17.563  -4.391
  298    HA   TYR  41           HA       TYR  41   3.679  19.035  -2.304
  299   1HB   TYR  41           HB2      TYR  41   4.121  16.557  -2.206
  300   2HB   TYR  41           HB1      TYR  41   4.607  16.593  -3.895
  301    HD1  TYR  41           HD1      TYR  41   5.382  18.940  -1.067
  302    HD2  TYR  41           HD2      TYR  41   6.914  16.207  -3.947
  303    HE1  TYR  41           HE1      TYR  41   7.669  19.486  -0.375
  304    HE2  TYR  41           HE2      TYR  41   9.198  16.765  -3.260
  305    HH   TYR  41           HH       TYR  41  10.329  18.858  -2.128
  306    H    LEU  42           HN       LEU  42   5.695  19.976  -3.143
  307    HA   LEU  42           HA       LEU  42   5.943  20.279  -6.053
  308   1HB   LEU  42           HB2      LEU  42   4.301  22.011  -5.714
  309   2HB   LEU  42           HB1      LEU  42   5.035  22.516  -4.199
  310    HG   LEU  42           HG       LEU  42   7.067  23.256  -5.487
  311   1HD1  LEU  42          HD12      LEU  42   5.771  21.808  -7.575
  312   2HD1  LEU  42          HD13      LEU  42   5.791  23.500  -8.059
  313   3HD1  LEU  42          HD11      LEU  42   7.297  22.680  -7.664
  314   1HD2  LEU  42          HD21      LEU  42   4.406  24.472  -6.292
  315   2HD2  LEU  42          HD22      LEU  42   5.348  24.885  -4.864
  316   3HD2  LEU  42          HD23      LEU  42   5.967  25.268  -6.467
  317    H    GLN  43           HN       GLN  43   7.964  20.730  -6.639
  318    HA   GLN  43           HA       GLN  43   9.912  21.418  -4.475
  319   1HB   GLN  43           HB2      GLN  43  10.140  19.111  -5.504
  320   2HB   GLN  43           HB1      GLN  43  10.383  19.871  -7.072
  321   1HG   GLN  43           HG1      GLN  43  12.580  19.415  -6.200
  322   2HG   GLN  43           HG2      GLN  43  12.333  21.148  -6.016
  323   1HE2  GLN  43          HE22      GLN  43  13.361  20.643  -2.667
  324   2HE2  GLN  43          HE21      GLN  43  13.768  21.296  -4.180
  325    H    LYS  44           HN       LYS  44  10.848  23.353  -4.703
  326    HA   LYS  44           HA       LYS  44  10.528  24.805  -7.248
  327   1HB   LYS  44           HB2      LYS  44  10.156  25.808  -4.911
  328   2HB   LYS  44           HB1      LYS  44  11.892  25.705  -4.680
  329   1HG   LYS  44           HG1      LYS  44  11.579  27.912  -5.469
  330   2HG   LYS  44           HG2      LYS  44  12.056  27.034  -6.913
  331   1HD   LYS  44           HD1      LYS  44   9.514  26.656  -7.290
  332   2HD   LYS  44           HD2      LYS  44   9.284  27.922  -6.090
  333   1HE   LYS  44           HE1      LYS  44   9.288  28.882  -8.359
  334   2HE   LYS  44           HE2      LYS  44  10.677  29.461  -7.450
  335   1HZ   LYS  44           HZ1      LYS  44  12.037  27.795  -8.536
  336   2HZ   LYS  44           HZ2      LYS  44  10.686  27.222  -9.399
  337    H    ALA  45           HN       ALA  45  12.297  25.812  -8.311
  338    HA   ALA  45           HA       ALA  45  14.521  24.095  -8.769
  339   1HB   ALA  45           HB1      ALA  45  13.571  25.874 -10.340
  340   2HB   ALA  45           HB2      ALA  45  14.374  27.088  -9.348
  341   3HB   ALA  45           HB3      ALA  45  15.328  25.889 -10.216
  342    H    GLY  46           HN       GLY  46  15.454  23.690  -6.721
  343   1HA   GLY  46           HA1      GLY  46  17.189  23.985  -5.161
  344   2HA   GLY  46           HA2      GLY  46  17.688  25.397  -6.082
  345    H    GLN  47           HN       GLN  47  14.740  24.611  -4.227
  346    HA   GLN  47           HA       GLN  47  15.341  26.895  -2.423
  347   1HB   GLN  47           HB2      GLN  47  13.555  27.051  -4.572
  348   2HB   GLN  47           HB1      GLN  47  12.515  26.628  -3.226
  349   1HG   GLN  47           HG1      GLN  47  12.612  29.037  -3.267
  350   2HG   GLN  47           HG2      GLN  47  13.616  28.524  -1.913
  351   1HE2  GLN  47          HE22      GLN  47  15.562  29.778  -5.319
  352   2HE2  GLN  47          HE21      GLN  47  14.086  28.956  -5.471
  353    H    SER  48           HN       SER  48  13.024  26.907  -0.984
  354    HA   SER  48           HA       SER  48  13.187  24.294   0.396
  355   1HB   SER  48           HB2      SER  48  11.755  25.584   2.136
  356   2HB   SER  48           HB1      SER  48  13.355  26.290   1.832
  357    HG   SER  48           HG       SER  48  10.977  26.970   0.427
  358    HA   PRO  49           HA       PRO  49   9.433  23.231  -1.807
  359   1HB   PRO  49           HB2      PRO  49   9.368  20.695  -0.465
  360   2HB   PRO  49           HB1      PRO  49   9.958  21.011  -2.096
  361   1HG   PRO  49           HG1      PRO  49  11.503  20.400   0.298
  362   2HG   PRO  49           HG2      PRO  49  12.077  20.559  -1.361
  363   1HD   PRO  49           HD1      PRO  49  12.442  22.418   0.801
  364   2HD   PRO  49           HD2      PRO  49  12.953  22.614  -0.885
  365    H    LYS  50           HN       LYS  50   7.242  22.734  -1.179
  366    HA   LYS  50           HA       LYS  50   6.670  22.751   1.711
  367   1HB   LYS  50           HB2      LYS  50   5.264  24.698   1.614
  368   2HB   LYS  50           HB1      LYS  50   6.756  25.142   0.793
  369   1HG   LYS  50           HG1      LYS  50   5.736  25.325  -1.221
  370   2HG   LYS  50           HG2      LYS  50   4.781  23.877  -0.961
  371   1HD   LYS  50           HD1      LYS  50   3.161  25.614  -0.991
  372   2HD   LYS  50           HD2      LYS  50   3.412  25.302   0.721
  373   1HE   LYS  50           HE1      LYS  50   5.343  27.154   0.341
  374   2HE   LYS  50           HE2      LYS  50   4.225  27.660  -0.918
  375   1HZ   LYS  50           HZ1      LYS  50   2.893  28.546   0.593
  376   2HZ   LYS  50           HZ2      LYS  50   2.824  27.097   1.478
  377    H    LEU  51           HN       LEU  51   4.346  22.435   2.177
  378    HA   LEU  51           HA       LEU  51   3.313  20.324   0.397
  379   1HB   LEU  51           HB2      LEU  51   3.255  19.875   2.795
  380   2HB   LEU  51           HB1      LEU  51   2.492  21.421   3.128
  381    HG   LEU  51           HG       LEU  51   0.468  20.655   1.858
  382   1HD1  LEU  51          HD11      LEU  51   2.280  18.540   1.099
  383   2HD1  LEU  51          HD12      LEU  51   0.900  17.842   1.942
  384   3HD1  LEU  51          HD13      LEU  51   0.647  18.843   0.518
  385   1HD2  LEU  51          HD21      LEU  51   1.039  20.230   4.417
  386   2HD2  LEU  51          HD22      LEU  51  -0.400  19.516   3.699
  387   3HD2  LEU  51          HD23      LEU  51   1.052  18.544   3.914
  388    H    LEU  52           HN       LEU  52   1.461  20.460  -0.797
  389    HA   LEU  52           HA       LEU  52   0.353  23.196  -1.138
  390   1HB   LEU  52           HB2      LEU  52   0.619  20.735  -2.812
  391   2HB   LEU  52           HB1      LEU  52  -0.870  21.632  -3.057
  392    HG   LEU  52           HG       LEU  52   0.668  22.537  -4.629
  393   1HD1  LEU  52          HD11      LEU  52  -0.525  24.157  -2.874
  394   2HD1  LEU  52          HD12      LEU  52   1.143  24.527  -2.445
  395   3HD1  LEU  52          HD13      LEU  52   0.579  24.784  -4.092
  396   1HD2  LEU  52          HD21      LEU  52   2.625  22.383  -2.339
  397   2HD2  LEU  52          HD22      LEU  52   2.765  21.707  -3.959
  398   3HD2  LEU  52          HD23      LEU  52   2.928  23.442  -3.713
  399    H    ILE  53           HN       ILE  53  -1.142  20.006  -1.439
  400    HA   ILE  53           HA       ILE  53  -3.399  21.025   0.245
  401    HB   ILE  53           HB       ILE  53  -3.449  19.020  -2.044
  402   1HG1  ILE  53          HG11      ILE  53  -2.953  21.347  -2.777
  403   2HG1  ILE  53          HG12      ILE  53  -4.476  20.729  -3.401
  404   1HG2  ILE  53          HG22      ILE  53  -5.476  20.050  -0.093
  405   2HG2  ILE  53          HG23      ILE  53  -6.024  19.851  -1.752
  406   3HG2  ILE  53          HG21      ILE  53  -5.387  18.471  -0.864
  407   1HD1  ILE  53          HD11      ILE  53  -5.003  21.903  -0.861
  408   2HD1  ILE  53          HD12      ILE  53  -4.039  23.049  -1.783
  409   3HD1  ILE  53          HD13      ILE  53  -5.558  22.449  -2.437
  410    OH   TYR  54           OH       TYR  54  -6.125  21.511   6.633
  411    H    TYR  54           HN       TYR  54  -4.629  19.274   1.317
  412    HA   TYR  54           HA       TYR  54  -3.276  16.709   1.698
  413   1HB   TYR  54           HB2      TYR  54  -2.849  17.001   4.092
  414   2HB   TYR  54           HB1      TYR  54  -2.096  18.358   3.261
  415    HD1  TYR  54           HD1      TYR  54  -3.321  20.583   3.206
  416    HD2  TYR  54           HD2      TYR  54  -4.621  17.357   5.654
  417    HE1  TYR  54           HE1      TYR  54  -4.653  22.139   4.555
  418    HE2  TYR  54           HE2      TYR  54  -5.946  18.918   7.004
  419    HH   TYR  54           HH       TYR  54  -5.515  22.083   7.103
  420    H    LYS  55           HN       LYS  55  -4.584  15.217   2.948
  421    HA   LYS  55           HA       LYS  55  -6.693  14.228   3.266
  422   1HB   LYS  55           HB2      LYS  55  -6.738  16.883   4.701
  423   2HB   LYS  55           HB1      LYS  55  -8.241  15.973   4.609
  424   1HG   LYS  55           HG1      LYS  55  -6.441  14.008   5.318
  425   2HG   LYS  55           HG2      LYS  55  -5.790  15.407   6.161
  426   1HD   LYS  55           HD1      LYS  55  -8.236  15.825   6.936
  427   2HD   LYS  55           HD2      LYS  55  -8.535  14.167   6.429
  428   1HE   LYS  55           HE1      LYS  55  -6.318  14.961   8.346
  429   2HE   LYS  55           HE2      LYS  55  -7.906  14.414   8.871
  430   1HZ   LYS  55           HZ1      LYS  55  -6.808  12.449   8.853
  431   2HZ   LYS  55           HZ2      LYS  55  -7.338  12.455   7.239
  432    H    VAL  56           HN       VAL  56  -6.187  15.919   0.872
  433    HA   VAL  56           HA       VAL  56  -7.303  16.525  -1.060
  434    HB   VAL  56           HB       VAL  56  -9.577  15.101   0.388
  435   1HG1  VAL  56          HG12      VAL  56  -9.420  16.250  -2.417
  436   2HG1  VAL  56          HG13      VAL  56 -10.585  15.014  -1.954
  437   3HG1  VAL  56          HG11      VAL  56 -10.631  16.597  -1.187
  438   1HG2  VAL  56          HG23      VAL  56  -7.671  14.339  -1.849
  439   2HG2  VAL  56          HG21      VAL  56  -7.717  13.652  -0.228
  440   3HG2  VAL  56          HG22      VAL  56  -9.043  13.359  -1.348
  441    H    SER  57           HN       SER  57  -7.875  18.418  -1.686
  442    HA   SER  57           HA       SER  57  -8.546  20.641  -1.616
  443   1HB   SER  57           HB2      SER  57 -11.060  20.836  -1.390
  444   2HB   SER  57           HB1      SER  57 -10.590  19.478  -2.431
  445    HG   SER  57           HG       SER  57 -10.776  19.106   0.349
  446    H    ASN  58           HN       ASN  58  -7.133  20.470   0.557
  447    HA   ASN  58           HA       ASN  58  -8.832  21.853   2.601
  448   1HB   ASN  58           HB2      ASN  58  -6.534  19.903   3.062
  449   2HB   ASN  58           HB1      ASN  58  -7.266  20.867   4.338
  450   1HD2  ASN  58          HD22      ASN  58 -10.475  18.973   3.256
  451   2HD2  ASN  58          HD21      ASN  58  -9.963  20.520   2.788
  452    NH1  ARG  59           NH1      ARG  59  -9.362  25.758  -3.032
  453    NH2  ARG  59           NH2      ARG  59  -9.506  27.606  -1.718
  454    H    ARG  59           HN       ARG  59  -5.915  21.844   0.776
  455    HA   ARG  59           HA       ARG  59  -4.172  23.392   0.591
  456   1HB   ARG  59           HB2      ARG  59  -6.302  25.223   1.794
  457   2HB   ARG  59           HB1      ARG  59  -4.867  25.763   0.930
  458   1HG   ARG  59           HG1      ARG  59  -5.626  24.601  -1.105
  459   2HG   ARG  59           HG2      ARG  59  -7.033  23.984  -0.248
  460   1HD   ARG  59           HD1      ARG  59  -7.072  26.762   0.208
  461   2HD   ARG  59           HD2      ARG  59  -6.645  26.582  -1.493
  462    HE   ARG  59           HE       ARG  59  -8.983  25.055  -0.450
  463   1HH1  ARG  59          HH11      ARG  59  -9.064  24.811  -3.146
  464   2HH1  ARG  59          HH12      ARG  59  -9.830  26.227  -3.779
  465   1HH2  ARG  59          HH21      ARG  59  -9.317  28.049  -0.841
  466   2HH2  ARG  59          HH22      ARG  59  -9.977  28.111  -2.441
  467    H    PHE  60           HN       PHE  60  -2.584  22.824   1.952
  468    HA   PHE  60           HA       PHE  60  -2.687  22.911   4.797
  469   1HB   PHE  60           HB2      PHE  60  -0.979  21.720   3.271
  470   2HB   PHE  60           HB1      PHE  60  -0.177  23.279   3.109
  471    HD1  PHE  60           HD1      PHE  60  -1.498  20.979   5.760
  472    HD2  PHE  60           HD2      PHE  60   1.445  23.871   4.701
  473    HE1  PHE  60           HE1      PHE  60  -0.372  20.625   7.913
  474    HE2  PHE  60           HE2      PHE  60   2.568  23.513   6.855
  475    HZ   PHE  60           HZ       PHE  60   1.661  21.891   8.464
  476    H    SER  61           HN       SER  61  -1.468  24.311   6.241
  477    HA   SER  61           HA       SER  61  -2.154  27.043   5.975
  478   1HB   SER  61           HB2      SER  61  -0.348  27.335   7.834
  479   2HB   SER  61           HB1      SER  61  -1.610  26.139   8.188
  480    HG   SER  61           HG       SER  61   0.855  25.569   6.887
  481    H    GLY  62           HN       GLY  62  -1.452  28.372   4.462
  482   1HA   GLY  62           HA1      GLY  62   0.454  29.826   3.780
  483   2HA   GLY  62           HA2      GLY  62   1.473  28.388   3.812
  484    H    VAL  63           HN       VAL  63  -1.547  27.626   2.656
  485    HA   VAL  63           HA       VAL  63  -0.596  27.792  -0.173
  486    HB   VAL  63           HB       VAL  63  -2.488  25.861   1.248
  487   1HG1  VAL  63          HG13      VAL  63  -1.859  26.251  -1.685
  488   2HG1  VAL  63          HG11      VAL  63  -2.374  24.686  -1.065
  489   3HG1  VAL  63          HG12      VAL  63  -3.437  26.082  -0.921
  490   1HG2  VAL  63          HG23      VAL  63   0.192  25.788   1.264
  491   2HG2  VAL  63          HG21      VAL  63  -0.762  24.316   1.141
  492   3HG2  VAL  63          HG22      VAL  63  -0.066  25.037  -0.306
  493    HA   PRO  64           HA       PRO  64  -3.917  30.835  -0.258
  494   1HB   PRO  64           HB2      PRO  64  -3.231  31.252  -3.054
  495   2HB   PRO  64           HB1      PRO  64  -2.936  32.335  -1.694
  496   1HG   PRO  64           HG1      PRO  64  -1.004  30.745  -3.125
  497   2HG   PRO  64           HG2      PRO  64  -0.712  31.811  -1.749
  498   1HD   PRO  64           HD1      PRO  64  -0.696  28.922  -1.788
  499   2HD   PRO  64           HD2      PRO  64  -0.396  29.992  -0.405
  500    H    ASP  65           HN       ASP  65  -5.908  30.985  -1.369
  501    HA   ASP  65           HA       ASP  65  -7.235  28.614  -1.991
  502   1HB   ASP  65           HB2      ASP  65  -7.683  31.521  -2.465
  503   2HB   ASP  65           HB1      ASP  65  -8.587  30.463  -3.543
  504    NH1  ARG  66           NH2      ARG  66  -2.414  33.572  -5.573
  505    NH2  ARG  66           NH1      ARG  66  -4.133  34.324  -4.285
  506    H    ARG  66           HN       ARG  66  -4.973  30.246  -3.927
  507    HA   ARG  66           HA       ARG  66  -5.778  29.735  -6.559
  508   1HB   ARG  66           HB2      ARG  66  -3.350  30.409  -5.172
  509   2HB   ARG  66           HB1      ARG  66  -2.966  29.092  -6.269
  510   1HG   ARG  66           HG1      ARG  66  -2.666  31.175  -7.473
  511   2HG   ARG  66           HG2      ARG  66  -4.095  30.378  -8.115
  512   1HD   ARG  66           HD1      ARG  66  -4.212  32.939  -7.499
  513   2HD   ARG  66           HD2      ARG  66  -5.565  31.891  -7.085
  514    HE   ARG  66           HE       ARG  66  -4.760  31.870  -4.764
  515   1HH1  ARG  66          HH21      ARG  66  -2.053  32.878  -6.196
  516   2HH1  ARG  66          HH22      ARG  66  -1.847  34.352  -5.311
  517   1HH2  ARG  66          HH11      ARG  66  -5.063  34.196  -3.940
  518   2HH2  ARG  66          HH12      ARG  66  -3.599  35.119  -4.001
  519    H    PHE  67           HN       PHE  67  -4.387  27.496  -4.217
  520    HA   PHE  67           HA       PHE  67  -4.340  25.359  -6.271
  521   1HB   PHE  67           HB2      PHE  67  -3.380  25.512  -3.384
  522   2HB   PHE  67           HB1      PHE  67  -3.271  24.046  -4.357
  523    HD1  PHE  67           HD1      PHE  67  -2.074  27.531  -4.027
  524    HD2  PHE  67           HD2      PHE  67  -1.701  23.886  -6.192
  525    HE1  PHE  67           HE1      PHE  67  -0.046  28.386  -5.121
  526    HE2  PHE  67           HE2      PHE  67   0.312  24.746  -7.294
  527    HZ   PHE  67           HZ       PHE  67   1.150  26.993  -6.756
  528    H    SER  68           HN       SER  68  -5.815  23.867  -6.471
  529    HA   SER  68           HA       SER  68  -7.679  23.319  -4.200
  530   1HB   SER  68           HB2      SER  68  -8.289  24.502  -6.790
  531   2HB   SER  68           HB1      SER  68  -9.085  22.920  -6.674
  532    HG   SER  68           HG       SER  68 -10.251  24.698  -5.666
  533    H    GLY  69           HN       GLY  69  -6.646  21.387  -3.700
  534   1HA   GLY  69           HA1      GLY  69  -6.174  19.376  -5.799
  535   2HA   GLY  69           HA2      GLY  69  -5.827  19.179  -4.085
  536    H    SER  70           HN       SER  70  -7.976  18.454  -6.594
  537    HA   SER  70           HA       SER  70 -10.028  17.492  -4.633
  538   1HB   SER  70           HB2      SER  70 -10.284  18.213  -7.601
  539   2HB   SER  70           HB1      SER  70 -11.610  17.580  -6.606
  540    HG   SER  70           HG       SER  70 -10.894  20.065  -6.773
  541    H    GLY  71           HN       GLY  71 -11.373  15.635  -5.896
  542   1HA   GLY  71           HA1      GLY  71 -10.412  13.776  -7.629
  543   2HA   GLY  71           HA2      GLY  71  -9.420  13.457  -6.212
  544    H    SER  72           HN       SER  72 -12.168  12.520  -7.759
  545    HA   SER  72           HA       SER  72 -13.649  11.891  -5.258
  546   1HB   SER  72           HB2      SER  72 -14.890  12.902  -7.212
  547   2HB   SER  72           HB1      SER  72 -14.495  11.461  -8.169
  548    HG   SER  72           HG       SER  72 -15.549  10.197  -6.648
  549    H    GLY  73           HN       GLY  73 -11.750  10.303  -4.858
  550   1HA   GLY  73           HA1      GLY  73 -12.099   7.821  -4.418
  551   2HA   GLY  73           HA2      GLY  73 -12.463   7.679  -6.133
  552    H    THR  74           HN       THR  74 -10.834   7.162  -7.459
  553    HA   THR  74           HA       THR  74  -8.086   7.180  -6.316
  554    HB   THR  74           HB       THR  74  -7.592   5.533  -8.188
  555    HG1  THR  74           HG1      THR  74  -9.006   6.172  -9.720
  556   1HG2  THR  74          HG23      THR  74  -9.904   5.110  -6.277
  557   2HG2  THR  74          HG21      THR  74  -9.682   3.921  -7.555
  558   3HG2  THR  74          HG22      THR  74  -8.396   4.208  -6.387
  559    H    ASP  75           HN       ASP  75  -9.818   9.246  -7.887
  560    HA   ASP  75           HA       ASP  75  -7.679  10.006  -9.837
  561   1HB   ASP  75           HB2      ASP  75  -9.517  11.302 -10.971
  562   2HB   ASP  75           HB1      ASP  75  -9.917   9.591 -10.865
  563    H    PHE  76           HN       PHE  76  -6.771  12.009  -9.664
  564    HA   PHE  76           HA       PHE  76  -7.989  13.988  -7.839
  565   1HB   PHE  76           HB2      PHE  76  -5.164  12.871  -7.470
  566   2HB   PHE  76           HB1      PHE  76  -5.830  14.230  -6.567
  567    HD1  PHE  76           HD1      PHE  76  -7.695  13.863  -4.961
  568    HD2  PHE  76           HD2      PHE  76  -5.888  10.593  -7.007
  569    HE1  PHE  76           HE1      PHE  76  -8.835  12.289  -3.459
  570    HE2  PHE  76           HE2      PHE  76  -7.014   9.027  -5.489
  571    HZ   PHE  76           HZ       PHE  76  -8.464   9.874  -3.698
  572    H    THR  77           HN       THR  77  -7.064  16.117  -8.053
  573    HA   THR  77           HA       THR  77  -5.170  16.508 -10.294
  574    HB   THR  77           HB       THR  77  -7.956  17.813 -10.292
  575    HG1  THR  77           HG1      THR  77  -6.809  15.511 -11.462
  576   1HG2  THR  77          HG22      THR  77  -5.857  18.819 -11.623
  577   2HG2  THR  77          HG23      THR  77  -6.067  17.401 -12.647
  578   3HG2  THR  77          HG21      THR  77  -7.365  18.577 -12.497
  579    H    LEU  78           HN       LEU  78  -4.258  18.581 -10.393
  580    HA   LEU  78           HA       LEU  78  -4.697  20.240  -7.936
  581   1HB   LEU  78           HB2      LEU  78  -2.417  19.013  -8.304
  582   2HB   LEU  78           HB1      LEU  78  -2.147  20.155  -9.611
  583    HG   LEU  78           HG       LEU  78  -2.927  21.155  -6.872
  584   1HD1  LEU  78          HD13      LEU  78  -0.283  20.059  -7.770
  585   2HD1  LEU  78          HD11      LEU  78  -0.293  21.479  -6.727
  586   3HD1  LEU  78          HD12      LEU  78  -1.041  19.983  -6.184
  587   1HD2  LEU  78          HD22      LEU  78  -1.811  22.235  -9.411
  588   2HD2  LEU  78          HD23      LEU  78  -2.888  22.997  -8.246
  589   3HD2  LEU  78          HD21      LEU  78  -1.159  22.921  -7.929
  590    H    LYS  79           HN       LYS  79  -6.209  21.608  -8.849
  591    HA   LYS  79           HA       LYS  79  -5.518  22.989 -11.365
  592   1HB   LYS  79           HB2      LYS  79  -7.968  22.614  -9.692
  593   2HB   LYS  79           HB1      LYS  79  -7.870  24.124 -10.592
  594   1HG   LYS  79           HG1      LYS  79  -7.969  23.068 -12.646
  595   2HG   LYS  79           HG2      LYS  79  -7.146  21.627 -12.061
  596   1HD   LYS  79           HD1      LYS  79  -9.348  21.328 -10.617
  597   2HD   LYS  79           HD2      LYS  79 -10.053  22.365 -11.852
  598   1HE   LYS  79           HE1      LYS  79  -8.513  20.488 -13.276
  599   2HE   LYS  79           HE2      LYS  79  -9.317  19.555 -12.019
  600   1HZ   LYS  79           HZ1      LYS  79 -10.602  21.337 -14.010
  601   2HZ   LYS  79           HZ2      LYS  79 -10.725  19.645 -13.917
  602    H    ILE  80           HN       ILE  80  -4.609  24.912 -11.453
  603    HA   ILE  80           HA       ILE  80  -4.621  26.597  -8.989
  604    HB   ILE  80           HB       ILE  80  -2.579  26.561 -11.258
  605   1HG1  ILE  80          HG11      ILE  80  -1.956  25.646  -8.470
  606   2HG1  ILE  80          HG12      ILE  80  -2.798  24.539  -9.545
  607   1HG2  ILE  80          HG21      ILE  80  -2.818  28.032  -8.599
  608   2HG2  ILE  80          HG22      ILE  80  -1.253  27.822  -9.378
  609   3HG2  ILE  80          HG23      ILE  80  -2.528  28.720 -10.193
  610   1HD1  ILE  80          HD11      ILE  80  -0.412  25.971 -10.642
  611   2HD1  ILE  80          HD12      ILE  80  -0.123  24.665  -9.498
  612   3HD1  ILE  80          HD13      ILE  80  -0.999  24.348 -10.992
  613    H    SER  81           HN       SER  81  -5.422  28.548  -9.070
  614    HA   SER  81           HA       SER  81  -6.962  29.338 -11.289
  615   1HB   SER  81           HB2      SER  81  -5.844  31.008  -8.986
  616   2HB   SER  81           HB1      SER  81  -7.106  31.573 -10.094
  617    HG   SER  81           HG       SER  81  -8.464  30.059  -9.360
  618    NH1  ARG  82           NH2      ARG  82  -0.826  34.917  -9.247
  619    NH2  ARG  82           NH1      ARG  82  -1.200  36.543  -7.706
  620    H    ARG  82           HN       ARG  82  -4.218  31.251 -10.095
  621    HA   ARG  82           HA       ARG  82  -3.434  31.694 -12.947
  622   1HB   ARG  82           HB2      ARG  82  -2.577  33.984 -11.960
  623   2HB   ARG  82           HB1      ARG  82  -4.297  33.805 -12.272
  624   1HG   ARG  82           HG1      ARG  82  -4.795  33.460  -9.970
  625   2HG   ARG  82           HG2      ARG  82  -3.114  33.129  -9.570
  626   1HD   ARG  82           HD1      ARG  82  -2.904  35.641 -10.648
  627   2HD   ARG  82           HD2      ARG  82  -4.495  35.732  -9.889
  628    HE   ARG  82           HE       ARG  82  -3.421  35.246  -7.736
  629   1HH1  ARG  82          HH21      ARG  82  -1.188  34.205  -9.851
  630   2HH1  ARG  82          HH22      ARG  82   0.153  35.102  -9.224
  631   1HH2  ARG  82          HH11      ARG  82  -1.848  37.060  -7.149
  632   2HH2  ARG  82          HH12      ARG  82  -0.220  36.746  -7.654
  633    H    VAL  83           HN       VAL  83  -1.744  30.351 -13.094
  634    HA   VAL  83           HA       VAL  83   0.137  29.673 -11.115
  635    HB   VAL  83           HB       VAL  83   0.514  29.945 -14.135
  636   1HG1  VAL  83          HG13      VAL  83   2.646  29.722 -12.769
  637   2HG1  VAL  83          HG11      VAL  83   2.031  28.180 -12.188
  638   3HG1  VAL  83          HG12      VAL  83   2.366  28.404 -13.900
  639   1HG2  VAL  83          HG22      VAL  83  -1.099  28.192 -12.538
  640   2HG2  VAL  83          HG23      VAL  83  -0.859  28.157 -14.281
  641   3HG2  VAL  83          HG21      VAL  83   0.215  27.246 -13.225
  642    H    GLU  84           HN       GLU  84   2.142  30.419 -10.528
  643    HA   GLU  84           HA       GLU  84   2.914  33.132 -11.541
  644   1HB   GLU  84           HB2      GLU  84   2.755  32.038  -8.708
  645   2HB   GLU  84           HB1      GLU  84   3.818  33.390  -9.083
  646    HG   GLU  84           HG1      GLU  84   1.167  33.772 -10.254
  647    H    ALA  85           HN       ALA  85   5.267  33.629 -10.852
  648    HA   ALA  85           HA       ALA  85   7.002  31.816 -12.140
  649   1HB   ALA  85           HB1      ALA  85   7.513  34.231 -11.611
  650   2HB   ALA  85           HB2      ALA  85   7.723  33.788  -9.920
  651   3HB   ALA  85           HB3      ALA  85   8.825  33.156 -11.139
  652    H    GLU  86           HN       GLU  86   5.965  31.896  -8.802
  653    HA   GLU  86           HA       GLU  86   7.998  30.168  -7.744
  654   1HB   GLU  86           HB2      GLU  86   5.144  30.802  -6.904
  655   2HB   GLU  86           HB1      GLU  86   6.166  29.715  -5.969
  656   1HG   GLU  86           HG1      GLU  86   7.020  32.514  -6.747
  657   2HG   GLU  86           HG2      GLU  86   6.218  32.149  -5.223
  658    H    ASP  87           HN       ASP  87   4.820  29.557  -9.116
  659    HA   ASP  87           HA       ASP  87   4.569  26.810  -8.593
  660   1HB   ASP  87           HB2      ASP  87   3.661  28.644 -10.802
  661   2HB   ASP  87           HB1      ASP  87   3.479  26.913 -11.060
  662    H    LEU  88           HN       LEU  88   6.547  28.426 -11.006
  663    HA   LEU  88           HA       LEU  88   7.177  26.238 -12.664
  664   1HB   LEU  88           HB2      LEU  88   9.132  28.377 -11.719
  665   2HB   LEU  88           HB1      LEU  88   9.251  27.447 -13.203
  666    HG   LEU  88           HG       LEU  88   7.095  29.475 -12.512
  667   1HD1  LEU  88          HD11      LEU  88   9.496  30.124 -13.357
  668   2HD1  LEU  88          HD12      LEU  88   8.932  29.497 -14.904
  669   3HD1  LEU  88          HD13      LEU  88   8.096  30.847 -14.141
  670   1HD2  LEU  88          HD21      LEU  88   7.301  27.362 -14.635
  671   2HD2  LEU  88          HD22      LEU  88   5.876  27.950 -13.783
  672   3HD2  LEU  88          HD23      LEU  88   6.592  28.913 -15.070
  673    H    GLY  89           HN       GLY  89   8.301  24.458 -12.432
  674   1HA   GLY  89           HA1      GLY  89  10.578  23.764 -11.174
  675   2HA   GLY  89           HA2      GLY  89   9.486  23.842  -9.792
  676    H    ILE  90           HN       ILE  90   9.377  21.685  -9.299
  677    HA   ILE  90           HA       ILE  90   8.167  19.942 -11.408
  678    HB   ILE  90           HB       ILE  90  10.044  19.005  -9.188
  679   1HG1  ILE  90          HG11      ILE  90  11.555  18.722 -11.387
  680   2HG1  ILE  90          HG12      ILE  90  10.610  20.106 -11.918
  681   1HG2  ILE  90          HG23      ILE  90   8.447  17.360 -10.310
  682   2HG2  ILE  90          HG21      ILE  90   9.213  17.741 -11.848
  683   3HG2  ILE  90          HG22      ILE  90  10.143  16.965 -10.571
  684   1HD1  ILE  90          HD11      ILE  90  11.224  20.951  -9.427
  685   2HD1  ILE  90          HD12      ILE  90  12.614  19.912  -9.717
  686   3HD1  ILE  90          HD13      ILE  90  12.274  21.252 -10.807
  687    OH   TYR  91           OH       TYR  91   2.441  24.554  -7.501
  688    H    TYR  91           HN       TYR  91   6.175  19.449 -10.863
  689    HA   TYR  91           HA       TYR  91   5.327  19.564  -8.049
  690   1HB   TYR  91           HB2      TYR  91   4.028  19.585 -10.730
  691   2HB   TYR  91           HB1      TYR  91   3.102  18.778  -9.467
  692    HD1  TYR  91           HD1      TYR  91   2.441  20.033  -7.420
  693    HD2  TYR  91           HD2      TYR  91   4.419  21.976 -10.647
  694    HE1  TYR  91           HE1      TYR  91   1.816  22.213  -6.489
  695    HE2  TYR  91           HE2      TYR  91   3.797  24.157  -9.711
  696    HH   TYR  91           HH       TYR  91   2.400  25.191  -8.219
  697    H    PHE  92           HN       PHE  92   4.222  17.926  -6.996
  698    HA   PHE  92           HA       PHE  92   4.248  15.166  -8.070
  699   1HB   PHE  92           HB2      PHE  92   5.917  16.110  -5.685
  700   2HB   PHE  92           HB1      PHE  92   5.524  14.417  -5.954
  701    HD1  PHE  92           HD1      PHE  92   6.082  13.534  -8.398
  702    HD2  PHE  92           HD2      PHE  92   7.890  16.950  -6.615
  703    HE1  PHE  92           HE1      PHE  92   8.002  13.309  -9.914
  704    HE2  PHE  92           HE2      PHE  92   9.806  16.727  -8.132
  705    HZ   PHE  92           HZ       PHE  92   9.863  14.907  -9.786
  706    H    CYS  93           HN       CYS  93   3.522  13.700  -6.067
  707    HA   CYS  93           HA       CYS  93   1.907  15.016  -4.045
  708   1HB   CYS  93           HB2      CYS  93  -0.249  14.660  -4.881
  709   2HB   CYS  93           HB1      CYS  93   0.620  15.173  -6.300
  710    H    SER  94           HN       SER  94   0.654  13.440  -2.719
  711    HA   SER  94           HA       SER  94   1.512  10.618  -3.054
  712   1HB   SER  94           HB2      SER  94   3.229  11.923  -1.630
  713   2HB   SER  94           HB1      SER  94   1.951  12.071  -0.408
  714    HG   SER  94           HG       SER  94   2.753   9.634  -1.641
  715    H    GLN  95           HN       GLN  95   0.722   9.467  -0.818
  716    HA   GLN  95           HA       GLN  95  -2.053  10.409  -0.260
  717   1HB   GLN  95           HB2      GLN  95  -2.600   7.819  -0.361
  718   2HB   GLN  95           HB1      GLN  95  -2.503   8.722  -1.867
  719   1HG   GLN  95           HG1      GLN  95  -0.324   7.891  -2.357
  720   2HG   GLN  95           HG2      GLN  95  -0.072   7.339  -0.703
  721   1HE2  GLN  95          HE22      GLN  95  -1.897   4.313  -1.149
  722   2HE2  GLN  95          HE21      GLN  95  -1.283   5.402  -0.001
  723    H    THR  96           HN       THR  96  -1.970  10.818   1.863
  724    HA   THR  96           HA       THR  96  -0.328   9.180   3.668
  725    HB   THR  96           HB       THR  96  -2.370  11.204   4.671
  726    HG1  THR  96           HG1      THR  96  -1.108  12.826   3.866
  727   1HG2  THR  96          HG23      THR  96  -0.596  10.070   6.172
  728   2HG2  THR  96          HG21      THR  96   0.634  10.848   5.180
  729   3HG2  THR  96          HG22      THR  96  -0.476  11.826   6.134
  730    H    THR  97           HN       THR  97  -2.212   7.641   2.387
  731    HA   THR  97           HA       THR  97  -4.215   7.057   4.535
  732    HB   THR  97           HB       THR  97  -4.792   5.663   2.033
  733    HG1  THR  97           HG1      THR  97  -4.634   8.475   1.784
  734   1HG2  THR  97          HG21      THR  97  -6.025   7.907   3.679
  735   2HG2  THR  97          HG22      THR  97  -6.666   7.576   2.074
  736   3HG2  THR  97          HG23      THR  97  -6.709   6.327   3.315
  737    H    HIS  98           HN       HIS  98  -2.421   5.368   1.965
  738    HA   HIS  98           HA       HIS  98  -2.457   2.897   3.578
  739   1HB   HIS  98           HB2      HIS  98  -1.301   3.538   0.822
  740   2HB   HIS  98           HB1      HIS  98  -1.334   1.928   1.536
  741    HD2  HIS  98           HD2      HIS  98  -3.868   4.622   0.172
  742    HE1  HIS  98           HE1      HIS  98  -5.833   1.002   0.510
  743    H    VAL  99           HN       VAL  99  -0.354   1.617   3.589
  744    HA   VAL  99           HA       VAL  99   2.003   3.381   4.014
  745    HB   VAL  99           HB       VAL  99   0.966   1.273   5.972
  746   1HG1  VAL  99          HG13      VAL  99   3.510   1.562   5.762
  747   2HG1  VAL  99          HG11      VAL  99   3.275   3.200   6.365
  748   3HG1  VAL  99          HG12      VAL  99   2.839   1.821   7.367
  749   1HG2  VAL  99          HG21      VAL  99   1.074   4.307   6.096
  750   2HG2  VAL  99          HG22      VAL  99  -0.371   3.300   6.103
  751   3HG2  VAL  99          HG23      VAL  99   0.721   3.282   7.483
  752    HA   PRO 100           HA       PRO 100   4.036   3.238   4.458
  753   1HB   PRO 100           HB2      PRO 100   5.993   3.373   2.365
  754   2HB   PRO 100           HB1      PRO 100   6.259   2.826   4.020
  755   1HG   PRO 100           HG1      PRO 100   6.180   1.228   1.595
  756   2HG   PRO 100           HG2      PRO 100   6.550   0.697   3.236
  757   1HD   PRO 100           HD1      PRO 100   4.125   0.244   1.728
  758   2HD   PRO 100           HD2      PRO 100   4.505  -0.315   3.365
  759    HA   PRO 101           HA       PRO 101   1.991   6.027   1.752
  760   1HB   PRO 101           HB2      PRO 101   3.731   8.247   2.412
  761   2HB   PRO 101           HB1      PRO 101   2.132   7.913   3.074
  762   1HG   PRO 101           HG1      PRO 101   4.700   7.615   4.385
  763   2HG   PRO 101           HG2      PRO 101   3.098   7.339   5.068
  764   1HD   PRO 101           HD1      PRO 101   5.057   5.359   4.330
  765   2HD   PRO 101           HD2      PRO 101   3.429   5.082   4.977
  766    H    THR 102           HN       THR 102   2.371   5.806  -0.380
  767    HA   THR 102           HA       THR 102   5.091   5.865  -1.435
  768    HB   THR 102           HB       THR 102   3.698   5.709  -3.690
  769    HG1  THR 102           HG1      THR 102   1.580   5.505  -3.358
  770   1HG2  THR 102          HG21      THR 102   3.367   3.641  -1.445
  771   2HG2  THR 102          HG22      THR 102   3.071   3.309  -3.148
  772   3HG2  THR 102          HG23      THR 102   4.700   3.674  -2.594
  773    H    PHE 103           HN       PHE 103   5.776   7.918  -0.955
  774    HA   PHE 103           HA       PHE 103   4.375  10.251  -2.059
  775   1HB   PHE 103           HB2      PHE 103   6.059   9.900   0.090
  776   2HB   PHE 103           HB1      PHE 103   7.208  10.484  -1.110
  777    HD1  PHE 103           HD1      PHE 103   6.852  12.716  -2.183
  778    HD2  PHE 103           HD2      PHE 103   4.353  11.358   0.988
  779    HE1  PHE 103           HE1      PHE 103   6.039  15.006  -1.838
  780    HE2  PHE 103           HE2      PHE 103   3.542  13.651   1.328
  781    HZ   PHE 103           HZ       PHE 103   4.380  15.475  -0.086
  782    H    GLY 104           HN       GLY 104   4.488  10.587  -4.175
  783   1HA   GLY 104           HA1      GLY 104   6.720  11.329  -5.607
  784   2HA   GLY 104           HA2      GLY 104   6.719   9.576  -5.769
  785    H    GLY 105           HN       GLY 105   6.372  11.566  -7.815
  786   1HA   GLY 105           HA1      GLY 105   4.106  10.423  -9.208
  787   2HA   GLY 105           HA2      GLY 105   3.795  12.090  -8.715
  788    H    GLY 106           HN       GLY 106   4.134  13.398 -10.471
  789   1HA   GLY 106           HA1      GLY 106   6.619  13.959 -11.497
  790   2HA   GLY 106           HA2      GLY 106   6.094  12.607 -12.487
  791    H    THR 107           HN       THR 107   5.907  15.922 -11.889
  792    HA   THR 107           HA       THR 107   4.537  16.420 -14.429
  793    HB   THR 107           HB       THR 107   3.317  17.407 -11.775
  794    HG1  THR 107           HG1      THR 107   2.624  15.505 -13.772
  795   1HG2  THR 107          HG21      THR 107   3.198  18.489 -14.423
  796   2HG2  THR 107          HG22      THR 107   1.710  17.565 -14.233
  797   3HG2  THR 107          HG23      THR 107   2.089  18.864 -13.106
  798    H    LYS 108           HN       LYS 108   6.144  17.711 -15.181
  799    HA   LYS 108           HA       LYS 108   7.348  19.679 -13.357
  800   1HB   LYS 108           HB2      LYS 108   9.094  19.886 -14.926
  801   2HB   LYS 108           HB1      LYS 108   8.622  18.198 -15.071
  802   1HG   LYS 108           HG1      LYS 108   7.943  18.481 -17.197
  803   2HG   LYS 108           HG2      LYS 108   7.009  19.901 -16.770
  804   1HD   LYS 108           HD1      LYS 108   8.818  20.470 -18.371
  805   2HD   LYS 108           HD2      LYS 108   9.032  21.293 -16.831
  806   1HE   LYS 108           HE1      LYS 108  10.922  20.108 -16.311
  807   2HE   LYS 108           HE2      LYS 108  10.302  18.617 -17.012
  808   1HZ   LYS 108           HZ1      LYS 108  10.856  19.350 -19.174
  809   2HZ   LYS 108           HZ2      LYS 108  11.206  20.923 -18.636
  810    H    LEU 109           HN       LEU 109   7.575  21.889 -13.852
  811    HA   LEU 109           HA       LEU 109   5.517  22.956 -15.726
  812   1HB   LEU 109           HB2      LEU 109   5.320  22.992 -12.904
  813   2HB   LEU 109           HB1      LEU 109   5.879  24.607 -13.312
  814    HG   LEU 109           HG       LEU 109   3.892  24.030 -15.227
  815   1HD1  LEU 109          HD12      LEU 109   3.246  22.134 -13.670
  816   2HD1  LEU 109          HD13      LEU 109   2.899  23.346 -12.441
  817   3HD1  LEU 109          HD11      LEU 109   1.970  23.318 -13.937
  818   1HD2  LEU 109          HD23      LEU 109   4.401  26.211 -14.106
  819   2HD2  LEU 109          HD21      LEU 109   2.681  25.833 -14.094
  820   3HD2  LEU 109          HD22      LEU 109   3.644  25.600 -12.638
  821    H    GLU 110           HN       GLU 110   7.053  23.567 -17.196
  822    HA   GLU 110           HA       GLU 110   9.125  25.506 -16.265
  823   1HB   GLU 110           HB2      GLU 110  10.182  24.992 -18.523
  824   2HB   GLU 110           HB1      GLU 110  10.048  23.583 -17.480
  825   1HG   GLU 110           HG1      GLU 110   7.999  22.875 -18.654
  826   2HG   GLU 110           HG2      GLU 110   8.056  24.319 -19.660
  827    H    ILE 111           HN       ILE 111   6.335  26.168 -16.672
  828    HA   ILE 111           HA       ILE 111   5.071  27.885 -17.589
  829    HB   ILE 111           HB       ILE 111   7.701  28.833 -17.325
  830   1HG1  ILE 111          HG11      ILE 111   5.353  30.517 -18.234
  831   2HG1  ILE 111          HG12      ILE 111   5.448  29.826 -16.620
  832   1HG2  ILE 111          HG22      ILE 111   7.752  28.542 -19.921
  833   2HG2  ILE 111          HG23      ILE 111   6.588  29.859 -19.970
  834   3HG2  ILE 111          HG21      ILE 111   8.193  30.127 -19.301
  835   1HD1  ILE 111          HD13      ILE 111   7.966  31.097 -17.310
  836   2HD1  ILE 111          HD11      ILE 111   6.635  32.233 -17.503
  837   3HD1  ILE 111          HD12      ILE 111   6.893  31.434 -15.956
  838    H    LYS 112           HN       LYS 112   4.532  29.013 -19.719
  839    HA   LYS 112           HA       LYS 112   4.340  26.936 -21.757
  840   1HB   LYS 112           HB2      LYS 112   2.584  28.764 -21.158
  841   2HB   LYS 112           HB1      LYS 112   3.590  29.868 -22.084
  842   1HG   LYS 112           HG1      LYS 112   3.446  27.935 -23.908
  843   2HG   LYS 112           HG2      LYS 112   1.984  27.512 -23.026
  844   1HD   LYS 112           HD1      LYS 112   0.859  29.255 -23.928
  845   2HD   LYS 112           HD2      LYS 112   2.114  30.385 -23.435
  846   1HE   LYS 112           HE1      LYS 112   2.472  28.579 -25.836
  847   2HE   LYS 112           HE2      LYS 112   1.677  30.143 -25.971
  848   1HZ   LYS 112           HZ1      LYS 112   4.472  29.539 -25.275
  849   2HZ   LYS 112           HZ2      LYS 112   3.862  30.640 -26.416
  850    NH1  ARG 113           NH1      ARG 113   7.946  23.377 -25.700
  851    NH2  ARG 113           NH2      ARG 113   6.193  22.703 -24.415
  852    H    ARG 113           HN       ARG 113   5.387  26.797 -23.667
  853    HA   ARG 113           HA       ARG 113   7.522  28.828 -24.193
  854   1HB   ARG 113           HB2      ARG 113   7.592  25.946 -25.156
  855   2HB   ARG 113           HB1      ARG 113   8.939  27.058 -24.971
  856   1HG   ARG 113           HG1      ARG 113   9.270  25.915 -23.013
  857   2HG   ARG 113           HG2      ARG 113   8.023  26.995 -22.406
  858   1HD   ARG 113           HD1      ARG 113   7.239  24.845 -21.794
  859   2HD   ARG 113           HD2      ARG 113   6.346  25.199 -23.270
  860    HE   ARG 113           HE       ARG 113   8.727  23.392 -23.130
  861   1HH1  ARG 113          HH11      ARG 113   8.830  23.837 -25.763
  862   2HH1  ARG 113          HH12      ARG 113   7.525  22.986 -26.518
  863   1HH2  ARG 113          HH21      ARG 113   5.764  22.659 -23.515
  864   2HH2  ARG 113          HH22      ARG 113   5.739  22.300 -25.208
   
  Start of MODEL           5
 Raw file had  865 H/Q atoms
  Start of MODEL    5
    1   1H    ASP   1           HT1      ASP   1   1.175   0.902  -0.174
    2   2H    ASP   1           HT2      ASP   1   0.874  -0.768  -0.110
    3   3H    ASP   1           HT3      ASP   1   2.359  -0.154   0.435
    4    HA   ASP   1           HA       ASP   1   2.989   0.499  -1.756
    5   1HB   ASP   1           HB2      ASP   1   2.775  -2.130  -0.889
    6   2HB   ASP   1           HB1      ASP   1   1.905  -2.194  -2.419
    7    H    VAL   2           HN       VAL   2   2.248   1.682  -3.207
    8    HA   VAL   2           HA       VAL   2   0.974   2.547  -4.892
    9    HB   VAL   2           HB       VAL   2   0.059  -0.357  -5.029
   10   1HG1  VAL   2          HG12      VAL   2  -0.909   2.055  -6.464
   11   2HG1  VAL   2          HG13      VAL   2  -0.491   0.693  -7.497
   12   3HG1  VAL   2          HG11      VAL   2  -1.698   0.497  -6.231
   13   1HG2  VAL   2          HG23      VAL   2   2.072   1.357  -6.499
   14   2HG2  VAL   2          HG21      VAL   2   2.343  -0.172  -5.670
   15   3HG2  VAL   2          HG22      VAL   2   1.463  -0.140  -7.194
   16    H    VAL   3           HN       VAL   3  -0.317   3.988  -3.934
   17    HA   VAL   3           HA       VAL   3  -2.621   3.237  -2.334
   18    HB   VAL   3           HB       VAL   3  -2.073   5.954  -3.607
   19   1HG1  VAL   3          HG11      VAL   3  -4.236   5.631  -2.414
   20   2HG1  VAL   3          HG12      VAL   3  -3.354   5.130  -0.975
   21   3HG1  VAL   3          HG13      VAL   3  -3.200   6.779  -1.572
   22   1HG2  VAL   3          HG23      VAL   3  -0.694   4.548  -1.328
   23   2HG2  VAL   3          HG21      VAL   3   0.003   5.561  -2.590
   24   3HG2  VAL   3          HG22      VAL   3  -0.898   6.296  -1.267
   25    H    MET   4           HN       MET   4  -4.440   2.481  -3.166
   26    HA   MET   4           HA       MET   4  -5.171   3.143  -5.961
   27   1HB   MET   4           HB2      MET   4  -6.102   1.097  -3.914
   28   2HB   MET   4           HB1      MET   4  -7.072   1.421  -5.346
   29   1HG   MET   4           HG1      MET   4  -4.449   1.165  -6.292
   30   2HG   MET   4           HG2      MET   4  -4.594  -0.082  -5.082
   31   1HE   MET   4           HE2      MET   4  -6.438   1.668  -7.750
   32   2HE   MET   4           HE3      MET   4  -5.452   0.780  -8.912
   33   3HE   MET   4           HE1      MET   4  -7.176   0.440  -8.778
   34    H    THR   5           HN       THR   5  -5.845   5.284  -5.696
   35    HA   THR   5           HA       THR   5  -7.885   5.989  -3.734
   36    HB   THR   5           HB       THR   5  -7.132   7.596  -6.235
   37    HG1  THR   5           HG1      THR   5  -5.781   7.002  -3.825
   38   1HG2  THR   5          HG23      THR   5  -7.802   8.336  -3.328
   39   2HG2  THR   5          HG21      THR   5  -7.424   9.491  -4.603
   40   3HG2  THR   5          HG22      THR   5  -8.906   8.543  -4.685
   41    H    GLN   6           HN       GLN   6  -9.891   5.265  -3.937
   42    HA   GLN   6           HA       GLN   6 -11.030   4.873  -6.652
   43   1HB   GLN   6           HB2      GLN   6 -11.098   3.047  -4.878
   44   2HB   GLN   6           HB1      GLN   6 -12.187   4.071  -3.950
   45   1HG   GLN   6           HG1      GLN   6 -13.855   4.003  -5.681
   46   2HG   GLN   6           HG2      GLN   6 -12.737   3.275  -6.821
   47   1HE2  GLN   6          HE22      GLN   6 -13.394   0.002  -5.738
   48   2HE2  GLN   6          HE21      GLN   6 -12.650   1.019  -6.874
   49    H    THR   7           HN       THR   7 -13.108   5.592  -7.162
   50    HA   THR   7           HA       THR   7 -14.536   7.495  -5.467
   51    HB   THR   7           HB       THR   7 -14.232   9.121  -7.732
   52    HG1  THR   7           HG1      THR   7 -11.860   7.666  -7.153
   53   1HG2  THR   7          HG22      THR   7 -13.774   9.624  -5.162
   54   2HG2  THR   7          HG23      THR   7 -12.120   9.140  -5.527
   55   3HG2  THR   7          HG21      THR   7 -12.833  10.523  -6.347
   56    HA   PRO   8           HA       PRO   8 -15.849   9.273  -6.191
   57   1HB   PRO   8           HB2      PRO   8 -18.676   9.294  -5.827
   58   2HB   PRO   8           HB1      PRO   8 -17.779  10.255  -7.003
   59   1HG   PRO   8           HG1      PRO   8 -19.531   7.988  -7.496
   60   2HG   PRO   8           HG2      PRO   8 -18.736   9.027  -8.678
   61   1HD   PRO   8           HD1      PRO   8 -18.021   6.316  -7.907
   62   2HD   PRO   8           HD2      PRO   8 -17.278   7.330  -9.159
   63    H    LEU   9           HN       LEU   9 -17.037   9.718  -3.989
   64    HA   LEU   9           HA       LEU   9 -16.403   7.543  -2.239
   65   1HB   LEU   9           HB2      LEU   9 -17.783  10.212  -1.976
   66   2HB   LEU   9           HB1      LEU   9 -17.969   9.069  -0.653
   67    HG   LEU   9           HG       LEU   9 -16.003  10.606  -0.357
   68   1HD1  LEU   9          HD11      LEU   9 -16.182   8.090   0.415
   69   2HD1  LEU   9          HD12      LEU   9 -14.932   7.825  -0.797
   70   3HD1  LEU   9          HD13      LEU   9 -14.638   8.927   0.545
   71   1HD2  LEU   9          HD23      LEU   9 -15.474  10.694  -2.836
   72   2HD2  LEU   9          HD21      LEU   9 -14.077  10.396  -1.808
   73   3HD2  LEU   9          HD22      LEU   9 -14.817   9.066  -2.693
   74    H    SER  10           HN       SER  10 -19.237   8.315  -4.019
   75    HA   SER  10           HA       SER  10 -20.511   5.849  -3.074
   76   1HB   SER  10           HB2      SER  10 -22.525   6.892  -2.204
   77   2HB   SER  10           HB1      SER  10 -21.203   7.842  -1.503
   78    HG   SER  10           HG       SER  10 -21.417   9.045  -3.641
   79    H    LEU  11           HN       LEU  11 -22.205   5.132  -4.439
   80    HA   LEU  11           HA       LEU  11 -22.482   6.685  -6.978
   81   1HB   LEU  11           HB2      LEU  11 -21.006   4.390  -6.721
   82   2HB   LEU  11           HB1      LEU  11 -22.575   3.701  -7.103
   83    HG   LEU  11           HG       LEU  11 -22.674   5.370  -9.055
   84   1HD1  LEU  11          HD13      LEU  11 -20.018   5.940  -7.879
   85   2HD1  LEU  11          HD11      LEU  11 -20.014   5.743  -9.629
   86   3HD1  LEU  11          HD12      LEU  11 -21.041   6.963  -8.882
   87   1HD2  LEU  11          HD22      LEU  11 -20.622   3.143  -8.905
   88   2HD2  LEU  11          HD23      LEU  11 -22.259   3.057  -9.544
   89   3HD2  LEU  11          HD21      LEU  11 -21.023   3.958 -10.413
   90    HA   PRO  12           HA       PRO  12 -26.657   5.583  -5.334
   91   1HB   PRO  12           HB2      PRO  12 -27.616   8.160  -6.115
   92   2HB   PRO  12           HB1      PRO  12 -27.251   7.640  -4.470
   93   1HG   PRO  12           HG1      PRO  12 -25.751   9.491  -6.158
   94   2HG   PRO  12           HG2      PRO  12 -25.497   9.113  -4.454
   95   1HD   PRO  12           HD1      PRO  12 -23.905   8.257  -6.691
   96   2HD   PRO  12           HD2      PRO  12 -23.693   7.815  -4.986
   97    H    VAL  13           HN       VAL  13 -27.226   4.229  -6.997
   98    HA   VAL  13           HA       VAL  13 -28.255   5.544  -9.470
   99    HB   VAL  13           HB       VAL  13 -27.266   3.670 -10.816
  100   1HG1  VAL  13          HG12      VAL  13 -26.022   5.861 -10.292
  101   2HG1  VAL  13          HG13      VAL  13 -25.099   4.931  -9.116
  102   3HG1  VAL  13          HG11      VAL  13 -25.028   4.508 -10.824
  103   1HG2  VAL  13          HG23      VAL  13 -26.065   2.891  -8.133
  104   2HG2  VAL  13          HG21      VAL  13 -27.202   1.940  -9.084
  105   3HG2  VAL  13          HG22      VAL  13 -25.566   2.210  -9.678
  106    H    SER  14           HN       SER  14 -29.110   3.382 -10.848
  107    HA   SER  14           HA       SER  14 -31.111   2.148  -8.993
  108   1HB   SER  14           HB2      SER  14 -31.410   3.651 -11.509
  109   2HB   SER  14           HB1      SER  14 -32.175   2.054 -11.612
  110    HG   SER  14           HG       SER  14 -33.666   2.898 -10.390
  111    H    LEU  15           HN       LEU  15 -31.769   0.000  -9.469
  112    HA   LEU  15           HA       LEU  15 -29.600  -1.629 -10.502
  113   1HB   LEU  15           HB2      LEU  15 -32.434  -2.452  -9.724
  114   2HB   LEU  15           HB1      LEU  15 -31.043  -3.521  -9.877
  115    HG   LEU  15           HG       LEU  15 -31.310  -1.233  -7.898
  116   1HD1  LEU  15          HD11      LEU  15 -31.387  -4.248  -7.580
  117   2HD1  LEU  15          HD12      LEU  15 -31.248  -3.123  -6.232
  118   3HD1  LEU  15          HD13      LEU  15 -32.692  -3.116  -7.239
  119   1HD2  LEU  15          HD23      LEU  15 -29.020  -2.829  -8.846
  120   2HD2  LEU  15          HD21      LEU  15 -29.033  -1.298  -7.978
  121   3HD2  LEU  15          HD22      LEU  15 -29.194  -2.813  -7.095
  122    H    GLY  16           HN       GLY  16 -29.442  -0.980 -12.616
  123   1HA   GLY  16           HA1      GLY  16 -30.421  -2.530 -14.636
  124   2HA   GLY  16           HA2      GLY  16 -31.695  -1.324 -14.469
  125    H    ASP  17           HN       ASP  17 -29.684   0.689 -13.599
  126    HA   ASP  17           HA       ASP  17 -29.003   1.647 -16.281
  127   1HB   ASP  17           HB2      ASP  17 -28.909   2.721 -13.462
  128   2HB   ASP  17           HB1      ASP  17 -27.898   3.505 -14.671
  129    H    GLN  18           HN       GLN  18 -26.654   2.940 -16.020
  130    HA   GLN  18           HA       GLN  18 -24.745   0.672 -15.665
  131   1HB   GLN  18           HB2      GLN  18 -24.536   3.256 -17.285
  132   2HB   GLN  18           HB1      GLN  18 -23.268   2.039 -17.191
  133   1HG   GLN  18           HG1      GLN  18 -25.039   0.356 -18.005
  134   2HG   GLN  18           HG2      GLN  18 -26.031   1.756 -18.402
  135   1HE2  GLN  18          HE22      GLN  18 -24.410   1.906 -21.523
  136   2HE2  GLN  18          HE21      GLN  18 -25.876   1.832 -20.671
  137    H    ALA  19           HN       ALA  19 -22.996   0.851 -14.373
  138    HA   ALA  19           HA       ALA  19 -22.756   3.367 -12.761
  139   1HB   ALA  19           HB3      ALA  19 -22.649   0.453 -12.109
  140   2HB   ALA  19           HB1      ALA  19 -21.442   1.443 -11.294
  141   3HB   ALA  19           HB2      ALA  19 -23.155   1.801 -11.096
  142    H    SER  20           HN       SER  20 -20.697   4.232 -12.404
  143    HA   SER  20           HA       SER  20 -18.420   2.869 -13.762
  144   1HB   SER  20           HB2      SER  20 -17.759   5.148 -14.719
  145   2HB   SER  20           HB1      SER  20 -19.299   4.554 -15.368
  146    HG   SER  20           HG       SER  20 -18.860   6.413 -13.272
  147    H    ILE  21           HN       ILE  21 -17.495   2.383 -11.776
  148    HA   ILE  21           HA       ILE  21 -16.926   4.602  -9.901
  149    HB   ILE  21           HB       ILE  21 -16.025   1.693  -9.761
  150   1HG1  ILE  21          HG11      ILE  21 -18.322   2.565  -8.105
  151   2HG1  ILE  21          HG12      ILE  21 -18.659   2.481  -9.829
  152   1HG2  ILE  21          HG21      ILE  21 -16.353   3.944  -7.722
  153   2HG2  ILE  21          HG22      ILE  21 -16.054   2.271  -7.262
  154   3HG2  ILE  21          HG23      ILE  21 -14.849   3.158  -8.191
  155   1HD1  ILE  21          HD13      ILE  21 -17.626   0.158  -9.815
  156   2HD1  ILE  21          HD11      ILE  21 -17.593   0.264  -8.059
  157   3HD1  ILE  21          HD12      ILE  21 -19.132   0.300  -8.914
  158    H    SER  22           HN       SER  22 -15.126   5.693  -9.923
  159    HA   SER  22           HA       SER  22 -12.970   4.993 -11.791
  160   1HB   SER  22           HB2      SER  22 -13.165   7.312 -11.886
  161   2HB   SER  22           HB1      SER  22 -13.883   7.405 -10.267
  162    HG   SER  22           HG       SER  22 -11.970   7.698  -9.466
  163    H    CYS  23           HN       CYS  23 -10.757   4.940 -11.207
  164    HA   CYS  23           HA       CYS  23  -9.943   4.709  -8.421
  165   1HB   CYS  23           HB2      CYS  23 -10.243   2.286 -10.210
  166   2HB   CYS  23           HB1      CYS  23  -9.069   2.295  -8.921
  167    NH1  ARG  24           NH2      ARG  24  -3.659  11.628 -11.427
  168    NH2  ARG  24           NH1      ARG  24  -5.787  11.860 -12.191
  169    H    ARG  24           HN       ARG  24  -8.116   5.828  -8.537
  170    HA   ARG  24           HA       ARG  24  -6.295   5.349 -10.863
  171   1HB   ARG  24           HB2      ARG  24  -7.030   7.669 -10.712
  172   2HB   ARG  24           HB1      ARG  24  -6.679   7.725  -8.989
  173   1HG   ARG  24           HG1      ARG  24  -4.254   7.334  -9.525
  174   2HG   ARG  24           HG2      ARG  24  -4.654   7.439 -11.233
  175   1HD   ARG  24           HD1      ARG  24  -5.646   9.664  -9.521
  176   2HD   ARG  24           HD2      ARG  24  -3.902   9.588  -9.761
  177    HE   ARG  24           HE       ARG  24  -5.284   9.283 -12.282
  178   1HH1  ARG  24          HH21      ARG  24  -2.942  11.035 -11.064
  179   2HH1  ARG  24          HH22      ARG  24  -3.482  12.601 -11.562
  180   1HH2  ARG  24          HH11      ARG  24  -6.671  11.442 -12.402
  181   2HH2  ARG  24          HH12      ARG  24  -5.648  12.838 -12.341
  182    H    SER  25           HN       SER  25  -4.193   4.799 -10.529
  183    HA   SER  25           HA       SER  25  -3.462   3.972  -7.771
  184   1HB   SER  25           HB2      SER  25  -3.039   2.221  -9.395
  185   2HB   SER  25           HB1      SER  25  -2.321   3.363 -10.546
  186    HG   SER  25           HG       SER  25  -0.699   2.258  -9.363
  187    H    SER  26           HN       SER  26  -1.129   4.333  -7.151
  188    HA   SER  26           HA       SER  26  -0.561   7.192  -7.431
  189   1HB   SER  26           HB2      SER  26   1.603   6.065  -6.051
  190   2HB   SER  26           HB1      SER  26   0.112   6.634  -5.277
  191    HG   SER  26           HG       SER  26  -0.769   4.588  -5.529
  192    H    GLN  27           HN       GLN  27   1.000   4.167  -8.418
  193    HA   GLN  27           HA       GLN  27   2.578   5.772 -10.364
  194   1HB   GLN  27           HB2      GLN  27   3.679   4.703  -8.062
  195   2HB   GLN  27           HB1      GLN  27   3.964   3.403  -9.215
  196   1HG   GLN  27           HG1      GLN  27   5.003   5.022 -10.775
  197   2HG   GLN  27           HG2      GLN  27   4.723   6.315  -9.614
  198   1HE2  GLN  27          HE22      GLN  27   7.542   5.509  -7.662
  199   2HE2  GLN  27          HE21      GLN  27   6.223   6.548  -7.905
  200    H    SER  28           HN       SER  28   0.262   4.385 -10.978
  201    HA   SER  28           HA       SER  28  -0.563   2.856 -12.544
  202   1HB   SER  28           HB2      SER  28   2.312   2.337 -13.415
  203   2HB   SER  28           HB1      SER  28   0.854   2.412 -14.422
  204    HG   SER  28           HG       SER  28   2.457   4.429 -13.514
  205    H    LEU  29           HN       LEU  29   0.113   0.501 -13.499
  206    HA   LEU  29           HA       LEU  29   1.171  -1.162 -11.269
  207   1HB   LEU  29           HB2      LEU  29  -1.486  -1.695 -12.666
  208   2HB   LEU  29           HB1      LEU  29  -0.803  -2.634 -11.351
  209    HG   LEU  29           HG       LEU  29  -1.315   0.316 -10.985
  210   1HD1  LEU  29          HD11      LEU  29  -3.404  -0.803 -11.847
  211   2HD1  LEU  29          HD12      LEU  29  -3.326  -1.890 -10.464
  212   3HD1  LEU  29          HD13      LEU  29  -3.560  -0.162 -10.214
  213   1HD2  LEU  29          HD22      LEU  29  -0.944  -2.125  -9.265
  214   2HD2  LEU  29          HD23      LEU  29  -0.120  -0.574  -9.166
  215   3HD2  LEU  29          HD21      LEU  29  -1.790  -0.721  -8.622
  216    H    VAL  30           HN       VAL  30   1.877  -0.436 -14.166
  217    HA   VAL  30           HA       VAL  30   1.594  -2.967 -15.593
  218    HB   VAL  30           HB       VAL  30   3.400  -0.558 -16.134
  219   1HG1  VAL  30          HG11      VAL  30   2.894  -3.147 -17.576
  220   2HG1  VAL  30          HG12      VAL  30   3.116  -1.691 -18.544
  221   3HG1  VAL  30          HG13      VAL  30   4.383  -2.216 -17.441
  222   1HG2  VAL  30          HG22      VAL  30   0.784  -0.346 -16.171
  223   2HG2  VAL  30          HG23      VAL  30   1.698   0.272 -17.542
  224   3HG2  VAL  30          HG21      VAL  30   0.895  -1.291 -17.653
  225    H    HIS  31           HN       HIS  31   3.043  -4.596 -15.767
  226    HA   HIS  31           HA       HIS  31   5.000  -4.921 -13.699
  227   1HB   HIS  31           HB2      HIS  31   3.727  -6.637 -15.370
  228   2HB   HIS  31           HB1      HIS  31   5.245  -6.492 -16.250
  229    HD2  HIS  31           HD2      HIS  31   3.909  -7.799 -12.800
  230    HE1  HIS  31           HE1      HIS  31   7.838  -9.015 -13.222
  231    H    SER  32           HN       SER  32   7.327  -5.536 -14.251
  232    HA   SER  32           HA       SER  32   8.752  -3.277 -15.119
  233   1HB   SER  32           HB2      SER  32  10.024  -4.939 -13.933
  234   2HB   SER  32           HB1      SER  32   9.481  -6.241 -15.008
  235    HG   SER  32           HG       SER  32  10.769  -4.022 -16.130
  236    H    ASN  33           HN       ASN  33   7.572  -5.998 -16.975
  237    HA   ASN  33           HA       ASN  33   7.801  -4.449 -19.450
  238   1HB   ASN  33           HB2      ASN  33   9.152  -6.352 -20.551
  239   2HB   ASN  33           HB1      ASN  33  10.059  -5.378 -19.398
  240   1HD2  ASN  33          HD22      ASN  33  10.266  -7.992 -16.961
  241   2HD2  ASN  33          HD21      ASN  33  10.270  -6.306 -17.149
  242    H    GLY  34           HN       GLY  34   5.637  -5.509 -17.997
  243   1HA   GLY  34           HA1      GLY  34   4.625  -7.536 -19.953
  244   2HA   GLY  34           HA2      GLY  34   4.277  -7.676 -18.235
  245    H    ASN  35           HN       ASN  35   2.199  -7.241 -17.949
  246    HA   ASN  35           HA       ASN  35   1.083  -4.807 -19.292
  247   1HB   ASN  35           HB2      ASN  35  -0.577  -7.205 -18.427
  248   2HB   ASN  35           HB1      ASN  35  -0.998  -5.960 -19.597
  249   1HD2  ASN  35          HD22      ASN  35   1.571  -7.439 -21.913
  250   2HD2  ASN  35          HD21      ASN  35   1.452  -5.950 -21.108
  251    H    THR  36           HN       THR  36  -1.391  -4.900 -17.940
  252    HA   THR  36           HA       THR  36  -0.499  -4.083 -15.206
  253    HB   THR  36           HB       THR  36  -2.808  -3.153 -16.998
  254    HG1  THR  36           HG1      THR  36  -0.615  -1.900 -15.680
  255   1HG2  THR  36          HG21      THR  36  -2.399  -2.977 -14.028
  256   2HG2  THR  36          HG22      THR  36  -2.697  -1.434 -14.822
  257   3HG2  THR  36          HG23      THR  36  -3.879  -2.732 -14.949
  258    OH   TYR  37           OH       TYR  37   2.238  -9.693 -16.872
  259    H    TYR  37           HN       TYR  37  -0.768  -5.982 -14.074
  260    HA   TYR  37           HA       TYR  37  -3.248  -7.522 -14.323
  261   1HB   TYR  37           HB2      TYR  37  -1.134  -7.745 -12.131
  262   2HB   TYR  37           HB1      TYR  37  -2.219  -9.010 -12.702
  263    HD1  TYR  37           HD1      TYR  37  -2.024  -9.437 -15.367
  264    HD2  TYR  37           HD2      TYR  37   1.059  -7.803 -12.933
  265    HE1  TYR  37           HE1      TYR  37  -0.355 -10.094 -17.038
  266    HE2  TYR  37           HE2      TYR  37   2.726  -8.467 -14.604
  267    HH   TYR  37           HH       TYR  37   2.633 -10.522 -16.587
  268    H    LEU  38           HN       LEU  38  -4.468  -5.441 -13.834
  269    HA   LEU  38           HA       LEU  38  -4.554  -4.749 -10.964
  270   1HB   LEU  38           HB2      LEU  38  -4.738  -2.939 -12.639
  271   2HB   LEU  38           HB1      LEU  38  -6.136  -3.721 -13.365
  272    HG   LEU  38           HG       LEU  38  -6.513  -3.400 -10.495
  273   1HD1  LEU  38          HD13      LEU  38  -5.456  -1.089 -12.040
  274   2HD1  LEU  38          HD11      LEU  38  -6.863  -0.771 -11.031
  275   3HD1  LEU  38          HD12      LEU  38  -5.391  -1.411 -10.308
  276   1HD2  LEU  38          HD23      LEU  38  -8.233  -3.796 -12.326
  277   2HD2  LEU  38          HD21      LEU  38  -8.625  -2.492 -11.209
  278   3HD2  LEU  38          HD22      LEU  38  -7.993  -2.120 -12.810
  279    H    ASN  39           HN       ASN  39  -6.216  -5.156  -9.604
  280    HA   ASN  39           HA       ASN  39  -8.379  -6.938 -10.632
  281   1HB   ASN  39           HB2      ASN  39  -6.944  -8.316  -9.270
  282   2HB   ASN  39           HB1      ASN  39  -6.757  -7.050  -8.060
  283   1HD2  ASN  39          HD22      ASN  39  -9.416  -8.354  -6.199
  284   2HD2  ASN  39          HD21      ASN  39  -7.895  -7.601  -6.222
  285    CH2  TRP  40           CH2      TRP  40 -12.696   0.257 -10.105
  286    H    TRP  40           HN       TRP  40 -10.348  -6.923  -9.335
  287    HA   TRP  40           HA       TRP  40 -10.784  -4.294  -7.980
  288   1HB   TRP  40           HB2      TRP  40 -12.420  -5.770 -10.061
  289   2HB   TRP  40           HB1      TRP  40 -13.214  -4.656  -8.951
  290    HD1  TRP  40           HD1      TRP  40 -10.522  -4.697 -11.750
  291    HE1  TRP  40           HE1      TRP  40 -10.390  -2.312 -12.576
  292    HE3  TRP  40           HE3      TRP  40 -13.426  -2.535  -8.365
  293    HZ2  TRP  40           HZ2      TRP  40 -11.443   0.338 -11.834
  294    HZ3  TRP  40           HZ3      TRP  40 -13.892  -0.121  -8.377
  295    HH2  TRP  40           HH2      TRP  40 -12.914   1.315 -10.119
  296    OH   TYR  41           OH       TYR  41  -9.522 -10.147  -1.882
  297    H    TYR  41           HN       TYR  41 -12.391  -4.273  -6.345
  298    HA   TYR  41           HA       TYR  41 -13.102  -6.989  -5.283
  299   1HB   TYR  41           HB2      TYR  41 -11.520  -4.804  -4.101
  300   2HB   TYR  41           HB1      TYR  41 -12.908  -5.188  -3.092
  301    HD1  TYR  41           HD2      TYR  41 -10.578  -7.247  -5.194
  302    HD2  TYR  41           HD1      TYR  41 -12.306  -6.619  -1.362
  303    HE1  TYR  41           HE2      TYR  41  -9.394  -9.216  -4.337
  304    HE2  TYR  41           HE1      TYR  41 -11.118  -8.584  -0.504
  305    HH   TYR  41           HH       TYR  41  -8.920 -10.455  -2.564
  306    H    LEU  42           HN       LEU  42 -15.077  -7.163  -4.279
  307    HA   LEU  42           HA       LEU  42 -16.798  -4.877  -3.736
  308   1HB   LEU  42           HB2      LEU  42 -17.315  -4.856  -6.072
  309   2HB   LEU  42           HB1      LEU  42 -17.181  -6.604  -6.209
  310    HG   LEU  42           HG       LEU  42 -19.247  -6.836  -4.804
  311   1HD1  LEU  42          HD12      LEU  42 -18.912  -4.524  -3.722
  312   2HD1  LEU  42          HD13      LEU  42 -19.576  -3.848  -5.204
  313   3HD1  LEU  42          HD11      LEU  42 -20.559  -4.915  -4.204
  314   1HD2  LEU  42          HD21      LEU  42 -19.384  -5.189  -7.342
  315   2HD2  LEU  42          HD22      LEU  42 -19.554  -6.933  -7.183
  316   3HD2  LEU  42          HD23      LEU  42 -20.812  -5.867  -6.568
  317    H    GLN  43           HN       GLN  43 -18.095  -5.473  -2.066
  318    HA   GLN  43           HA       GLN  43 -19.369  -8.062  -1.951
  319   1HB   GLN  43           HB2      GLN  43 -18.037  -8.895   0.057
  320   2HB   GLN  43           HB1      GLN  43 -17.118  -8.866  -1.443
  321   1HG   GLN  43           HG1      GLN  43 -16.899  -6.278  -0.196
  322   2HG   GLN  43           HG2      GLN  43 -16.516  -7.508   1.004
  323   1HE2  GLN  43          HE22      GLN  43 -13.348  -8.063  -0.362
  324   2HE2  GLN  43          HE21      GLN  43 -14.376  -8.120   0.985
  325    H    LYS  44           HN       LYS  44 -20.287  -8.543   0.217
  326    HA   LYS  44           HA       LYS  44 -21.114  -5.996   1.547
  327   1HB   LYS  44           HB2      LYS  44 -22.744  -7.743   0.281
  328   2HB   LYS  44           HB1      LYS  44 -22.662  -8.581   1.826
  329   1HG   LYS  44           HG1      LYS  44 -24.481  -7.157   2.187
  330   2HG   LYS  44           HG2      LYS  44 -23.166  -6.175   2.815
  331   1HD   LYS  44           HD1      LYS  44 -24.356  -4.701   1.386
  332   2HD   LYS  44           HD2      LYS  44 -22.971  -5.207   0.430
  333   1HE   LYS  44           HE1      LYS  44 -25.205  -5.276  -0.786
  334   2HE   LYS  44           HE2      LYS  44 -24.294  -6.779  -0.820
  335   1HZ   LYS  44           HZ1      LYS  44 -25.843  -7.828   0.358
  336   2HZ   LYS  44           HZ2      LYS  44 -26.063  -6.535   1.438
  337    H    ALA  45           HN       ALA  45 -22.330  -7.317   3.780
  338    HA   ALA  45           HA       ALA  45 -20.158  -7.435   5.586
  339   1HB   ALA  45           HB2      ALA  45 -22.576  -7.148   6.230
  340   2HB   ALA  45           HB3      ALA  45 -22.865  -8.837   5.825
  341   3HB   ALA  45           HB1      ALA  45 -21.800  -8.421   7.166
  342    H    GLY  46           HN       GLY  46 -21.321  -9.813   3.409
  343   1HA   GLY  46           HA1      GLY  46 -19.263 -11.568   3.347
  344   2HA   GLY  46           HA2      GLY  46 -20.063 -12.069   4.837
  345    H    GLN  47           HN       GLN  47 -20.471 -11.689   1.363
  346    HA   GLN  47           HA       GLN  47 -22.421 -13.920   1.420
  347   1HB   GLN  47           HB2      GLN  47 -23.475 -11.483   1.483
  348   2HB   GLN  47           HB1      GLN  47 -23.035 -11.442  -0.217
  349   1HG   GLN  47           HG1      GLN  47 -24.408 -13.927   0.657
  350   2HG   GLN  47           HG2      GLN  47 -25.396 -12.471   0.705
  351   1HE2  GLN  47          HE22      GLN  47 -25.839 -12.440  -2.770
  352   2HE2  GLN  47          HE21      GLN  47 -26.368 -11.936  -1.239
  353    H    SER  48           HN       SER  48 -21.500 -11.544  -1.043
  354    HA   SER  48           HA       SER  48 -20.928 -13.718  -2.939
  355   1HB   SER  48           HB2      SER  48 -20.897 -11.922  -4.592
  356   2HB   SER  48           HB1      SER  48 -22.138 -11.432  -3.427
  357    HG   SER  48           HG       SER  48 -19.394 -10.672  -3.470
  358    HA   PRO  49           HA       PRO  49 -16.579 -13.793  -2.648
  359   1HB   PRO  49           HB2      PRO  49 -16.063 -13.487  -5.491
  360   2HB   PRO  49           HB1      PRO  49 -16.055 -14.980  -4.552
  361   1HG   PRO  49           HG1      PRO  49 -18.029 -14.118  -6.468
  362   2HG   PRO  49           HG2      PRO  49 -18.032 -15.603  -5.517
  363   1HD   PRO  49           HD1      PRO  49 -19.707 -13.274  -5.175
  364   2HD   PRO  49           HD2      PRO  49 -19.729 -14.775  -4.233
  365    H    LYS  50           HN       LYS  50 -14.551 -12.540  -3.390
  366    HA   LYS  50           HA       LYS  50 -15.273  -9.693  -3.854
  367   1HB   LYS  50           HB2      LYS  50 -13.289  -9.171  -2.350
  368   2HB   LYS  50           HB1      LYS  50 -14.645  -9.943  -1.533
  369   1HG   LYS  50           HG1      LYS  50 -13.060 -12.010  -2.624
  370   2HG   LYS  50           HG2      LYS  50 -11.949 -10.902  -1.838
  371   1HD   LYS  50           HD1      LYS  50 -12.880 -11.242   0.271
  372   2HD   LYS  50           HD2      LYS  50 -14.462 -11.650  -0.381
  373   1HE   LYS  50           HE1      LYS  50 -12.175 -13.473  -1.026
  374   2HE   LYS  50           HE2      LYS  50 -12.839 -13.533   0.603
  375   1HZ   LYS  50           HZ1      LYS  50 -14.145 -15.042  -0.481
  376   2HZ   LYS  50           HZ2      LYS  50 -15.085 -13.639  -0.669
  377    H    LEU  51           HN       LEU  51 -14.796 -10.631  -6.137
  378    HA   LEU  51           HA       LEU  51 -12.298  -9.480  -6.978
  379   1HB   LEU  51           HB2      LEU  51 -11.325 -11.565  -6.112
  380   2HB   LEU  51           HB1      LEU  51 -12.549 -12.526  -6.928
  381    HG   LEU  51           HG       LEU  51 -11.467 -11.114  -9.050
  382   1HD1  LEU  51          HD12      LEU  51  -9.712 -10.439  -7.135
  383   2HD1  LEU  51          HD13      LEU  51  -9.025 -12.001  -7.562
  384   3HD1  LEU  51          HD11      LEU  51  -9.194 -10.748  -8.789
  385   1HD2  LEU  51          HD23      LEU  51 -11.927 -13.581  -8.835
  386   2HD2  LEU  51          HD21      LEU  51 -10.406 -13.216  -9.644
  387   3HD2  LEU  51          HD22      LEU  51 -10.407 -13.743  -7.963
  388    H    LEU  52           HN       LEU  52 -13.452  -8.430  -8.545
  389    HA   LEU  52           HA       LEU  52 -15.107 -10.030 -10.410
  390   1HB   LEU  52           HB2      LEU  52 -14.551  -7.020 -10.251
  391   2HB   LEU  52           HB1      LEU  52 -15.730  -7.772 -11.320
  392    HG   LEU  52           HG       LEU  52 -15.851  -8.245  -8.339
  393   1HD1  LEU  52          HD11      LEU  52 -16.794  -5.838  -9.904
  394   2HD1  LEU  52          HD12      LEU  52 -17.610  -6.338  -8.428
  395   3HD1  LEU  52          HD13      LEU  52 -15.913  -5.873  -8.381
  396   1HD2  LEU  52          HD21      LEU  52 -17.215  -9.600  -9.984
  397   2HD2  LEU  52          HD22      LEU  52 -18.186  -8.703  -8.820
  398   3HD2  LEU  52          HD23      LEU  52 -18.012  -8.107 -10.468
  399    H    ILE  53           HN       ILE  53 -13.254  -7.232 -11.371
  400    HA   ILE  53           HA       ILE  53 -12.061  -8.727 -13.560
  401    HB   ILE  53           HB       ILE  53 -11.941  -5.869 -12.538
  402   1HG1  ILE  53          HG11      ILE  53 -12.929  -5.611 -14.957
  403   2HG1  ILE  53          HG12      ILE  53 -13.253  -7.329 -14.798
  404   1HG2  ILE  53          HG23      ILE  53  -9.733  -6.570 -13.605
  405   2HG2  ILE  53          HG21      ILE  53 -10.626  -6.959 -15.072
  406   3HG2  ILE  53          HG22      ILE  53 -10.565  -5.299 -14.489
  407   1HD1  ILE  53          HD11      ILE  53 -14.057  -5.544 -12.548
  408   2HD1  ILE  53          HD12      ILE  53 -15.036  -5.543 -14.015
  409   3HD1  ILE  53          HD13      ILE  53 -14.793  -7.041 -13.119
  410    OH   TYR  54           OH       TYR  54  -8.685 -14.122 -16.414
  411    H    TYR  54           HN       TYR  54  -9.892  -9.178 -13.814
  412    HA   TYR  54           HA       TYR  54  -8.044  -8.539 -11.576
  413   1HB   TYR  54           HB2      TYR  54  -7.302 -10.870 -11.408
  414   2HB   TYR  54           HB1      TYR  54  -9.055 -10.857 -11.241
  415    HD1  TYR  54           HD2      TYR  54  -6.262 -11.615 -13.537
  416    HD2  TYR  54           HD1      TYR  54 -10.470 -11.808 -12.954
  417    HE1  TYR  54           HE2      TYR  54  -6.456 -13.110 -15.470
  418    HE2  TYR  54           HE1      TYR  54 -10.661 -13.285 -14.912
  419    HH   TYR  54           HH       TYR  54  -9.148 -13.634 -17.101
  420    H    LYS  55           HN       LYS  55  -8.661  -8.730 -14.825
  421    HA   LYS  55           HA       LYS  55  -5.762  -8.419 -15.453
  422   1HB   LYS  55           HB2      LYS  55  -7.329 -10.587 -16.243
  423   2HB   LYS  55           HB1      LYS  55  -7.474  -9.516 -17.628
  424   1HG   LYS  55           HG1      LYS  55  -4.720  -9.617 -16.679
  425   2HG   LYS  55           HG2      LYS  55  -5.317 -11.229 -17.049
  426   1HD   LYS  55           HD1      LYS  55  -6.199 -10.208 -19.254
  427   2HD   LYS  55           HD2      LYS  55  -5.178  -8.825 -18.885
  428   1HE   LYS  55           HE1      LYS  55  -3.206 -10.324 -18.744
  429   2HE   LYS  55           HE2      LYS  55  -4.231 -11.702 -19.127
  430   1HZ   LYS  55           HZ1      LYS  55  -4.341  -9.447 -20.964
  431   2HZ   LYS  55           HZ2      LYS  55  -2.903 -10.353 -20.962
  432    H    VAL  56           HN       VAL  56  -6.972  -6.225 -14.910
  433    HA   VAL  56           HA       VAL  56  -7.952  -4.229 -15.658
  434    HB   VAL  56           HB       VAL  56  -5.624  -3.986 -16.348
  435   1HG1  VAL  56          HG12      VAL  56  -6.442  -5.516 -18.841
  436   2HG1  VAL  56          HG13      VAL  56  -4.913  -4.667 -18.663
  437   3HG1  VAL  56          HG11      VAL  56  -5.286  -6.030 -17.616
  438   1HG2  VAL  56          HG21      VAL  56  -7.483  -2.392 -17.234
  439   2HG2  VAL  56          HG22      VAL  56  -5.886  -2.295 -17.969
  440   3HG2  VAL  56          HG23      VAL  56  -7.183  -3.153 -18.793
  441    H    SER  57           HN       SER  57 -10.042  -5.102 -16.007
  442    HA   SER  57           HA       SER  57 -12.012  -5.189 -17.238
  443   1HB   SER  57           HB2      SER  57 -10.305  -3.436 -18.703
  444   2HB   SER  57           HB1      SER  57 -11.005  -4.537 -19.904
  445    HG   SER  57           HG       SER  57 -12.870  -3.649 -19.554
  446    H    ASN  58           HN       ASN  58 -11.686  -7.490 -16.865
  447    HA   ASN  58           HA       ASN  58 -11.818  -8.931 -19.431
  448   1HB   ASN  58           HB2      ASN  58  -9.912 -10.223 -19.137
  449   2HB   ASN  58           HB1      ASN  58  -9.387  -8.858 -18.159
  450   1HD2  ASN  58          HD22      ASN  58 -10.093 -10.575 -15.043
  451   2HD2  ASN  58          HD21      ASN  58 -10.205  -9.034 -15.747
  452    NH1  ARG  59           NH2      ARG  59 -16.986  -6.713 -19.186
  453    NH2  ARG  59           NH1      ARG  59 -15.299  -7.723 -20.320
  454    H    ARG  59           HN       ARG  59 -12.390  -8.713 -16.039
  455    HA   ARG  59           HA       ARG  59 -14.048  -9.669 -14.702
  456   1HB   ARG  59           HB2      ARG  59 -14.961 -11.184 -17.186
  457   2HB   ARG  59           HB1      ARG  59 -15.920 -10.769 -15.774
  458   1HG   ARG  59           HG1      ARG  59 -15.557  -8.332 -16.331
  459   2HG   ARG  59           HG2      ARG  59 -14.791  -8.843 -17.830
  460   1HD   ARG  59           HD1      ARG  59 -17.246 -10.280 -17.614
  461   2HD   ARG  59           HD2      ARG  59 -17.600  -8.590 -17.268
  462    HE   ARG  59           HE       ARG  59 -17.057  -9.612 -19.859
  463   1HH1  ARG  59          HH21      ARG  59 -17.795  -6.797 -18.608
  464   2HH1  ARG  59          HH22      ARG  59 -16.666  -5.810 -19.468
  465   1HH2  ARG  59          HH11      ARG  59 -14.836  -8.565 -20.594
  466   2HH2  ARG  59          HH12      ARG  59 -14.953  -6.839 -20.627
  467    H    PHE  60           HN       PHE  60 -14.045 -11.362 -13.356
  468    HA   PHE  60           HA       PHE  60 -12.206 -13.588 -13.973
  469   1HB   PHE  60           HB2      PHE  60 -12.045 -12.419 -11.774
  470   2HB   PHE  60           HB1      PHE  60 -13.717 -12.837 -11.424
  471    HD1  PHE  60           HD1      PHE  60 -10.467 -14.460 -12.353
  472    HD2  PHE  60           HD2      PHE  60 -14.164 -14.828 -10.264
  473    HE1  PHE  60           HE1      PHE  60  -9.750 -16.631 -11.458
  474    HE2  PHE  60           HE2      PHE  60 -13.440 -16.996  -9.369
  475    HZ   PHE  60           HZ       PHE  60 -11.235 -17.899  -9.965
  476    H    SER  61           HN       SER  61 -12.916 -15.792 -13.077
  477    HA   SER  61           HA       SER  61 -15.101 -16.751 -14.607
  478   1HB   SER  61           HB2      SER  61 -13.143 -18.085 -13.498
  479   2HB   SER  61           HB1      SER  61 -14.149 -18.092 -12.036
  480    HG   SER  61           HG       SER  61 -15.640 -19.263 -13.038
  481    H    GLY  62           HN       GLY  62 -17.187 -16.354 -14.341
  482   1HA   GLY  62           HA1      GLY  62 -19.239 -16.659 -13.046
  483   2HA   GLY  62           HA2      GLY  62 -18.316 -16.357 -11.578
  484    H    VAL  63           HN       VAL  63 -17.103 -14.129 -13.519
  485    HA   VAL  63           HA       VAL  63 -18.831 -12.025 -12.422
  486    HB   VAL  63           HB       VAL  63 -16.325 -11.926 -14.167
  487   1HG1  VAL  63          HG12      VAL  63 -17.839  -9.732 -12.705
  488   2HG1  VAL  63          HG13      VAL  63 -16.232  -9.529 -13.394
  489   3HG1  VAL  63          HG11      VAL  63 -17.604  -9.862 -14.445
  490   1HG2  VAL  63          HG21      VAL  63 -16.766 -11.513 -11.188
  491   2HG2  VAL  63          HG22      VAL  63 -15.941 -12.880 -11.930
  492   3HG2  VAL  63          HG23      VAL  63 -15.236 -11.271 -12.021
  493    HA   PRO  64           HA       PRO  64 -21.429 -11.925 -16.005
  494   1HB   PRO  64           HB2      PRO  64 -22.253  -9.230 -15.250
  495   2HB   PRO  64           HB1      PRO  64 -23.176 -10.726 -15.112
  496   1HG   PRO  64           HG1      PRO  64 -21.958  -9.224 -12.983
  497   2HG   PRO  64           HG2      PRO  64 -22.828 -10.753 -12.853
  498   1HD   PRO  64           HD1      PRO  64 -19.986 -10.303 -12.591
  499   2HD   PRO  64           HD2      PRO  64 -20.864 -11.838 -12.444
  500    H    ASP  65           HN       ASP  65 -21.342 -11.029 -18.028
  501    HA   ASP  65           HA       ASP  65 -18.980  -9.709 -18.852
  502   1HB   ASP  65           HB2      ASP  65 -21.026 -10.962 -20.150
  503   2HB   ASP  65           HB1      ASP  65 -21.468  -9.290 -20.477
  504    NH1  ARG  66           NH1      ARG  66 -26.103 -10.442 -18.577
  505    NH2  ARG  66           NH2      ARG  66 -26.810  -9.975 -16.464
  506    H    ARG  66           HN       ARG  66 -21.954  -8.420 -17.629
  507    HA   ARG  66           HA       ARG  66 -21.788  -5.781 -18.679
  508   1HB   ARG  66           HB2      ARG  66 -22.850  -6.731 -15.976
  509   2HB   ARG  66           HB1      ARG  66 -23.240  -5.190 -16.729
  510   1HG   ARG  66           HG1      ARG  66 -24.737  -6.136 -18.167
  511   2HG   ARG  66           HG2      ARG  66 -23.691  -7.510 -18.498
  512   1HD   ARG  66           HD1      ARG  66 -24.606  -7.664 -15.762
  513   2HD   ARG  66           HD2      ARG  66 -25.993  -7.454 -16.828
  514    HE   ARG  66           HE       ARG  66 -23.973  -9.609 -17.322
  515   1HH1  ARG  66          HH11      ARG  66 -25.404 -10.345 -19.285
  516   2HH1  ARG  66          HH12      ARG  66 -26.930 -10.974 -18.758
  517   1HH2  ARG  66          HH21      ARG  66 -26.642  -9.528 -15.586
  518   2HH2  ARG  66          HH22      ARG  66 -27.650 -10.495 -16.606
  519    H    PHE  67           HN       PHE  67 -20.088  -7.326 -16.048
  520    HA   PHE  67           HA       PHE  67 -19.106  -4.813 -14.916
  521   1HB   PHE  67           HB2      PHE  67 -18.652  -7.753 -14.446
  522   2HB   PHE  67           HB1      PHE  67 -17.449  -6.629 -13.834
  523    HD1  PHE  67           HD2      PHE  67 -21.179  -7.049 -13.920
  524    HD2  PHE  67           HD1      PHE  67 -17.785  -5.708 -11.724
  525    HE1  PHE  67           HE2      PHE  67 -22.619  -6.548 -11.991
  526    HE2  PHE  67           HE1      PHE  67 -19.219  -5.218  -9.800
  527    HZ   PHE  67           HZ       PHE  67 -21.638  -5.642  -9.928
  528    H    SER  68           HN       SER  68 -17.424  -3.684 -15.582
  529    HA   SER  68           HA       SER  68 -15.255  -5.065 -17.101
  530   1HB   SER  68           HB2      SER  68 -16.483  -2.345 -17.827
  531   2HB   SER  68           HB1      SER  68 -15.217  -3.196 -18.733
  532    HG   SER  68           HG       SER  68 -17.910  -3.959 -18.288
  533    H    GLY  69           HN       GLY  69 -13.203  -3.835 -17.054
  534   1HA   GLY  69           HA1      GLY  69 -13.050  -1.666 -15.055
  535   2HA   GLY  69           HA2      GLY  69 -12.228  -3.155 -14.612
  536    H    SER  70           HN       SER  70 -12.363  -0.605 -17.044
  537    HA   SER  70           HA       SER  70  -9.788  -1.431 -18.206
  538   1HB   SER  70           HB2      SER  70 -11.734  -0.309 -19.501
  539   2HB   SER  70           HB1      SER  70 -11.273   1.198 -18.683
  540    HG   SER  70           HG       SER  70 -10.169   0.336 -20.803
  541    H    GLY  71           HN       GLY  71  -8.496   0.934 -18.664
  542   1HA   GLY  71           HA1      GLY  71  -8.084   2.881 -16.851
  543   2HA   GLY  71           HA2      GLY  71  -7.435   1.512 -15.970
  544    H    SER  72           HN       SER  72  -6.631   4.019 -17.915
  545    HA   SER  72           HA       SER  72  -4.437   2.626 -19.326
  546   1HB   SER  72           HB2      SER  72  -5.545   5.469 -19.367
  547   2HB   SER  72           HB1      SER  72  -4.033   5.050 -20.198
  548    HG   SER  72           HG       SER  72  -5.469   4.480 -21.690
  549    H    GLY  73           HN       GLY  73  -3.063   2.051 -17.645
  550   1HA   GLY  73           HA1      GLY  73  -1.133   2.413 -16.342
  551   2HA   GLY  73           HA2      GLY  73  -1.178   4.101 -16.834
  552    H    THR  74           HN       THR  74  -2.849   5.466 -15.721
  553    HA   THR  74           HA       THR  74  -3.408   4.476 -12.957
  554    HB   THR  74           HB       THR  74  -2.752   6.777 -12.104
  555    HG1  THR  74           HG1      THR  74  -3.183   7.805 -14.099
  556   1HG2  THR  74          HG23      THR  74  -0.922   4.822 -13.288
  557   2HG2  THR  74          HG21      THR  74  -0.293   6.443 -13.555
  558   3HG2  THR  74          HG22      THR  74  -0.621   5.884 -11.918
  559    H    ASP  75           HN       ASP  75  -5.411   4.279 -14.604
  560    HA   ASP  75           HA       ASP  75  -7.329   6.220 -13.581
  561   1HB   ASP  75           HB2      ASP  75  -6.324   7.424 -15.571
  562   2HB   ASP  75           HB1      ASP  75  -6.822   6.086 -16.600
  563    H    PHE  76           HN       PHE  76  -7.500   3.749 -12.975
  564    HA   PHE  76           HA       PHE  76  -8.945   2.153 -14.947
  565   1HB   PHE  76           HB2      PHE  76  -8.593   1.664 -11.955
  566   2HB   PHE  76           HB1      PHE  76  -9.038   0.460 -13.164
  567    HD1  PHE  76           HD1      PHE  76  -7.365  -0.274 -14.863
  568    HD2  PHE  76           HD2      PHE  76  -6.298   2.408 -11.728
  569    HE1  PHE  76           HE1      PHE  76  -4.989  -0.618 -15.374
  570    HE2  PHE  76           HE2      PHE  76  -3.923   2.041 -12.228
  571    HZ   PHE  76           HZ       PHE  76  -3.266   0.529 -14.047
  572    H    THR  77           HN       THR  77 -11.077   1.508 -14.870
  573    HA   THR  77           HA       THR  77 -12.863   2.782 -12.888
  574    HB   THR  77           HB       THR  77 -13.251   3.178 -15.917
  575    HG1  THR  77           HG1      THR  77 -11.992   4.566 -13.853
  576   1HG2  THR  77          HG22      THR  77 -14.579   4.476 -13.472
  577   2HG2  THR  77          HG23      THR  77 -14.980   4.802 -15.153
  578   3HG2  THR  77          HG21      THR  77 -15.354   3.233 -14.447
  579    H    LEU  78           HN       LEU  78 -14.272   1.297 -12.246
  580    HA   LEU  78           HA       LEU  78 -14.651  -1.126 -13.857
  581   1HB   LEU  78           HB2      LEU  78 -14.448  -0.935 -11.244
  582   2HB   LEU  78           HB1      LEU  78 -16.137  -0.457 -11.293
  583    HG   LEU  78           HG       LEU  78 -15.370  -2.920 -12.828
  584   1HD1  LEU  78          HD13      LEU  78 -15.231  -2.597  -9.843
  585   2HD1  LEU  78          HD11      LEU  78 -15.849  -4.106 -10.507
  586   3HD1  LEU  78          HD12      LEU  78 -14.222  -3.573 -10.906
  587   1HD2  LEU  78          HD23      LEU  78 -17.732  -1.633 -12.161
  588   2HD2  LEU  78          HD21      LEU  78 -17.608  -3.311 -12.678
  589   3HD2  LEU  78          HD22      LEU  78 -17.649  -2.919 -10.963
  590    H    LYS  79           HN       LYS  79 -15.979  -0.837 -15.560
  591    HA   LYS  79           HA       LYS  79 -18.421   0.804 -15.200
  592   1HB   LYS  79           HB2      LYS  79 -16.784   0.952 -17.226
  593   2HB   LYS  79           HB1      LYS  79 -17.518  -0.554 -17.763
  594   1HG   LYS  79           HG1      LYS  79 -19.538   0.441 -18.254
  595   2HG   LYS  79           HG2      LYS  79 -19.392   1.625 -16.961
  596   1HD   LYS  79           HD1      LYS  79 -17.471   1.768 -19.267
  597   2HD   LYS  79           HD2      LYS  79 -19.112   2.358 -19.501
  598   1HE   LYS  79           HE1      LYS  79 -18.582   3.544 -17.139
  599   2HE   LYS  79           HE2      LYS  79 -16.938   3.435 -17.758
  600   1HZ   LYS  79           HZ1      LYS  79 -17.336   4.989 -19.283
  601   2HZ   LYS  79           HZ2      LYS  79 -18.856   4.355 -19.700
  602    H    ILE  80           HN       ILE  80 -20.244  -0.118 -14.676
  603    HA   ILE  80           HA       ILE  80 -20.693  -2.978 -15.394
  604    HB   ILE  80           HB       ILE  80 -21.968  -1.251 -13.217
  605   1HG1  ILE  80          HG11      ILE  80 -20.436  -3.683 -12.504
  606   2HG1  ILE  80          HG12      ILE  80 -19.473  -2.368 -13.164
  607   1HG2  ILE  80          HG23      ILE  80 -22.336  -4.152 -14.080
  608   2HG2  ILE  80          HG21      ILE  80 -22.785  -3.610 -12.466
  609   3HG2  ILE  80          HG22      ILE  80 -23.581  -2.923 -13.878
  610   1HD1  ILE  80          HD13      ILE  80 -20.521  -0.811 -11.513
  611   2HD1  ILE  80          HD11      ILE  80 -21.396  -2.174 -10.821
  612   3HD1  ILE  80          HD12      ILE  80 -19.639  -2.118 -10.731
  613    H    SER  81           HN       SER  81 -21.908  -3.263 -17.042
  614    HA   SER  81           HA       SER  81 -23.530  -1.174 -18.094
  615   1HB   SER  81           HB2      SER  81 -23.237  -4.131 -18.724
  616   2HB   SER  81           HB1      SER  81 -24.418  -3.128 -19.589
  617    HG   SER  81           HG       SER  81 -22.769  -1.733 -20.170
  618    NH1  ARG  82           NH2      ARG  82 -30.639  -2.351 -18.322
  619    NH2  ARG  82           NH1      ARG  82 -30.541  -4.040 -19.844
  620    H    ARG  82           HN       ARG  82 -24.148  -3.707 -15.834
  621    HA   ARG  82           HA       ARG  82 -26.943  -2.727 -15.613
  622   1HB   ARG  82           HB2      ARG  82 -26.008  -5.502 -16.294
  623   2HB   ARG  82           HB1      ARG  82 -27.388  -5.371 -15.214
  624   1HG   ARG  82           HG1      ARG  82 -27.277  -3.830 -17.813
  625   2HG   ARG  82           HG2      ARG  82 -27.866  -5.488 -17.756
  626   1HD   ARG  82           HD1      ARG  82 -29.320  -4.551 -15.727
  627   2HD   ARG  82           HD2      ARG  82 -29.057  -3.012 -16.547
  628    HE   ARG  82           HE       ARG  82 -30.605  -5.297 -17.612
  629   1HH1  ARG  82          HH21      ARG  82 -30.561  -2.049 -17.372
  630   2HH1  ARG  82          HH22      ARG  82 -30.867  -1.692 -19.037
  631   1HH2  ARG  82          HH11      ARG  82 -30.387  -5.007 -20.039
  632   2HH2  ARG  82          HH12      ARG  82 -30.775  -3.412 -20.585
  633    H    VAL  83           HN       VAL  83 -27.005  -1.994 -13.589
  634    HA   VAL  83           HA       VAL  83 -25.478  -3.330 -11.452
  635    HB   VAL  83           HB       VAL  83 -27.444  -0.992 -11.296
  636   1HG1  VAL  83          HG12      VAL  83 -26.593  -2.308  -9.185
  637   2HG1  VAL  83          HG13      VAL  83 -25.075  -1.472  -9.492
  638   3HG1  VAL  83          HG11      VAL  83 -26.537  -0.550  -9.167
  639   1HG2  VAL  83          HG22      VAL  83 -24.723  -1.179 -12.392
  640   2HG2  VAL  83          HG23      VAL  83 -25.908   0.114 -12.556
  641   3HG2  VAL  83          HG21      VAL  83 -24.872   0.046 -11.135
  642    H    GLU  84           HN       GLU  84 -26.355  -4.635  -9.894
  643    HA   GLU  84           HA       GLU  84 -29.333  -4.936  -9.908
  644   1HB   GLU  84           HB2      GLU  84 -27.237  -6.916 -10.501
  645   2HB   GLU  84           HB1      GLU  84 -28.297  -7.456  -9.203
  646   1HG   GLU  84           HG1      GLU  84 -30.243  -6.691 -10.755
  647   2HG   GLU  84           HG2      GLU  84 -29.036  -6.691 -12.037
  648    H    ALA  85           HN       ALA  85 -30.102  -6.191  -7.957
  649    HA   ALA  85           HA       ALA  85 -29.541  -4.794  -5.596
  650   1HB   ALA  85           HB3      ALA  85 -30.486  -7.684  -5.902
  651   2HB   ALA  85           HB1      ALA  85 -30.659  -6.721  -4.438
  652   3HB   ALA  85           HB2      ALA  85 -31.525  -6.263  -5.900
  653    H    GLU  86           HN       GLU  86 -28.142  -7.868  -6.682
  654    HA   GLU  86           HA       GLU  86 -26.572  -8.351  -4.346
  655   1HB   GLU  86           HB2      GLU  86 -26.184  -9.107  -7.277
  656   2HB   GLU  86           HB1      GLU  86 -25.135  -9.706  -5.997
  657   1HG   GLU  86           HG1      GLU  86 -28.124  -9.979  -5.747
  658   2HG   GLU  86           HG2      GLU  86 -27.211 -11.143  -6.701
  659    H    ASP  87           HN       ASP  87 -25.966  -6.499  -7.264
  660    HA   ASP  87           HA       ASP  87 -23.208  -5.969  -6.865
  661   1HB   ASP  87           HB2      ASP  87 -24.759  -5.385  -8.888
  662   2HB   ASP  87           HB1      ASP  87 -25.169  -3.929  -7.990
  663    H    LEU  88           HN       LEU  88 -25.976  -4.775  -5.185
  664    HA   LEU  88           HA       LEU  88 -24.964  -2.296  -4.222
  665   1HB   LEU  88           HB2      LEU  88 -26.763  -4.341  -2.832
  666   2HB   LEU  88           HB1      LEU  88 -26.533  -2.686  -2.282
  667    HG   LEU  88           HG       LEU  88 -27.525  -3.361  -5.068
  668   1HD1  LEU  88          HD13      LEU  88 -29.078  -4.228  -3.305
  669   2HD1  LEU  88          HD11      LEU  88 -29.151  -2.611  -2.611
  670   3HD1  LEU  88          HD12      LEU  88 -29.784  -2.906  -4.228
  671   1HD2  LEU  88          HD23      LEU  88 -26.621  -0.976  -3.843
  672   2HD2  LEU  88          HD21      LEU  88 -27.464  -1.119  -5.381
  673   3HD2  LEU  88          HD22      LEU  88 -28.375  -0.841  -3.900
  674    H    GLY  89           HN       GLY  89 -23.787  -1.749  -2.401
  675   1HA   GLY  89           HA1      GLY  89 -22.900  -2.935  -0.201
  676   2HA   GLY  89           HA2      GLY  89 -22.042  -3.931  -1.380
  677    H    ILE  90           HN       ILE  90 -20.048  -3.185  -0.518
  678    HA   ILE  90           HA       ILE  90 -19.424  -0.344  -1.220
  679    HB   ILE  90           HB       ILE  90 -17.815  -2.143   0.643
  680   1HG1  ILE  90          HG11      ILE  90 -19.978  -0.158   1.433
  681   2HG1  ILE  90          HG12      ILE  90 -20.178  -1.906   1.460
  682   1HG2  ILE  90          HG23      ILE  90 -18.083   0.887   0.290
  683   2HG2  ILE  90          HG21      ILE  90 -17.051   0.109   1.485
  684   3HG2  ILE  90          HG22      ILE  90 -16.709  -0.083  -0.232
  685   1HD1  ILE  90          HD13      ILE  90 -17.948  -1.817   2.902
  686   2HD1  ILE  90          HD11      ILE  90 -18.478  -0.169   3.222
  687   3HD1  ILE  90          HD12      ILE  90 -19.510  -1.526   3.659
  688    OH   TYR  91           OH       TYR  91 -19.630  -3.365  -8.857
  689    H    TYR  91           HN       TYR  91 -17.735   0.090  -2.529
  690    HA   TYR  91           HA       TYR  91 -16.507  -2.251  -3.904
  691   1HB   TYR  91           HB2      TYR  91 -17.356   0.496  -4.698
  692   2HB   TYR  91           HB1      TYR  91 -15.841  -0.038  -5.413
  693    HD1  TYR  91           HD2      TYR  91 -15.821  -2.262  -6.692
  694    HD2  TYR  91           HD1      TYR  91 -19.435  -0.355  -5.488
  695    HE1  TYR  91           HE2      TYR  91 -17.065  -3.541  -8.378
  696    HE2  TYR  91           HE1      TYR  91 -20.667  -1.635  -7.179
  697    HH   TYR  91           HH       TYR  91 -20.566  -3.338  -8.638
  698    H    PHE  92           HN       PHE  92 -14.335  -2.319  -4.339
  699    HA   PHE  92           HA       PHE  92 -12.514  -0.296  -3.181
  700   1HB   PHE  92           HB2      PHE  92 -12.289  -3.253  -2.433
  701   2HB   PHE  92           HB1      PHE  92 -11.327  -1.931  -1.790
  702    HD1  PHE  92           HD1      PHE  92 -12.316  -0.340  -0.171
  703    HD2  PHE  92           HD2      PHE  92 -14.553  -3.656  -1.637
  704    HE1  PHE  92           HE1      PHE  92 -13.910  -0.088   1.681
  705    HE2  PHE  92           HE2      PHE  92 -16.141  -3.400   0.214
  706    HZ   PHE  92           HZ       PHE  92 -15.820  -1.622   1.877
  707    H    CYS  93           HN       CYS  93 -10.660  -0.177  -4.442
  708    HA   CYS  93           HA       CYS  93 -10.385  -2.324  -6.504
  709   1HB   CYS  93           HB2      CYS  93  -8.785  -0.285  -7.397
  710   2HB   CYS  93           HB1      CYS  93 -10.430  -0.544  -7.901
  711    H    SER  94           HN       SER  94  -8.496  -3.333  -6.837
  712    HA   SER  94           HA       SER  94  -6.118  -2.499  -5.278
  713   1HB   SER  94           HB2      SER  94  -5.947  -4.574  -4.088
  714   2HB   SER  94           HB1      SER  94  -7.702  -4.315  -4.089
  715    HG   SER  94           HG       SER  94  -6.152  -6.084  -5.570
  716    H    GLN  95           HN       GLN  95  -4.549  -4.723  -5.752
  717    HA   GLN  95           HA       GLN  95  -4.703  -5.401  -8.600
  718   1HB   GLN  95           HB2      GLN  95  -2.644  -4.261  -9.243
  719   2HB   GLN  95           HB1      GLN  95  -3.685  -3.065  -8.482
  720   1HG   GLN  95           HG1      GLN  95  -1.738  -4.588  -6.759
  721   2HG   GLN  95           HG2      GLN  95  -1.141  -3.270  -7.752
  722   1HE2  GLN  95          HE22      GLN  95  -2.315  -2.027  -4.369
  723   2HE2  GLN  95          HE21      GLN  95  -1.293  -3.306  -4.815
  724    H    THR  96           HN       THR  96  -2.851  -6.722  -9.292
  725    HA   THR  96           HA       THR  96  -1.856  -8.376  -7.006
  726    HB   THR  96           HB       THR  96  -1.591 -10.166  -8.866
  727    HG1  THR  96           HG1      THR  96  -3.202  -8.363 -10.328
  728   1HG2  THR  96          HG23      THR  96  -4.329  -8.831  -8.480
  729   2HG2  THR  96          HG21      THR  96  -4.124 -10.360  -9.328
  730   3HG2  THR  96          HG22      THR  96  -3.731 -10.244  -7.616
  731    H    THR  97           HN       THR  97  -1.022  -6.398  -9.658
  732    HA   THR  97           HA       THR  97   1.576  -7.195 -10.344
  733    HB   THR  97           HB       THR  97   0.290  -4.419 -10.094
  734    HG1  THR  97           HG1      THR  97   0.761  -5.015 -12.516
  735   1HG2  THR  97          HG21      THR  97   2.937  -4.462 -10.116
  736   2HG2  THR  97          HG22      THR  97   2.764  -5.134 -11.734
  737   3HG2  THR  97          HG23      THR  97   2.139  -3.527 -11.376
  738    H    HIS  98           HN       HIS  98   0.697  -4.792  -7.865
  739    HA   HIS  98           HA       HIS  98   3.442  -4.889  -6.799
  740   1HB   HIS  98           HB2      HIS  98   0.962  -3.237  -6.224
  741   2HB   HIS  98           HB1      HIS  98   2.348  -3.179  -5.139
  742    HD2  HIS  98           HD2      HIS  98   1.575  -2.472  -8.958
  743    HE1  HIS  98           HE1      HIS  98   4.985  -0.407  -7.869
  744    H    VAL  99           HN       VAL  99   4.077  -5.966  -5.076
  745    HA   VAL  99           HA       VAL  99   2.035  -7.079  -3.216
  746    HB   VAL  99           HB       VAL  99   4.411  -8.564  -4.439
  747   1HG1  VAL  99          HG11      VAL  99   3.784  -9.144  -2.024
  748   2HG1  VAL  99          HG12      VAL  99   2.235  -9.693  -2.654
  749   3HG1  VAL  99          HG13      VAL  99   3.722 -10.480  -3.167
  750   1HG2  VAL  99          HG21      VAL  99   1.420  -8.687  -4.892
  751   2HG2  VAL  99          HG22      VAL  99   2.692  -8.462  -6.088
  752   3HG2  VAL  99          HG23      VAL  99   2.476 -10.030  -5.317
  753    HA   PRO 100           HA       PRO 100   1.935  -8.087  -1.306
  754   1HB   PRO 100           HB2      PRO 100   1.356  -6.477   1.009
  755   2HB   PRO 100           HB1      PRO 100   1.942  -8.140   0.993
  756   1HG   PRO 100           HG1      PRO 100   3.400  -5.743   1.723
  757   2HG   PRO 100           HG2      PRO 100   3.965  -7.413   1.772
  758   1HD   PRO 100           HD1      PRO 100   4.685  -5.352  -0.124
  759   2HD   PRO 100           HD2      PRO 100   5.272  -7.023  -0.059
  760    HA   PRO 101           HA       PRO 101  -0.562  -5.004  -3.252
  761   1HB   PRO 101           HB2      PRO 101  -2.986  -6.468  -2.707
  762   2HB   PRO 101           HB1      PRO 101  -2.060  -6.463  -4.207
  763   1HG   PRO 101           HG1      PRO 101  -2.263  -8.588  -2.239
  764   2HG   PRO 101           HG2      PRO 101  -1.422  -8.617  -3.789
  765   1HD   PRO 101           HD1      PRO 101  -0.255  -8.471  -1.160
  766   2HD   PRO 101           HD2      PRO 101   0.585  -8.455  -2.721
  767    H    THR 102           HN       THR 102  -2.187  -3.468  -2.717
  768    HA   THR 102           HA       THR 102  -2.424  -3.076   0.215
  769    HB   THR 102           HB       THR 102  -3.556  -0.814  -0.890
  770    HG1  THR 102           HG1      THR 102  -1.791  -0.790  -2.761
  771   1HG2  THR 102          HG21      THR 102  -0.572  -1.528  -0.836
  772   2HG2  THR 102          HG22      THR 102  -1.190   0.116  -0.992
  773   3HG2  THR 102          HG23      THR 102  -1.461  -0.790   0.494
  774    H    PHE 103           HN       PHE 103  -4.615  -2.551  -2.535
  775    HA   PHE 103           HA       PHE 103  -6.894  -2.979  -2.776
  776   1HB   PHE 103           HB2      PHE 103  -6.931  -5.252  -2.326
  777   2HB   PHE 103           HB1      PHE 103  -5.918  -5.084  -0.903
  778    HD1  PHE 103           HD1      PHE 103  -9.399  -4.384  -2.094
  779    HD2  PHE 103           HD2      PHE 103  -6.891  -5.282   1.231
  780    HE1  PHE 103           HE1      PHE 103 -11.378  -4.596  -0.655
  781    HE2  PHE 103           HE2      PHE 103  -8.874  -5.499   2.664
  782    HZ   PHE 103           HZ       PHE 103 -11.118  -5.155   1.724
  783    H    GLY 104           HN       GLY 104  -8.286  -1.447  -2.277
  784   1HA   GLY 104           HA1      GLY 104  -9.761  -1.072  -0.017
  785   2HA   GLY 104           HA2      GLY 104  -8.267  -0.249   0.411
  786    H    GLY 105           HN       GLY 105 -10.532  -0.410  -2.339
  787   1HA   GLY 105           HA1      GLY 105  -9.896   2.224  -3.302
  788   2HA   GLY 105           HA2      GLY 105 -11.345   1.313  -3.729
  789    H    GLY 106           HN       GLY 106 -13.191   1.452  -2.320
  790   1HA   GLY 106           HA1      GLY 106 -14.133   2.418  -0.218
  791   2HA   GLY 106           HA2      GLY 106 -13.098   3.812  -0.480
  792    H    THR 107           HN       THR 107 -15.800   2.027  -1.904
  793    HA   THR 107           HA       THR 107 -17.085   4.608  -2.577
  794    HB   THR 107           HB       THR 107 -16.390   2.443  -4.657
  795    HG1  THR 107           HG1      THR 107 -15.511   4.904  -3.835
  796   1HG2  THR 107          HG23      THR 107 -18.534   4.531  -4.546
  797   2HG2  THR 107          HG21      THR 107 -17.500   4.647  -5.967
  798   3HG2  THR 107          HG22      THR 107 -18.392   3.163  -5.646
  799    H    LYS 108           HN       LYS 108 -18.908   4.332  -1.450
  800    HA   LYS 108           HA       LYS 108 -20.156   1.699  -1.257
  801   1HB   LYS 108           HB2      LYS 108 -21.860   2.967   0.142
  802   2HB   LYS 108           HB1      LYS 108 -20.201   3.063   0.728
  803   1HG   LYS 108           HG1      LYS 108 -20.585   5.106  -1.211
  804   2HG   LYS 108           HG2      LYS 108 -21.916   5.201  -0.072
  805   1HD   LYS 108           HD1      LYS 108 -18.976   5.092   0.702
  806   2HD   LYS 108           HD2      LYS 108 -19.938   6.563   0.654
  807   1HE   LYS 108           HE1      LYS 108 -21.568   5.196   2.227
  808   2HE   LYS 108           HE2      LYS 108 -20.128   4.240   2.555
  809   1HZ   LYS 108           HZ1      LYS 108 -19.167   6.717   2.790
  810   2HZ   LYS 108           HZ2      LYS 108 -20.761   6.955   3.327
  811    H    LEU 109           HN       LEU 109 -21.978   0.987  -2.142
  812    HA   LEU 109           HA       LEU 109 -23.467   2.807  -3.980
  813   1HB   LEU 109           HB2      LEU 109 -21.812   1.173  -5.146
  814   2HB   LEU 109           HB1      LEU 109 -22.858  -0.126  -4.584
  815    HG   LEU 109           HG       LEU 109 -24.153   2.175  -6.002
  816   1HD1  LEU 109          HD12      LEU 109 -21.998   1.345  -7.259
  817   2HD1  LEU 109          HD13      LEU 109 -22.965  -0.086  -7.602
  818   3HD1  LEU 109          HD11      LEU 109 -23.503   1.496  -8.159
  819   1HD2  LEU 109          HD21      LEU 109 -24.545  -0.834  -5.898
  820   2HD2  LEU 109          HD22      LEU 109 -25.559   0.391  -5.144
  821   3HD2  LEU 109          HD23      LEU 109 -25.516   0.243  -6.896
  822    H    GLU 110           HN       GLU 110 -25.372   2.976  -2.957
  823    HA   GLU 110           HA       GLU 110 -26.733   0.424  -2.203
  824   1HB   GLU 110           HB2      GLU 110 -25.798   2.346  -0.400
  825   2HB   GLU 110           HB1      GLU 110 -27.494   2.777  -0.584
  826   1HG   GLU 110           HG1      GLU 110 -27.725   0.074  -0.362
  827   2HG   GLU 110           HG2      GLU 110 -26.279   0.334   0.609
  828    H    ILE 111           HN       ILE 111 -26.959   2.025  -4.601
  829    HA   ILE 111           HA       ILE 111 -28.662   2.732  -6.026
  830    HB   ILE 111           HB       ILE 111 -29.854   0.964  -4.144
  831   1HG1  ILE 111          HG11      ILE 111 -31.243   2.032  -6.601
  832   2HG1  ILE 111          HG12      ILE 111 -29.844   0.970  -6.710
  833   1HG2  ILE 111          HG23      ILE 111 -30.937   3.081  -3.203
  834   2HG2  ILE 111          HG21      ILE 111 -31.715   3.302  -4.766
  835   3HG2  ILE 111          HG22      ILE 111 -32.089   1.890  -3.786
  836   1HD1  ILE 111          HD13      ILE 111 -32.072   0.160  -4.875
  837   2HD1  ILE 111          HD11      ILE 111 -32.324  -0.026  -6.607
  838   3HD1  ILE 111          HD12      ILE 111 -30.981  -0.849  -5.819
  839    H    LYS 112           HN       LYS 112 -30.347   4.406  -6.258
  840    HA   LYS 112           HA       LYS 112 -29.671   6.682  -4.517
  841   1HB   LYS 112           HB2      LYS 112 -31.311   7.838  -6.268
  842   2HB   LYS 112           HB1      LYS 112 -29.673   7.410  -6.747
  843   1HG   LYS 112           HG1      LYS 112 -30.356   5.624  -8.008
  844   2HG   LYS 112           HG2      LYS 112 -31.758   5.307  -7.001
  845   1HD   LYS 112           HD1      LYS 112 -31.657   7.859  -8.587
  846   2HD   LYS 112           HD2      LYS 112 -32.055   6.364  -9.424
  847   1HE   LYS 112           HE1      LYS 112 -33.463   7.119  -6.860
  848   2HE   LYS 112           HE2      LYS 112 -34.006   7.757  -8.406
  849   1HZ   LYS 112           HZ1      LYS 112 -33.662   5.083  -8.854
  850   2HZ   LYS 112           HZ2      LYS 112 -34.353   5.153  -7.303
  851    NH1  ARG 113           NH1      ARG 113 -29.150   4.137   1.428
  852    NH2  ARG 113           NH2      ARG 113 -29.907   2.908   3.186
  853    H    ARG 113           HN       ARG 113 -30.950   5.129  -2.904
  854    HA   ARG 113           HA       ARG 113 -33.855   5.559  -3.022
  855   1HB   ARG 113           HB2      ARG 113 -33.862   4.276  -0.887
  856   2HB   ARG 113           HB1      ARG 113 -32.905   3.439  -2.101
  857   1HG   ARG 113           HG1      ARG 113 -30.856   4.069  -1.097
  858   2HG   ARG 113           HG2      ARG 113 -31.601   5.372  -0.179
  859   1HD   ARG 113           HD1      ARG 113 -33.020   3.273   0.793
  860   2HD   ARG 113           HD2      ARG 113 -31.506   2.454   0.412
  861    HE   ARG 113           HE       ARG 113 -31.845   4.614   2.418
  862   1HH1  ARG 113          HH11      ARG 113 -29.353   4.728   0.650
  863   2HH1  ARG 113          HH12      ARG 113 -28.204   3.894   1.641
  864   1HH2  ARG 113          HH21      ARG 113 -30.678   2.578   3.728
  865   2HH2  ARG 113          HH22      ARG 113 -28.974   2.640   3.425
   
  Start of MODEL           6
 Raw file had  865 H/Q atoms
  Start of MODEL    6
    1   1H    ASP   1           HT1      ASP   1   1.531   0.735   0.274
    2   2H    ASP   1           HT2      ASP   1   1.434  -0.903  -0.166
    3   3H    ASP   1           HT3      ASP   1   2.784  -0.334   0.693
    4    HA   ASP   1           HA       ASP   1   3.457   1.022  -1.162
    5   1HB   ASP   1           HB2      ASP   1   3.002  -1.415  -2.718
    6   2HB   ASP   1           HB1      ASP   1   4.518  -0.799  -2.072
    7    H    VAL   2           HN       VAL   2   3.181   0.681  -3.746
    8    HA   VAL   2           HA       VAL   2   0.766   2.134  -4.241
    9    HB   VAL   2           HB       VAL   2   2.544   0.779  -6.319
   10   1HG1  VAL   2          HG11      VAL   2   0.301   1.880  -6.959
   11   2HG1  VAL   2          HG12      VAL   2   1.049   3.409  -6.510
   12   3HG1  VAL   2          HG13      VAL   2   1.724   2.451  -7.823
   13   1HG2  VAL   2          HG21      VAL   2   2.902   3.404  -4.834
   14   2HG2  VAL   2          HG22      VAL   2   4.018   2.043  -4.872
   15   3HG2  VAL   2          HG23      VAL   2   3.761   3.010  -6.320
   16    H    VAL   3           HN       VAL   3  -1.014   0.913  -3.729
   17    HA   VAL   3           HA       VAL   3  -1.419  -1.812  -4.484
   18    HB   VAL   3           HB       VAL   3  -3.572   0.325  -4.113
   19   1HG1  VAL   3          HG12      VAL   3  -3.481  -2.691  -3.811
   20   2HG1  VAL   3          HG13      VAL   3  -4.762  -1.717  -3.097
   21   3HG1  VAL   3          HG11      VAL   3  -4.546  -1.740  -4.844
   22   1HG2  VAL   3          HG23      VAL   3  -1.849  -1.147  -2.112
   23   2HG2  VAL   3          HG21      VAL   3  -2.224   0.572  -2.178
   24   3HG2  VAL   3          HG22      VAL   3  -3.456  -0.579  -1.672
   25    H    MET   4           HN       MET   4  -2.838  -2.667  -6.095
   26    HA   MET   4           HA       MET   4  -3.277  -0.882  -8.437
   27   1HB   MET   4           HB2      MET   4  -1.971  -3.639  -8.375
   28   2HB   MET   4           HB1      MET   4  -2.574  -2.912  -9.860
   29   1HG   MET   4           HG1      MET   4  -0.752  -1.312  -8.111
   30   2HG   MET   4           HG2      MET   4  -0.056  -2.594  -9.065
   31   1HE   MET   4           HE2      MET   4  -1.104  -2.828 -11.599
   32   2HE   MET   4           HE3      MET   4  -0.448  -1.581 -12.658
   33   3HE   MET   4           HE1      MET   4   0.609  -2.418 -11.522
   34    H    THR   5           HN       THR   5  -5.408  -0.835  -8.643
   35    HA   THR   5           HA       THR   5  -7.098  -3.092  -7.866
   36    HB   THR   5           HB       THR   5  -8.119  -0.737  -9.507
   37    HG1  THR   5           HG1      THR   5  -7.962  -0.249  -6.856
   38   1HG2  THR   5          HG21      THR   5  -9.015  -2.172  -6.941
   39   2HG2  THR   5          HG22      THR   5  -9.885  -0.834  -7.685
   40   3HG2  THR   5          HG23      THR   5  -9.757  -2.376  -8.525
   41    H    GLN   6           HN       GLN   6  -8.348  -4.379  -9.231
   42    HA   GLN   6           HA       GLN   6  -7.525  -4.312 -12.110
   43   1HB   GLN   6           HB2      GLN   6  -7.885  -6.552 -10.133
   44   2HB   GLN   6           HB1      GLN   6  -8.315  -6.875 -11.809
   45   1HG   GLN   6           HG1      GLN   6  -6.044  -7.420 -11.813
   46   2HG   GLN   6           HG2      GLN   6  -5.983  -5.735 -12.315
   47   1HE2  GLN   6          HE22      GLN   6  -4.123  -4.759  -9.511
   48   2HE2  GLN   6          HE21      GLN   6  -4.670  -4.407 -11.079
   49    H    THR   7           HN       THR   7  -9.047  -4.563 -13.659
   50    HA   THR   7           HA       THR   7 -11.801  -5.293 -13.036
   51    HB   THR   7           HB       THR   7 -12.144  -2.730 -14.296
   52    HG1  THR   7           HG1      THR   7 -10.428  -2.705 -12.025
   53   1HG2  THR   7          HG23      THR   7 -12.445  -3.686 -11.398
   54   2HG2  THR   7          HG21      THR   7 -12.957  -2.085 -11.919
   55   3HG2  THR   7          HG22      THR   7 -13.732  -3.517 -12.587
   56    HA   PRO   8           HA       PRO   8 -13.620  -5.338 -13.945
   57   1HB   PRO   8           HB2      PRO   8 -14.784  -7.482 -15.382
   58   2HB   PRO   8           HB1      PRO   8 -15.212  -5.780 -15.567
   59   1HG   PRO   8           HG1      PRO   8 -13.746  -7.506 -17.420
   60   2HG   PRO   8           HG2      PRO   8 -14.387  -5.888 -17.701
   61   1HD   PRO   8           HD1      PRO   8 -11.631  -6.646 -17.232
   62   2HD   PRO   8           HD2      PRO   8 -12.279  -5.018 -17.522
   63    H    LEU   9           HN       LEU   9 -14.555  -7.393 -12.858
   64    HA   LEU   9           HA       LEU   9 -12.313  -8.951 -11.852
   65   1HB   LEU   9           HB2      LEU   9 -15.284  -8.790 -11.343
   66   2HB   LEU   9           HB1      LEU   9 -14.446 -10.241 -10.810
   67    HG   LEU   9           HG       LEU   9 -12.767  -8.726  -9.644
   68   1HD1  LEU   9          HD13      LEU   9 -14.849  -6.681 -10.475
   69   2HD1  LEU   9          HD11      LEU   9 -13.702  -6.396  -9.169
   70   3HD1  LEU   9          HD12      LEU   9 -13.120  -6.650 -10.812
   71   1HD2  LEU   9          HD21      LEU   9 -15.695  -8.618  -8.844
   72   2HD2  LEU   9          HD22      LEU   9 -14.513  -9.827  -8.352
   73   3HD2  LEU   9          HD23      LEU   9 -14.368  -8.170  -7.777
   74    H    SER  10           HN       SER  10 -14.671  -9.335 -14.319
   75    HA   SER  10           HA       SER  10 -13.533 -12.005 -14.966
   76   1HB   SER  10           HB2      SER  10 -15.745 -12.989 -15.251
   77   2HB   SER  10           HB1      SER  10 -15.841 -12.119 -13.708
   78    HG   SER  10           HG       SER  10 -16.732 -10.367 -14.782
   79    H    LEU  11           HN       LEU  11 -13.559 -12.508 -17.163
   80    HA   LEU  11           HA       LEU  11 -14.418 -10.279 -18.959
   81   1HB   LEU  11           HB2      LEU  11 -11.812 -10.927 -18.387
   82   2HB   LEU  11           HB1      LEU  11 -12.093 -11.972 -19.768
   83    HG   LEU  11           HG       LEU  11 -12.976  -9.944 -21.013
   84   1HD1  LEU  11          HD13      LEU  11 -12.005  -8.640 -18.459
   85   2HD1  LEU  11          HD11      LEU  11 -12.103  -7.740 -19.969
   86   3HD1  LEU  11          HD12      LEU  11 -13.557  -8.435 -19.264
   87   1HD2  LEU  11          HD21      LEU  11 -10.156 -10.267 -20.033
   88   2HD2  LEU  11          HD22      LEU  11 -10.799 -10.479 -21.657
   89   3HD2  LEU  11          HD23      LEU  11 -10.547  -8.860 -21.015
   90    HA   PRO  12           HA       PRO  12 -16.354 -14.218 -20.319
   91   1HB   PRO  12           HB2      PRO  12 -18.750 -12.785 -20.946
   92   2HB   PRO  12           HB1      PRO  12 -18.493 -13.834 -19.553
   93   1HG   PRO  12           HG1      PRO  12 -18.677 -10.924 -19.614
   94   2HG   PRO  12           HG2      PRO  12 -18.601 -11.987 -18.209
   95   1HD   PRO  12           HD1      PRO  12 -16.510 -10.303 -19.246
   96   2HD   PRO  12           HD2      PRO  12 -16.415 -11.419 -17.871
   97    H    VAL  13           HN       VAL  13 -15.285 -14.426 -22.234
   98    HA   VAL  13           HA       VAL  13 -16.303 -12.796 -24.521
   99    HB   VAL  13           HB       VAL  13 -14.023 -12.612 -25.408
  100   1HG1  VAL  13          HG11      VAL  13 -14.846 -11.171 -23.341
  101   2HG1  VAL  13          HG12      VAL  13 -13.571 -12.042 -22.494
  102   3HG1  VAL  13          HG13      VAL  13 -13.180 -11.051 -23.896
  103   1HG2  VAL  13          HG23      VAL  13 -13.348 -14.487 -23.122
  104   2HG2  VAL  13          HG21      VAL  13 -13.051 -14.728 -24.841
  105   3HG2  VAL  13          HG22      VAL  13 -12.114 -13.538 -23.943
  106    H    SER  14           HN       SER  14 -14.525 -14.081 -26.370
  107    HA   SER  14           HA       SER  14 -15.250 -16.945 -26.254
  108   1HB   SER  14           HB2      SER  14 -17.074 -15.452 -27.479
  109   2HB   SER  14           HB1      SER  14 -15.880 -15.399 -28.792
  110    HG   SER  14           HG       SER  14 -17.468 -17.315 -28.499
  111    H    LEU  15           HN       LEU  15 -14.035 -18.228 -27.757
  112    HA   LEU  15           HA       LEU  15 -11.365 -17.224 -28.164
  113   1HB   LEU  15           HB2      LEU  15 -12.669 -19.703 -29.382
  114   2HB   LEU  15           HB1      LEU  15 -10.942 -19.413 -29.201
  115    HG   LEU  15           HG       LEU  15 -12.991 -19.886 -27.021
  116   1HD1  LEU  15          HD13      LEU  15 -10.330 -21.162 -27.726
  117   2HD1  LEU  15          HD11      LEU  15 -11.338 -21.618 -26.357
  118   3HD1  LEU  15          HD12      LEU  15 -11.920 -21.868 -28.000
  119   1HD2  LEU  15          HD22      LEU  15 -10.311 -18.520 -26.899
  120   2HD2  LEU  15          HD23      LEU  15 -11.792 -18.118 -26.043
  121   3HD2  LEU  15          HD21      LEU  15 -10.837 -19.508 -25.542
  122    H    GLY  16           HN       GLY  16 -11.619 -15.420 -29.397
  123   1HA   GLY  16           HA1      GLY  16 -10.940 -15.272 -31.983
  124   2HA   GLY  16           HA2      GLY  16 -12.648 -15.669 -32.164
  125    H    ASP  17           HN       ASP  17 -13.390 -14.259 -29.742
  126    HA   ASP  17           HA       ASP  17 -13.754 -11.619 -30.913
  127   1HB   ASP  17           HB2      ASP  17 -15.132 -13.197 -29.066
  128   2HB   ASP  17           HB1      ASP  17 -14.409 -11.964 -28.038
  129    H    GLN  18           HN       GLN  18 -13.406  -9.679 -29.378
  130    HA   GLN  18           HA       GLN  18 -10.538  -9.717 -28.664
  131   1HB   GLN  18           HB2      GLN  18 -12.656  -7.615 -29.131
  132   2HB   GLN  18           HB1      GLN  18 -11.269  -7.173 -28.144
  133   1HG   GLN  18           HG1      GLN  18 -10.097  -8.493 -30.290
  134   2HG   GLN  18           HG2      GLN  18 -11.424  -7.618 -31.046
  135   1HE2  GLN  18          HE22      GLN  18  -8.225  -5.578 -29.598
  136   2HE2  GLN  18          HE21      GLN  18  -8.340  -7.261 -29.425
  137    H    ALA  19           HN       ALA  19  -9.874  -8.550 -26.659
  138    HA   ALA  19           HA       ALA  19 -11.798  -8.716 -24.415
  139   1HB   ALA  19           HB1      ALA  19  -9.694 -10.685 -24.976
  140   2HB   ALA  19           HB2      ALA  19  -9.431  -9.920 -23.412
  141   3HB   ALA  19           HB3      ALA  19 -10.952 -10.743 -23.746
  142    H    SER  20           HN       SER  20 -10.916  -7.722 -22.428
  143    HA   SER  20           HA       SER  20  -8.441  -6.185 -22.702
  144   1HB   SER  20           HB2      SER  20  -9.512  -4.377 -23.664
  145   2HB   SER  20           HB1      SER  20 -11.118  -4.990 -23.231
  146    HG   SER  20           HG       SER  20 -10.768  -4.287 -21.119
  147    H    ILE  21           HN       ILE  21  -7.561  -6.611 -20.804
  148    HA   ILE  21           HA       ILE  21  -9.278  -6.572 -18.360
  149    HB   ILE  21           HB       ILE  21  -6.363  -7.403 -18.643
  150   1HG1  ILE  21          HG11      ILE  21  -8.056  -9.667 -18.258
  151   2HG1  ILE  21          HG12      ILE  21  -8.716  -8.749 -19.605
  152   1HG2  ILE  21          HG22      ILE  21  -8.508  -7.660 -16.518
  153   2HG2  ILE  21          HG23      ILE  21  -7.144  -8.773 -16.538
  154   3HG2  ILE  21          HG21      ILE  21  -6.869  -7.046 -16.338
  155   1HD1  ILE  21          HD13      ILE  21  -5.781  -9.479 -19.366
  156   2HD1  ILE  21          HD11      ILE  21  -6.950 -10.447 -20.258
  157   3HD1  ILE  21          HD12      ILE  21  -6.597  -8.801 -20.771
  158    H    SER  22           HN       SER  22  -9.279  -4.761 -17.263
  159    HA   SER  22           HA       SER  22  -7.108  -2.796 -17.677
  160   1HB   SER  22           HB2      SER  22  -9.639  -2.199 -17.760
  161   2HB   SER  22           HB1      SER  22  -9.613  -2.365 -15.993
  162    HG   SER  22           HG       SER  22  -7.665  -0.871 -17.403
  163    H    CYS  23           HN       CYS  23  -6.188  -1.659 -15.929
  164    HA   CYS  23           HA       CYS  23  -6.365  -2.712 -13.217
  165   1HB   CYS  23           HB2      CYS  23  -4.908  -4.406 -14.137
  166   2HB   CYS  23           HB1      CYS  23  -3.977  -3.225 -15.020
  167    NH1  ARG  24           NH2      ARG  24  -9.290   0.878 -14.827
  168    NH2  ARG  24           NH1      ARG  24  -8.500   2.428 -16.286
  169    H    ARG  24           HN       ARG  24  -6.259  -0.916 -12.040
  170    HA   ARG  24           HA       ARG  24  -4.620   1.371 -13.047
  171   1HB   ARG  24           HB2      ARG  24  -7.114   1.071 -11.402
  172   2HB   ARG  24           HB1      ARG  24  -6.063   2.418 -10.982
  173   1HG   ARG  24           HG1      ARG  24  -6.395   3.490 -13.007
  174   2HG   ARG  24           HG2      ARG  24  -6.653   1.986 -13.883
  175   1HD   ARG  24           HD1      ARG  24  -8.832   1.801 -12.437
  176   2HD   ARG  24           HD2      ARG  24  -8.598   3.527 -12.164
  177    HE   ARG  24           HE       ARG  24  -9.358   3.872 -14.365
  178   1HH1  ARG  24          HH21      ARG  24  -9.611   0.655 -13.908
  179   2HH1  ARG  24          HH22      ARG  24  -9.252   0.169 -15.530
  180   1HH2  ARG  24          HH11      ARG  24  -8.224   3.373 -16.463
  181   2HH2  ARG  24          HH12      ARG  24  -8.457   1.749 -17.016
  182    H    SER  25           HN       SER  25  -3.721   2.765 -11.196
  183    HA   SER  25           HA       SER  25  -2.483   0.932  -9.176
  184   1HB   SER  25           HB2      SER  25  -1.040   2.141 -11.074
  185   2HB   SER  25           HB1      SER  25  -1.174   3.539  -9.988
  186    HG   SER  25           HG       SER  25  -0.539   0.953  -9.040
  187    H    SER  26           HN       SER  26  -1.700   2.081  -7.205
  188    HA   SER  26           HA       SER  26  -3.892   3.472  -5.970
  189   1HB   SER  26           HB2      SER  26  -2.148   2.019  -4.784
  190   2HB   SER  26           HB1      SER  26  -0.997   3.352  -4.985
  191    HG   SER  26           HG       SER  26  -2.899   4.641  -4.106
  192    H    GLN  27           HN       GLN  27  -1.006   4.551  -7.602
  193    HA   GLN  27           HA       GLN  27  -1.978   7.330  -7.332
  194   1HB   GLN  27           HB2      GLN  27   0.063   6.377  -5.705
  195   2HB   GLN  27           HB1      GLN  27   0.967   7.061  -7.053
  196   1HG   GLN  27           HG1      GLN  27  -0.167   9.196  -6.800
  197   2HG   GLN  27           HG2      GLN  27  -1.239   8.523  -5.577
  198   1HE2  GLN  27          HE22      GLN  27   1.282   8.519  -3.018
  199   2HE2  GLN  27          HE21      GLN  27  -0.117   7.709  -3.534
  200    H    SER  28           HN       SER  28   0.837   5.538  -8.625
  201    HA   SER  28           HA       SER  28   0.135   5.998 -11.360
  202   1HB   SER  28           HB2      SER  28   1.135   8.040 -11.858
  203   2HB   SER  28           HB1      SER  28   1.105   8.329 -10.110
  204    HG   SER  28           HG       SER  28   3.133   7.357  -9.952
  205    H    LEU  29           HN       LEU  29   1.733   5.214 -12.845
  206    HA   LEU  29           HA       LEU  29   3.819   3.557 -11.482
  207   1HB   LEU  29           HB2      LEU  29   2.405   3.074 -14.144
  208   2HB   LEU  29           HB1      LEU  29   3.587   2.000 -13.409
  209    HG   LEU  29           HG       LEU  29   0.957   2.791 -12.116
  210   1HD1  LEU  29          HD11      LEU  29   0.791   1.342 -14.204
  211   2HD1  LEU  29          HD12      LEU  29   1.736   0.129 -13.347
  212   3HD1  LEU  29          HD13      LEU  29   0.152   0.602 -12.740
  213   1HD2  LEU  29          HD21      LEU  29   3.308   1.106 -11.321
  214   2HD2  LEU  29          HD22      LEU  29   2.316   2.171 -10.331
  215   3HD2  LEU  29          HD23      LEU  29   1.703   0.592 -10.809
  216    H    VAL  30           HN       VAL  30   3.604   6.329 -13.066
  217    HA   VAL  30           HA       VAL  30   5.565   5.987 -15.174
  218    HB   VAL  30           HB       VAL  30   4.680   8.505 -13.678
  219   1HG1  VAL  30          HG12      VAL  30   6.228   8.032 -16.241
  220   2HG1  VAL  30          HG13      VAL  30   5.391   9.550 -15.930
  221   3HG1  VAL  30          HG11      VAL  30   6.690   9.027 -14.862
  222   1HG2  VAL  30          HG21      VAL  30   2.814   7.252 -14.778
  223   2HG2  VAL  30          HG22      VAL  30   3.110   8.804 -15.553
  224   3HG2  VAL  30          HG23      VAL  30   3.694   7.320 -16.302
  225    H    HIS  31           HN       HIS  31   7.734   6.228 -15.110
  226    HA   HIS  31           HA       HIS  31   9.079   5.930 -12.593
  227   1HB   HIS  31           HB2      HIS  31   9.774   5.283 -15.083
  228   2HB   HIS  31           HB1      HIS  31  10.510   6.878 -15.092
  229    HD2  HIS  31           HD2      HIS  31  10.704   3.588 -12.891
  230    HE1  HIS  31           HE1      HIS  31  14.273   5.653 -12.564
  231    H    SER  32           HN       SER  32  10.265   8.414 -14.785
  232    HA   SER  32           HA       SER  32  10.459  10.243 -12.470
  233   1HB   SER  32           HB2      SER  32  12.431   9.922 -14.020
  234   2HB   SER  32           HB1      SER  32  11.463  10.593 -15.347
  235    HG   SER  32           HG       SER  32  11.461  12.520 -14.407
  236    H    ASN  33           HN       ASN  33   9.379  10.491 -15.855
  237    HA   ASN  33           HA       ASN  33   6.887  11.737 -15.202
  238   1HB   ASN  33           HB2      ASN  33   7.467  14.068 -16.000
  239   2HB   ASN  33           HB1      ASN  33   8.325  13.642 -14.524
  240   1HD2  ASN  33          HD22      ASN  33  10.467  14.734 -17.676
  241   2HD2  ASN  33          HD21      ASN  33   8.820  15.079 -17.460
  242    H    GLY  34           HN       GLY  34   7.715   9.720 -16.969
  243   1HA   GLY  34           HA1      GLY  34   6.303  10.387 -19.324
  244   2HA   GLY  34           HA2      GLY  34   8.007  10.659 -19.672
  245    H    ASN  35           HN       ASN  35   9.302   8.654 -18.483
  246    HA   ASN  35           HA       ASN  35   8.563   6.369 -20.137
  247   1HB   ASN  35           HB2      ASN  35  10.674   6.509 -17.932
  248   2HB   ASN  35           HB1      ASN  35  10.639   5.389 -19.291
  249   1HD2  ASN  35          HD22      ASN  35  12.355   8.989 -19.756
  250   2HD2  ASN  35          HD21      ASN  35  11.848   8.403 -18.247
  251    H    THR  36           HN       THR  36   7.492   4.584 -19.554
  252    HA   THR  36           HA       THR  36   6.981   4.125 -16.646
  253    HB   THR  36           HB       THR  36   4.913   3.899 -18.918
  254    HG1  THR  36           HG1      THR  36   5.588   6.029 -18.282
  255   1HG2  THR  36          HG22      THR  36   4.937   3.310 -15.944
  256   2HG2  THR  36          HG23      THR  36   3.500   4.082 -16.603
  257   3HG2  THR  36          HG21      THR  36   4.011   2.510 -17.208
  258    OH   TYR  37           OH       TYR  37  12.433   4.012 -18.154
  259    H    TYR  37           HN       TYR  37   7.098   2.030 -15.997
  260    HA   TYR  37           HA       TYR  37   7.457  -0.034 -18.137
  261   1HB   TYR  37           HB2      TYR  37   8.800  -0.095 -15.400
  262   2HB   TYR  37           HB1      TYR  37   9.215  -1.045 -16.820
  263    HD1  TYR  37           HD1      TYR  37   9.852   0.385 -18.963
  264    HD2  TYR  37           HD2      TYR  37  10.029   1.864 -14.979
  265    HE1  TYR  37           HE1      TYR  37  11.391   2.152 -19.686
  266    HE2  TYR  37           HE2      TYR  37  11.563   3.633 -15.705
  267    HH   TYR  37           HH       TYR  37  13.185   4.020 -17.557
  268    H    LEU  38           HN       LEU  38   5.694  -1.237 -18.118
  269    HA   LEU  38           HA       LEU  38   4.735  -2.302 -15.496
  270   1HB   LEU  38           HB2      LEU  38   3.108  -0.651 -16.188
  271   2HB   LEU  38           HB1      LEU  38   3.159  -1.201 -17.856
  272    HG   LEU  38           HG       LEU  38   2.459  -3.392 -16.069
  273   1HD1  LEU  38          HD11      LEU  38   0.742  -0.888 -16.014
  274   2HD1  LEU  38          HD12      LEU  38   0.200  -2.473 -15.468
  275   3HD1  LEU  38          HD13      LEU  38   1.521  -1.660 -14.635
  276   1HD2  LEU  38          HD21      LEU  38   2.114  -3.035 -18.622
  277   2HD2  LEU  38          HD22      LEU  38   0.791  -3.765 -17.716
  278   3HD2  LEU  38          HD23      LEU  38   0.722  -2.062 -18.156
  279    H    ASN  39           HN       ASN  39   4.462  -4.447 -15.424
  280    HA   ASN  39           HA       ASN  39   4.729  -5.947 -17.996
  281   1HB   ASN  39           HB2      ASN  39   6.512  -6.797 -16.786
  282   2HB   ASN  39           HB1      ASN  39   5.830  -6.306 -15.241
  283   1HD2  ASN  39          HD22      ASN  39   3.867  -9.380 -14.996
  284   2HD2  ASN  39          HD21      ASN  39   3.677  -7.714 -14.737
  285    CH2  TRP  40           CH2      TRP  40  -3.986  -6.397 -17.567
  286    H    TRP  40           HN       TRP  40   3.405  -7.727 -18.372
  287    HA   TRP  40           HA       TRP  40   0.904  -7.770 -16.730
  288   1HB   TRP  40           HB2      TRP  40   1.512  -7.953 -19.662
  289   2HB   TRP  40           HB1      TRP  40   0.193  -8.964 -19.082
  290    HD1  TRP  40           HD1      TRP  40   1.117  -5.314 -19.743
  291    HE1  TRP  40           HE1      TRP  40  -0.990  -3.973 -19.330
  292    HE3  TRP  40           HE3      TRP  40  -1.697  -8.864 -17.723
  293    HZ2  TRP  40           HZ2      TRP  40  -3.681  -4.389 -18.223
  294    HZ3  TRP  40           HZ3      TRP  40  -4.008  -8.455 -16.993
  295    HH2  TRP  40           HH2      TRP  40  -5.004  -6.221 -17.261
  296    OH   TYR  41           OH       TYR  41   6.508 -14.037 -15.190
  297    H    TYR  41           HN       TYR  41  -0.275  -9.964 -16.952
  298    HA   TYR  41           HA       TYR  41   1.446 -12.293 -17.332
  299   1HB   TYR  41           HB2      TYR  41   1.166 -11.057 -14.692
  300   2HB   TYR  41           HB1      TYR  41   0.537 -12.702 -14.673
  301    HD1  TYR  41           HD1      TYR  41   2.126 -14.331 -16.268
  302    HD2  TYR  41           HD2      TYR  41   3.419 -10.920 -14.079
  303    HE1  TYR  41           HE1      TYR  41   4.417 -15.197 -16.272
  304    HE2  TYR  41           HE2      TYR  41   5.714 -11.788 -14.088
  305    HH   TYR  41           HH       TYR  41   6.834 -14.032 -14.287
  306    H    LEU  42           HN       LEU  42   0.328 -14.325 -16.898
  307    HA   LEU  42           HA       LEU  42  -2.603 -14.181 -16.595
  308   1HB   LEU  42           HB2      LEU  42  -2.466 -13.870 -18.982
  309   2HB   LEU  42           HB1      LEU  42  -1.145 -15.020 -19.134
  310    HG   LEU  42           HG       LEU  42  -2.705 -16.856 -18.455
  311   1HD1  LEU  42          HD11      LEU  42  -4.577 -14.510 -18.271
  312   2HD1  LEU  42          HD12      LEU  42  -5.220 -16.080 -18.741
  313   3HD1  LEU  42          HD13      LEU  42  -4.417 -15.886 -17.187
  314   1HD2  LEU  42          HD23      LEU  42  -2.324 -16.074 -20.880
  315   2HD2  LEU  42          HD21      LEU  42  -3.768 -17.035 -20.581
  316   3HD2  LEU  42          HD22      LEU  42  -3.894 -15.288 -20.754
  317    H    GLN  43           HN       GLN  43  -3.256 -15.856 -15.425
  318    HA   GLN  43           HA       GLN  43  -1.451 -18.227 -15.202
  319   1HB   GLN  43           HB2      GLN  43  -3.468 -16.894 -13.372
  320   2HB   GLN  43           HB1      GLN  43  -3.080 -18.592 -13.126
  321   1HG   GLN  43           HG1      GLN  43  -1.147 -18.031 -12.097
  322   2HG   GLN  43           HG2      GLN  43  -0.628 -17.131 -13.515
  323   1HE2  GLN  43          HE22      GLN  43  -0.703 -14.368 -11.271
  324   2HE2  GLN  43          HE21      GLN  43   0.307 -15.511 -12.018
  325    H    LYS  44           HN       LYS  44  -2.101 -19.885 -16.465
  326    HA   LYS  44           HA       LYS  44  -4.864 -20.076 -17.373
  327   1HB   LYS  44           HB2      LYS  44  -2.380 -21.023 -18.261
  328   2HB   LYS  44           HB1      LYS  44  -3.170 -22.477 -17.678
  329   1HG   LYS  44           HG1      LYS  44  -4.909 -20.708 -19.289
  330   2HG   LYS  44           HG2      LYS  44  -3.559 -21.401 -20.175
  331   1HD   LYS  44           HD1      LYS  44  -4.279 -23.607 -19.814
  332   2HD   LYS  44           HD2      LYS  44  -5.242 -23.171 -18.409
  333   1HE   LYS  44           HE1      LYS  44  -6.984 -22.286 -19.713
  334   2HE   LYS  44           HE2      LYS  44  -5.939 -22.019 -21.103
  335   1HZ   LYS  44           HZ1      LYS  44  -5.944 -24.276 -21.635
  336   2HZ   LYS  44           HZ2      LYS  44  -6.536 -24.738 -20.111
  337    H    ALA  45           HN       ALA  45  -6.046 -22.186 -17.130
  338    HA   ALA  45           HA       ALA  45  -6.674 -22.675 -14.428
  339   1HB   ALA  45           HB1      ALA  45  -7.018 -24.522 -16.837
  340   2HB   ALA  45           HB2      ALA  45  -7.882 -24.685 -15.311
  341   3HB   ALA  45           HB3      ALA  45  -8.155 -23.276 -16.332
  342    H    GLY  46           HN       GLY  46  -4.656 -22.974 -13.357
  343   1HA   GLY  46           HA1      GLY  46  -3.149 -24.370 -12.215
  344   2HA   GLY  46           HA2      GLY  46  -3.998 -25.746 -12.907
  345    H    GLN  47           HN       GLN  47  -2.491 -23.196 -14.819
  346    HA   GLN  47           HA       GLN  47  -0.434 -25.206 -15.661
  347   1HB   GLN  47           HB2      GLN  47  -2.459 -24.323 -17.264
  348   2HB   GLN  47           HB1      GLN  47  -1.268 -23.068 -17.582
  349   1HG   GLN  47           HG1      GLN  47   0.409 -25.032 -17.918
  350   2HG   GLN  47           HG2      GLN  47  -1.025 -26.046 -18.047
  351   1HE2  GLN  47          HE22      GLN  47  -0.157 -23.382 -21.035
  352   2HE2  GLN  47          HE21      GLN  47   0.626 -23.250 -19.535
  353    H    SER  48           HN       SER  48   1.460 -24.188 -16.741
  354    HA   SER  48           HA       SER  48   2.722 -22.339 -14.998
  355   1HB   SER  48           HB2      SER  48   4.075 -23.823 -16.405
  356   2HB   SER  48           HB1      SER  48   3.357 -23.148 -17.881
  357    HG   SER  48           HG       SER  48   5.469 -22.252 -16.714
  358    HA   PRO  49           HA       PRO  49   0.756 -18.622 -16.433
  359   1HB   PRO  49           HB2      PRO  49   2.721 -17.081 -14.953
  360   2HB   PRO  49           HB1      PRO  49   1.042 -17.386 -14.515
  361   1HG   PRO  49           HG1      PRO  49   3.406 -18.515 -13.311
  362   2HG   PRO  49           HG2      PRO  49   1.725 -18.833 -12.882
  363   1HD   PRO  49           HD1      PRO  49   3.565 -20.582 -14.268
  364   2HD   PRO  49           HD2      PRO  49   1.882 -20.911 -13.813
  365    H    LYS  50           HN       LYS  50   1.287 -16.910 -17.845
  366    HA   LYS  50           HA       LYS  50   4.094 -16.884 -18.855
  367   1HB   LYS  50           HB2      LYS  50   1.587 -17.610 -20.290
  368   2HB   LYS  50           HB1      LYS  50   2.617 -16.473 -21.153
  369   1HG   LYS  50           HG1      LYS  50   4.410 -17.976 -21.272
  370   2HG   LYS  50           HG2      LYS  50   3.858 -18.904 -19.883
  371   1HD   LYS  50           HD1      LYS  50   2.067 -18.809 -22.280
  372   2HD   LYS  50           HD2      LYS  50   3.521 -19.792 -22.393
  373   1HE   LYS  50           HE1      LYS  50   2.886 -21.021 -20.365
  374   2HE   LYS  50           HE2      LYS  50   1.472 -19.994 -20.160
  375   1HZ   LYS  50           HZ1      LYS  50   0.488 -20.858 -22.088
  376   2HZ   LYS  50           HZ2      LYS  50   1.923 -21.609 -22.599
  377    H    LEU  51           HN       LEU  51   4.747 -14.976 -19.865
  378    HA   LEU  51           HA       LEU  51   3.247 -12.587 -18.947
  379   1HB   LEU  51           HB2      LEU  51   5.556 -12.519 -18.320
  380   2HB   LEU  51           HB1      LEU  51   6.085 -13.166 -19.864
  381    HG   LEU  51           HG       LEU  51   5.144 -10.963 -20.889
  382   1HD1  LEU  51          HD13      LEU  51   4.855 -10.524 -17.967
  383   2HD1  LEU  51          HD11      LEU  51   5.595  -9.192 -18.851
  384   3HD1  LEU  51          HD12      LEU  51   3.992  -9.769 -19.302
  385   1HD2  LEU  51          HD23      LEU  51   7.649 -11.720 -19.921
  386   2HD2  LEU  51          HD21      LEU  51   7.323 -10.346 -20.971
  387   3HD2  LEU  51          HD22      LEU  51   7.402 -10.121 -19.226
  388    H    LEU  52           HN       LEU  52   2.425 -11.076 -20.302
  389    HA   LEU  52           HA       LEU  52   2.420 -11.757 -23.207
  390   1HB   LEU  52           HB2      LEU  52   0.622  -9.979 -21.488
  391   2HB   LEU  52           HB1      LEU  52   0.470 -10.088 -23.234
  392    HG   LEU  52           HG       LEU  52  -1.130 -11.630 -22.393
  393   1HD1  LEU  52          HD11      LEU  52   0.566 -12.512 -24.139
  394   2HD1  LEU  52          HD12      LEU  52   1.256 -13.438 -22.809
  395   3HD1  LEU  52          HD13      LEU  52  -0.416 -13.703 -23.293
  396   1HD2  LEU  52          HD22      LEU  52   0.110 -11.598 -20.067
  397   2HD2  LEU  52          HD23      LEU  52  -0.863 -12.995 -20.516
  398   3HD2  LEU  52          HD21      LEU  52   0.889 -13.054 -20.678
  399    H    ILE  53           HN       ILE  53   2.510  -8.892 -21.119
  400    HA   ILE  53           HA       ILE  53   4.313  -7.591 -23.131
  401    HB   ILE  53           HB       ILE  53   2.228  -6.313 -21.316
  402   1HG1  ILE  53          HG11      ILE  53   1.160  -7.565 -23.119
  403   2HG1  ILE  53          HG12      ILE  53   0.980  -5.836 -23.387
  404   1HG2  ILE  53          HG21      ILE  53   4.517  -5.175 -22.436
  405   2HG2  ILE  53          HG22      ILE  53   3.271  -4.777 -23.610
  406   3HG2  ILE  53          HG23      ILE  53   3.091  -4.277 -21.933
  407   1HD1  ILE  53          HD11      ILE  53   3.426  -6.517 -24.585
  408   2HD1  ILE  53          HD12      ILE  53   2.319  -7.807 -25.034
  409   3HD1  ILE  53          HD13      ILE  53   1.922  -6.135 -25.413
  410    OH   TYR  54           OH       TYR  54  10.175  -6.135 -25.773
  411    H    TYR  54           HN       TYR  54   6.145  -6.672 -22.316
  412    HA   TYR  54           HA       TYR  54   6.460  -6.798 -19.342
  413   1HB   TYR  54           HB2      TYR  54   8.935  -7.004 -19.840
  414   2HB   TYR  54           HB1      TYR  54   7.990  -8.336 -20.496
  415    HD1  TYR  54           HD2      TYR  54   7.464  -8.395 -22.942
  416    HD2  TYR  54           HD1      TYR  54  10.063  -5.456 -21.303
  417    HE1  TYR  54           HE2      TYR  54   8.333  -7.905 -25.183
  418    HE2  TYR  54           HE1      TYR  54  10.928  -4.970 -23.545
  419    HH   TYR  54           HH       TYR  54  10.660  -6.907 -26.077
  420    H    LYS  55           HN       LYS  55   6.914  -4.789 -22.178
  421    HA   LYS  55           HA       LYS  55   7.606  -2.538 -20.325
  422   1HB   LYS  55           HB2      LYS  55   8.803  -3.422 -22.928
  423   2HB   LYS  55           HB1      LYS  55   8.639  -1.687 -22.705
  424   1HG   LYS  55           HG1      LYS  55   9.639  -2.734 -20.252
  425   2HG   LYS  55           HG2      LYS  55  10.583  -3.469 -21.542
  426   1HD   LYS  55           HD1      LYS  55  10.625  -0.992 -22.495
  427   2HD   LYS  55           HD2      LYS  55  10.303  -0.567 -20.819
  428   1HE   LYS  55           HE1      LYS  55  12.625  -0.624 -20.779
  429   2HE   LYS  55           HE2      LYS  55  12.274  -2.295 -20.355
  430   1HZ   LYS  55           HZ1      LYS  55  12.329  -2.646 -22.894
  431   2HZ   LYS  55           HZ2      LYS  55  13.200  -1.188 -22.916
  432    H    VAL  56           HN       VAL  56   4.986  -3.038 -20.795
  433    HA   VAL  56           HA       VAL  56   3.000  -2.053 -21.542
  434    HB   VAL  56           HB       VAL  56   4.862   0.306 -22.123
  435   1HG1  VAL  56          HG12      VAL  56   1.868   0.061 -21.688
  436   2HG1  VAL  56          HG13      VAL  56   2.725   1.597 -21.601
  437   3HG1  VAL  56          HG11      VAL  56   2.695   0.690 -23.110
  438   1HG2  VAL  56          HG22      VAL  56   4.648  -0.897 -19.707
  439   2HG2  VAL  56          HG23      VAL  56   4.831   0.845 -19.881
  440   3HG2  VAL  56          HG21      VAL  56   3.234   0.148 -19.628
  441    H    SER  57           HN       SER  57   2.336  -3.087 -23.333
  442    HA   SER  57           HA       SER  57   1.737  -3.296 -25.587
  443   1HB   SER  57           HB2      SER  57   1.856  -1.373 -26.883
  444   2HB   SER  57           HB1      SER  57   2.512  -0.606 -25.428
  445    HG   SER  57           HG       SER  57   4.507  -0.832 -26.177
  446    H    ASN  58           HN       ASN  58   5.062  -2.974 -24.655
  447    HA   ASN  58           HA       ASN  58   6.186  -4.203 -27.011
  448   1HB   ASN  58           HB2      ASN  58   7.228  -4.038 -24.139
  449   2HB   ASN  58           HB1      ASN  58   8.201  -4.508 -25.527
  450   1HD2  ASN  58          HD22      ASN  58   6.932  -0.771 -26.307
  451   2HD2  ASN  58          HD21      ASN  58   5.904  -2.118 -26.391
  452    NH1  ARG  59           NH2      ARG  59   0.983  -6.276 -31.486
  453    NH2  ARG  59           NH1      ARG  59   3.089  -5.411 -31.548
  454    H    ARG  59           HN       ARG  59   5.082  -6.056 -27.492
  455    HA   ARG  59           HA       ARG  59   4.427  -8.120 -25.611
  456   1HB   ARG  59           HB2      ARG  59   4.844  -8.182 -28.628
  457   2HB   ARG  59           HB1      ARG  59   4.141  -9.507 -27.708
  458   1HG   ARG  59           HG1      ARG  59   2.201  -8.301 -27.199
  459   2HG   ARG  59           HG2      ARG  59   2.993  -6.743 -27.407
  460   1HD   ARG  59           HD1      ARG  59   3.161  -8.173 -29.885
  461   2HD   ARG  59           HD2      ARG  59   1.489  -8.213 -29.333
  462    HE   ARG  59           HE       ARG  59   2.266  -5.561 -28.980
  463   1HH1  ARG  59          HH21      ARG  59   0.254  -6.717 -30.959
  464   2HH1  ARG  59          HH22      ARG  59   0.843  -6.065 -32.452
  465   1HH2  ARG  59          HH11      ARG  59   3.941  -5.202 -31.069
  466   2HH2  ARG  59          HH12      ARG  59   2.990  -5.184 -32.516
  467    H    PHE  60           HN       PHE  60   5.543  -9.870 -24.914
  468    HA   PHE  60           HA       PHE  60   8.379  -9.890 -25.007
  469   1HB   PHE  60           HB2      PHE  60   6.809 -11.157 -23.383
  470   2HB   PHE  60           HB1      PHE  60   6.652 -12.374 -24.646
  471    HD1  PHE  60           HD2      PHE  60   9.425 -10.395 -23.060
  472    HD2  PHE  60           HD1      PHE  60   8.100 -14.195 -24.457
  473    HE1  PHE  60           HE2      PHE  60  11.565 -11.393 -22.384
  474    HE2  PHE  60           HE1      PHE  60  10.241 -15.188 -23.780
  475    HZ   PHE  60           HZ       PHE  60  11.974 -13.789 -22.741
  476    H    SER  61           HN       SER  61   9.812 -11.420 -26.025
  477    HA   SER  61           HA       SER  61   9.550 -11.560 -28.823
  478   1HB   SER  61           HB2      SER  61  11.673 -11.939 -27.394
  479   2HB   SER  61           HB1      SER  61  11.108 -13.609 -27.181
  480    HG   SER  61           HG       SER  61  10.775 -13.472 -29.586
  481    H    GLY  62           HN       GLY  62   8.199 -13.646 -26.424
  482   1HA   GLY  62           HA1      GLY  62   7.383 -15.572 -28.566
  483   2HA   GLY  62           HA2      GLY  62   7.522 -16.000 -26.865
  484    H    VAL  63           HN       VAL  63   6.070 -13.011 -27.987
  485    HA   VAL  63           HA       VAL  63   3.418 -14.080 -27.100
  486    HB   VAL  63           HB       VAL  63   4.717 -11.355 -26.710
  487   1HG1  VAL  63          HG11      VAL  63   1.791 -12.130 -26.455
  488   2HG1  VAL  63          HG12      VAL  63   2.477 -10.701 -25.690
  489   3HG1  VAL  63          HG13      VAL  63   2.467 -10.841 -27.445
  490   1HG2  VAL  63          HG21      VAL  63   4.930 -13.392 -25.089
  491   2HG2  VAL  63          HG22      VAL  63   4.497 -11.830 -24.405
  492   3HG2  VAL  63          HG23      VAL  63   3.254 -13.045 -24.681
  493    HA   PRO  64           HA       PRO  64   2.214 -13.290 -31.277
  494   1HB   PRO  64           HB2      PRO  64  -0.568 -13.303 -30.393
  495   2HB   PRO  64           HB1      PRO  64   0.286 -14.536 -31.319
  496   1HG   PRO  64           HG1      PRO  64  -0.511 -14.682 -28.573
  497   2HG   PRO  64           HG2      PRO  64   0.444 -15.864 -29.465
  498   1HD   PRO  64           HD1      PRO  64   1.337 -14.034 -27.404
  499   2HD   PRO  64           HD2      PRO  64   2.282 -15.271 -28.253
  500    H    ASP  65           HN       ASP  65   1.355 -11.608 -32.495
  501    HA   ASP  65           HA       ASP  65   1.471  -8.999 -31.375
  502   1HB   ASP  65           HB2      ASP  65   0.395  -8.332 -33.604
  503   2HB   ASP  65           HB1      ASP  65   1.831  -9.338 -33.764
  504    NH1  ARG  66           NH2      ARG  66  -2.012 -12.542 -34.621
  505    NH2  ARG  66           NH1      ARG  66  -0.390 -13.864 -33.743
  506    H    ARG  66           HN       ARG  66  -1.194 -11.217 -31.649
  507    HA   ARG  66           HA       ARG  66  -3.388  -9.460 -31.555
  508   1HB   ARG  66           HB2      ARG  66  -3.079 -12.081 -30.020
  509   2HB   ARG  66           HB1      ARG  66  -4.602 -11.336 -30.491
  510   1HG   ARG  66           HG1      ARG  66  -4.451 -12.119 -32.621
  511   2HG   ARG  66           HG2      ARG  66  -2.754 -11.678 -32.746
  512   1HD   ARG  66           HD1      ARG  66  -2.351 -13.713 -31.148
  513   2HD   ARG  66           HD2      ARG  66  -3.965 -14.212 -31.638
  514    HE   ARG  66           HE       ARG  66  -2.846 -15.054 -33.542
  515   1HH1  ARG  66          HH21      ARG  66  -2.981 -12.314 -34.697
  516   2HH1  ARG  66          HH22      ARG  66  -1.331 -12.005 -35.120
  517   1HH2  ARG  66          HH11      ARG  66  -0.138 -14.631 -33.157
  518   2HH2  ARG  66          HH12      ARG  66   0.316 -13.360 -34.241
  519    H    PHE  67           HN       PHE  67  -1.252 -10.473 -28.949
  520    HA   PHE  67           HA       PHE  67  -2.881  -9.161 -26.903
  521   1HB   PHE  67           HB2      PHE  67  -0.082 -10.378 -26.907
  522   2HB   PHE  67           HB1      PHE  67  -0.825  -9.689 -25.463
  523    HD1  PHE  67           HD1      PHE  67  -2.850 -10.732 -24.485
  524    HD2  PHE  67           HD2      PHE  67  -0.891 -12.475 -27.843
  525    HE1  PHE  67           HE1      PHE  67  -4.146 -12.797 -24.173
  526    HE2  PHE  67           HE2      PHE  67  -2.175 -14.545 -27.513
  527    HZ   PHE  67           HZ       PHE  67  -3.793 -14.710 -25.676
  528    H    SER  68           HN       SER  68  -2.770  -7.120 -26.280
  529    HA   SER  68           HA       SER  68  -0.331  -5.540 -26.939
  530   1HB   SER  68           HB2      SER  68  -2.386  -5.268 -28.595
  531   2HB   SER  68           HB1      SER  68  -3.090  -4.315 -27.273
  532    HG   SER  68           HG       SER  68  -1.838  -2.848 -28.244
  533    H    GLY  69           HN       GLY  69   0.245  -4.084 -25.430
  534   1HA   GLY  69           HA1      GLY  69  -1.602  -3.710 -23.101
  535   2HA   GLY  69           HA2      GLY  69   0.125  -3.971 -22.884
  536    H    SER  70           HN       SER  70  -1.980  -1.667 -22.536
  537    HA   SER  70           HA       SER  70  -0.020   0.452 -23.078
  538   1HB   SER  70           HB2      SER  70  -1.925   1.778 -24.332
  539   2HB   SER  70           HB1      SER  70  -1.119   0.490 -25.247
  540    HG   SER  70           HG       SER  70  -3.559   0.365 -23.806
  541    H    GLY  71           HN       GLY  71  -0.392   2.310 -21.853
  542   1HA   GLY  71           HA1      GLY  71  -2.875   2.777 -20.456
  543   2HA   GLY  71           HA2      GLY  71  -1.700   2.018 -19.390
  544    H    SER  72           HN       SER  72  -2.874   4.911 -20.457
  545    HA   SER  72           HA       SER  72  -0.325   6.384 -20.096
  546   1HB   SER  72           HB2      SER  72  -3.133   7.217 -20.980
  547   2HB   SER  72           HB1      SER  72  -1.807   8.376 -20.761
  548    HG   SER  72           HG       SER  72  -1.621   7.684 -22.843
  549    H    GLY  73           HN       GLY  73   0.017   7.861 -18.473
  550   1HA   GLY  73           HA1      GLY  73  -0.201   8.839 -16.354
  551   2HA   GLY  73           HA2      GLY  73  -1.942   8.755 -16.592
  552    H    THR  74           HN       THR  74  -3.098   7.192 -15.537
  553    HA   THR  74           HA       THR  74  -1.532   5.146 -14.016
  554    HB   THR  74           HB       THR  74  -2.977   5.580 -12.026
  555    HG1  THR  74           HG1      THR  74  -4.790   6.107 -13.407
  556   1HG2  THR  74          HG22      THR  74  -1.046   7.264 -12.501
  557   2HG2  THR  74          HG23      THR  74  -2.261   8.300 -13.240
  558   3HG2  THR  74          HG21      THR  74  -2.366   7.906 -11.529
  559    H    ASP  75           HN       ASP  75  -3.304   5.166 -16.481
  560    HA   ASP  75           HA       ASP  75  -5.171   3.020 -15.538
  561   1HB   ASP  75           HB2      ASP  75  -5.504   4.998 -17.849
  562   2HB   ASP  75           HB1      ASP  75  -6.659   3.736 -17.431
  563    H    PHE  76           HN       PHE  76  -4.727   1.078 -16.329
  564    HA   PHE  76           HA       PHE  76  -3.392   0.890 -19.004
  565   1HB   PHE  76           HB2      PHE  76  -2.779  -0.707 -16.467
  566   2HB   PHE  76           HB1      PHE  76  -2.077  -1.048 -18.044
  567    HD1  PHE  76           HD1      PHE  76  -2.470   1.777 -15.604
  568    HD2  PHE  76           HD2      PHE  76  -0.053  -0.010 -18.625
  569    HE1  PHE  76           HE1      PHE  76  -0.710   3.433 -15.180
  570    HE2  PHE  76           HE2      PHE  76   1.708   1.641 -18.186
  571    HZ   PHE  76           HZ       PHE  76   1.382   3.364 -16.464
  572    H    THR  77           HN       THR  77  -3.771  -1.068 -20.157
  573    HA   THR  77           HA       THR  77  -5.668  -3.031 -19.122
  574    HB   THR  77           HB       THR  77  -6.502  -1.100 -21.366
  575    HG1  THR  77           HG1      THR  77  -6.854  -0.443 -19.223
  576   1HG2  THR  77          HG23      THR  77  -7.251  -3.889 -20.885
  577   2HG2  THR  77          HG21      THR  77  -8.606  -2.852 -20.462
  578   3HG2  THR  77          HG22      THR  77  -7.927  -2.794 -22.084
  579    H    LEU  78           HN       LEU  78  -5.550  -4.941 -20.187
  580    HA   LEU  78           HA       LEU  78  -3.535  -5.118 -22.362
  581   1HB   LEU  78           HB2      LEU  78  -3.563  -6.602 -20.235
  582   2HB   LEU  78           HB1      LEU  78  -4.966  -7.397 -20.928
  583    HG   LEU  78           HG       LEU  78  -2.601  -7.102 -22.722
  584   1HD1  LEU  78          HD11      LEU  78  -2.609  -8.640 -20.148
  585   2HD1  LEU  78          HD12      LEU  78  -1.843  -9.375 -21.555
  586   3HD1  LEU  78          HD13      LEU  78  -1.274  -7.822 -20.955
  587   1HD2  LEU  78          HD21      LEU  78  -5.018  -8.633 -22.542
  588   2HD2  LEU  78          HD22      LEU  78  -3.833  -8.623 -23.843
  589   3HD2  LEU  78          HD23      LEU  78  -3.661  -9.753 -22.504
  590    H    LYS  79           HN       LYS  79  -4.475  -4.727 -24.300
  591    HA   LYS  79           HA       LYS  79  -7.173  -5.812 -24.854
  592   1HB   LYS  79           HB2      LYS  79  -5.323  -4.185 -26.657
  593   2HB   LYS  79           HB1      LYS  79  -7.047  -4.444 -26.891
  594   1HG   LYS  79           HG1      LYS  79  -7.133  -3.414 -24.407
  595   2HG   LYS  79           HG2      LYS  79  -5.640  -2.658 -24.949
  596   1HD   LYS  79           HD1      LYS  79  -6.967  -1.096 -25.930
  597   2HD   LYS  79           HD2      LYS  79  -7.319  -2.326 -27.136
  598   1HE   LYS  79           HE1      LYS  79  -8.884  -2.311 -24.568
  599   2HE   LYS  79           HE2      LYS  79  -9.294  -1.152 -25.828
  600   1HZ   LYS  79           HZ1      LYS  79  -9.033  -4.050 -26.372
  601   2HZ   LYS  79           HZ2      LYS  79 -10.500  -3.340 -25.891
  602    H    ILE  80           HN       ILE  80  -7.534  -7.606 -25.975
  603    HA   ILE  80           HA       ILE  80  -5.257  -8.795 -27.509
  604    HB   ILE  80           HB       ILE  80  -7.603 -10.302 -26.275
  605   1HG1  ILE  80          HG11      ILE  80  -4.813 -10.054 -25.109
  606   2HG1  ILE  80          HG12      ILE  80  -6.181  -9.098 -24.552
  607   1HG2  ILE  80          HG21      ILE  80  -5.612 -11.036 -28.140
  608   2HG2  ILE  80          HG22      ILE  80  -5.003 -11.663 -26.615
  609   3HG2  ILE  80          HG23      ILE  80  -6.588 -12.156 -27.196
  610   1HD1  ILE  80          HD12      ILE  80  -6.333 -12.117 -24.697
  611   2HD1  ILE  80          HD13      ILE  80  -5.690 -11.295 -23.279
  612   3HD1  ILE  80          HD11      ILE  80  -7.354 -11.016 -23.779
  613    H    SER  81           HN       SER  81  -5.499  -9.087 -29.564
  614    HA   SER  81           HA       SER  81  -8.078  -8.420 -30.731
  615   1HB   SER  81           HB2      SER  81  -5.306  -8.957 -31.830
  616   2HB   SER  81           HB1      SER  81  -6.696  -8.876 -32.929
  617    HG   SER  81           HG       SER  81  -6.657  -6.798 -32.662
  618    NH1  ARG  82           NH1      ARG  82  -8.090 -18.409 -32.124
  619    NH2  ARG  82           NH2      ARG  82 -10.310 -18.016 -32.419
  620    H    ARG  82           HN       ARG  82  -6.962 -11.174 -29.458
  621    HA   ARG  82           HA       ARG  82  -8.938 -12.797 -30.774
  622   1HB   ARG  82           HB2      ARG  82  -7.435 -12.968 -32.634
  623   2HB   ARG  82           HB1      ARG  82  -6.020 -13.026 -31.596
  624   1HG   ARG  82           HG1      ARG  82  -6.245 -15.258 -32.306
  625   2HG   ARG  82           HG2      ARG  82  -7.013 -15.280 -30.727
  626   1HD   ARG  82           HD1      ARG  82  -9.085 -14.534 -32.443
  627   2HD   ARG  82           HD2      ARG  82  -8.193 -15.740 -33.368
  628    HE   ARG  82           HE       ARG  82  -9.259 -16.256 -30.614
  629   1HH1  ARG  82          HH11      ARG  82  -7.196 -18.082 -31.813
  630   2HH1  ARG  82          HH12      ARG  82  -8.182 -19.330 -32.500
  631   1HH2  ARG  82          HH21      ARG  82 -11.089 -17.396 -32.330
  632   2HH2  ARG  82          HH22      ARG  82 -10.440 -18.929 -32.804
  633    H    VAL  83           HN       VAL  83  -9.623 -13.857 -29.045
  634    HA   VAL  83           HA       VAL  83  -7.697 -14.718 -26.967
  635    HB   VAL  83           HB       VAL  83 -10.747 -14.918 -27.124
  636   1HG1  VAL  83          HG13      VAL  83  -8.799 -15.412 -24.843
  637   2HG1  VAL  83          HG11      VAL  83 -10.546 -15.309 -24.649
  638   3HG1  VAL  83          HG12      VAL  83  -9.843 -16.607 -25.606
  639   1HG2  VAL  83          HG23      VAL  83  -9.036 -12.690 -26.648
  640   2HG2  VAL  83          HG21      VAL  83 -10.786 -12.759 -26.463
  641   3HG2  VAL  83          HG22      VAL  83  -9.740 -13.134 -25.096
  642    H    GLU  84           HN       GLU  84  -7.486 -16.883 -26.296
  643    HA   GLU  84           HA       GLU  84  -8.689 -18.930 -28.096
  644   1HB   GLU  84           HB2      GLU  84  -5.841 -18.184 -27.831
  645   2HB   GLU  84           HB1      GLU  84  -6.119 -19.908 -27.600
  646   1HG   GLU  84           HG1      GLU  84  -7.145 -20.138 -29.742
  647   2HG   GLU  84           HG2      GLU  84  -7.360 -18.400 -29.913
  648    H    ALA  85           HN       ALA  85  -8.341 -21.171 -27.247
  649    HA   ALA  85           HA       ALA  85  -9.432 -21.458 -24.677
  650   1HB   ALA  85           HB1      ALA  85  -9.319 -23.262 -26.428
  651   2HB   ALA  85           HB2      ALA  85  -7.590 -23.417 -26.132
  652   3HB   ALA  85           HB3      ALA  85  -8.741 -23.837 -24.867
  653    H    GLU  86           HN       GLU  86  -6.024 -21.557 -25.642
  654    HA   GLU  86           HA       GLU  86  -5.005 -22.183 -23.031
  655   1HB   GLU  86           HB2      GLU  86  -3.709 -20.692 -25.365
  656   2HB   GLU  86           HB1      GLU  86  -2.834 -21.348 -23.985
  657   1HG   GLU  86           HG1      GLU  86  -3.583 -23.620 -24.557
  658   2HG   GLU  86           HG2      GLU  86  -4.541 -22.989 -25.891
  659    H    ASP  87           HN       ASP  87  -5.947 -19.205 -24.580
  660    HA   ASP  87           HA       ASP  87  -4.651 -17.446 -22.680
  661   1HB   ASP  87           HB2      ASP  87  -5.521 -16.841 -25.032
  662   2HB   ASP  87           HB1      ASP  87  -7.140 -16.843 -24.341
  663    H    LEU  88           HN       LEU  88  -7.534 -19.325 -22.604
  664    HA   LEU  88           HA       LEU  88  -9.027 -17.740 -20.735
  665   1HB   LEU  88           HB2      LEU  88  -9.015 -20.760 -21.163
  666   2HB   LEU  88           HB1      LEU  88 -10.247 -19.884 -20.270
  667    HG   LEU  88           HG       LEU  88  -9.577 -19.298 -23.173
  668   1HD1  LEU  88          HD12      LEU  88 -10.484 -21.647 -22.724
  669   2HD1  LEU  88          HD13      LEU  88 -11.945 -20.873 -22.117
  670   3HD1  LEU  88          HD11      LEU  88 -11.464 -20.653 -23.797
  671   1HD2  LEU  88          HD23      LEU  88 -11.044 -17.881 -21.235
  672   2HD2  LEU  88          HD21      LEU  88 -11.088 -17.621 -22.973
  673   3HD2  LEU  88          HD22      LEU  88 -12.261 -18.691 -22.212
  674    H    GLY  89           HN       GLY  89  -8.984 -17.617 -18.589
  675   1HA   GLY  89           HA1      GLY  89  -8.186 -19.297 -16.605
  676   2HA   GLY  89           HA2      GLY  89  -6.639 -18.684 -17.184
  677    H    ILE  90           HN       ILE  90  -6.037 -17.361 -15.556
  678    HA   ILE  90           HA       ILE  90  -7.934 -15.176 -14.796
  679    HB   ILE  90           HB       ILE  90  -5.675 -16.441 -13.168
  680   1HG1  ILE  90          HG11      ILE  90  -7.533 -17.995 -13.344
  681   2HG1  ILE  90          HG12      ILE  90  -7.541 -17.294 -11.733
  682   1HG2  ILE  90          HG23      ILE  90  -7.609 -14.152 -12.713
  683   2HG2  ILE  90          HG21      ILE  90  -7.050 -15.089 -11.331
  684   3HG2  ILE  90          HG22      ILE  90  -5.891 -14.233 -12.342
  685   1HD1  ILE  90          HD12      ILE  90  -9.148 -15.506 -12.912
  686   2HD1  ILE  90          HD13      ILE  90  -9.448 -16.857 -13.999
  687   3HD1  ILE  90          HD11      ILE  90  -9.779 -17.022 -12.279
  688    OH   TYR  91           OH       TYR  91  -3.212 -12.665 -22.163
  689    H    TYR  91           HN       TYR  91  -7.282 -13.436 -15.954
  690    HA   TYR  91           HA       TYR  91  -4.457 -13.019 -16.572
  691   1HB   TYR  91           HB2      TYR  91  -7.028 -11.920 -17.413
  692   2HB   TYR  91           HB1      TYR  91  -5.907 -10.610 -17.044
  693    HD1  TYR  91           HD2      TYR  91  -3.513 -10.815 -18.050
  694    HD2  TYR  91           HD1      TYR  91  -6.825 -13.075 -19.471
  695    HE1  TYR  91           HE2      TYR  91  -2.320 -11.247 -20.145
  696    HE2  TYR  91           HE1      TYR  91  -5.626 -13.506 -21.570
  697    HH   TYR  91           HH       TYR  91  -3.634 -13.418 -22.591
  698    H    PHE  92           HN       PHE  92  -3.027 -11.884 -15.457
  699    HA   PHE  92           HA       PHE  92  -4.020 -10.262 -13.145
  700   1HB   PHE  92           HB2      PHE  92  -1.899 -12.332 -13.436
  701   2HB   PHE  92           HB1      PHE  92  -1.366 -10.895 -12.573
  702    HD1  PHE  92           HD1      PHE  92  -4.851 -12.204 -12.557
  703    HD2  PHE  92           HD2      PHE  92  -1.214 -11.846 -10.371
  704    HE1  PHE  92           HE1      PHE  92  -5.991 -12.975 -10.526
  705    HE2  PHE  92           HE2      PHE  92  -2.359 -12.623  -8.345
  706    HZ   PHE  92           HZ       PHE  92  -4.747 -13.190  -8.420
  707    H    CYS  93           HN       CYS  93  -2.447  -8.554 -12.447
  708    HA   CYS  93           HA       CYS  93  -0.888  -7.424 -14.729
  709   1HB   CYS  93           HB2      CYS  93  -1.877  -5.276 -14.447
  710   2HB   CYS  93           HB1      CYS  93  -3.217  -6.392 -14.448
  711    H    SER  94           HN       SER  94   0.821  -6.024 -14.124
  712    HA   SER  94           HA       SER  94   1.382  -5.607 -11.265
  713   1HB   SER  94           HB2      SER  94   2.221  -7.939 -11.688
  714   2HB   SER  94           HB1      SER  94   3.229  -7.324 -13.011
  715    HG   SER  94           HG       SER  94   4.510  -7.221 -11.225
  716    H    GLN  95           HN       GLN  95   3.194  -4.203 -10.894
  717    HA   GLN  95           HA       GLN  95   3.908  -2.629 -13.340
  718   1HB   GLN  95           HB2      GLN  95   4.215  -0.714 -11.751
  719   2HB   GLN  95           HB1      GLN  95   2.581  -1.360 -11.668
  720   1HG   GLN  95           HG1      GLN  95   2.862  -2.147  -9.533
  721   2HG   GLN  95           HG2      GLN  95   4.525  -2.642  -9.825
  722   1HE2  GLN  95          HE22      GLN  95   4.095   0.556  -7.658
  723   2HE2  GLN  95          HE21      GLN  95   3.086  -0.807  -7.719
  724    H    THR  96           HN       THR  96   6.028  -1.560 -13.268
  725    HA   THR  96           HA       THR  96   8.033  -2.883 -11.526
  726    HB   THR  96           HB       THR  96   8.340  -2.787 -14.587
  727    HG1  THR  96           HG1      THR  96   7.234  -4.610 -12.745
  728   1HG2  THR  96          HG23      THR  96   9.811  -4.099 -12.247
  729   2HG2  THR  96          HG21      THR  96   9.915  -4.781 -13.867
  730   3HG2  THR  96          HG22      THR  96  10.514  -3.154 -13.556
  731    H    THR  97           HN       THR  97   7.160  -0.321 -11.311
  732    HA   THR  97           HA       THR  97   9.488   1.248 -12.356
  733    HB   THR  97           HB       THR  97   7.724   3.235 -12.087
  734    HG1  THR  97           HG1      THR  97   5.609   2.316 -12.346
  735   1HG2  THR  97          HG22      THR  97   7.995   1.147 -14.209
  736   2HG2  THR  97          HG23      THR  97   6.457   1.998 -14.242
  737   3HG2  THR  97          HG21      THR  97   7.965   2.897 -14.392
  738    H    HIS  98           HN       HIS  98   7.082   0.992  -9.766
  739    HA   HIS  98           HA       HIS  98   8.863   2.601  -8.008
  740   1HB   HIS  98           HB2      HIS  98   6.027   1.560  -7.542
  741   2HB   HIS  98           HB1      HIS  98   6.885   2.704  -6.512
  742    HD2  HIS  98           HD2      HIS  98   5.226   2.563 -10.071
  743    HE1  HIS  98           HE1      HIS  98   6.033   6.514  -9.165
  744    H    VAL  99           HN       VAL  99   9.752   1.810  -6.166
  745    HA   VAL  99           HA       VAL  99   9.582  -1.147  -5.816
  746    HB   VAL  99           HB       VAL  99  11.833  -0.139  -6.382
  747   1HG1  VAL  99          HG13      VAL  99  11.302   2.005  -5.060
  748   2HG1  VAL  99          HG11      VAL  99  11.739   1.094  -3.618
  749   3HG1  VAL  99          HG12      VAL  99  12.931   1.362  -4.886
  750   1HG2  VAL  99          HG21      VAL  99  11.529  -1.381  -3.628
  751   2HG2  VAL  99          HG22      VAL  99  11.834  -2.226  -5.142
  752   3HG2  VAL  99          HG23      VAL  99  13.073  -1.188  -4.449
  753    HA   PRO 100           HA       PRO 100   9.917  -2.653  -4.484
  754   1HB   PRO 100           HB2      PRO 100   7.849  -4.107  -3.162
  755   2HB   PRO 100           HB1      PRO 100   9.544  -4.036  -2.679
  756   1HG   PRO 100           HG1      PRO 100   7.244  -2.811  -1.376
  757   2HG   PRO 100           HG2      PRO 100   8.916  -2.868  -0.815
  758   1HD   PRO 100           HD1      PRO 100   7.499  -0.613  -1.948
  759   2HD   PRO 100           HD2      PRO 100   9.170  -0.664  -1.357
  760    HA   PRO 101           HA       PRO 101   6.864  -2.590  -7.654
  761   1HB   PRO 101           HB2      PRO 101   7.339  -5.347  -8.404
  762   2HB   PRO 101           HB1      PRO 101   7.983  -3.904  -9.186
  763   1HG   PRO 101           HG1      PRO 101   9.398  -5.809  -7.524
  764   2HG   PRO 101           HG2      PRO 101  10.056  -4.397  -8.353
  765   1HD   PRO 101           HD1      PRO 101   9.590  -4.718  -5.526
  766   2HD   PRO 101           HD2      PRO 101  10.219  -3.288  -6.365
  767    H    THR 102           HN       THR 102   4.713  -2.855  -7.398
  768    HA   THR 102           HA       THR 102   3.772  -4.951  -5.534
  769    HB   THR 102           HB       THR 102   1.546  -3.688  -5.781
  770    HG1  THR 102           HG1      THR 102   1.588  -2.686  -7.653
  771   1HG2  THR 102          HG23      THR 102   3.515  -2.919  -4.179
  772   2HG2  THR 102          HG21      THR 102   3.825  -1.693  -5.405
  773   3HG2  THR 102          HG22      THR 102   2.278  -1.729  -4.567
  774    H    PHE 103           HN       PHE 103   3.514  -6.868  -6.433
  775    HA   PHE 103           HA       PHE 103   2.457  -7.085  -9.195
  776   1HB   PHE 103           HB2      PHE 103   4.250  -8.604  -8.914
  777   2HB   PHE 103           HB1      PHE 103   3.844  -8.925  -7.233
  778    HD1  PHE 103           HD1      PHE 103   2.082 -10.538  -6.656
  779    HD2  PHE 103           HD2      PHE 103   3.069  -9.775 -10.729
  780    HE1  PHE 103           HE1      PHE 103   0.835 -12.541  -7.336
  781    HE2  PHE 103           HE2      PHE 103   1.820 -11.778 -11.405
  782    HZ   PHE 103           HZ       PHE 103   0.706 -13.166  -9.708
  783    H    GLY 104           HN       GLY 104   0.474  -7.929  -9.678
  784   1HA   GLY 104           HA1      GLY 104  -1.137  -9.370  -7.742
  785   2HA   GLY 104           HA2      GLY 104  -1.676  -7.702  -7.910
  786    H    GLY 105           HN       GLY 105  -3.588  -8.035  -8.950
  787   1HA   GLY 105           HA1      GLY 105  -4.208  -7.957 -11.470
  788   2HA   GLY 105           HA2      GLY 105  -3.521  -9.574 -11.501
  789    H    GLY 106           HN       GLY 106  -6.070  -9.508 -12.316
  790   1HA   GLY 106           HA1      GLY 106  -7.434 -11.310 -10.731
  791   2HA   GLY 106           HA2      GLY 106  -7.909  -9.758 -10.062
  792    H    THR 107           HN       THR 107  -7.896 -11.678 -13.021
  793    HA   THR 107           HA       THR 107 -10.557 -10.583 -13.692
  794    HB   THR 107           HB       THR 107  -8.189 -10.430 -15.663
  795    HG1  THR 107           HG1      THR 107  -9.694  -8.590 -14.098
  796   1HG2  THR 107          HG21      THR 107 -11.142 -10.269 -15.932
  797   2HG2  THR 107          HG22      THR 107 -10.360  -8.773 -16.435
  798   3HG2  THR 107          HG23      THR 107  -9.932 -10.295 -17.210
  799    H    LYS 108           HN       LYS 108 -11.633 -12.440 -13.766
  800    HA   LYS 108           HA       LYS 108 -10.393 -14.915 -14.646
  801   1HB   LYS 108           HB2      LYS 108 -12.190 -14.824 -12.903
  802   2HB   LYS 108           HB1      LYS 108 -13.332 -14.280 -14.126
  803   1HG   LYS 108           HG1      LYS 108 -13.231 -16.346 -15.303
  804   2HG   LYS 108           HG2      LYS 108 -11.754 -16.837 -14.484
  805   1HD   LYS 108           HD1      LYS 108 -13.574 -16.408 -12.397
  806   2HD   LYS 108           HD2      LYS 108 -14.539 -17.180 -13.649
  807   1HE   LYS 108           HE1      LYS 108 -11.846 -18.358 -13.177
  808   2HE   LYS 108           HE2      LYS 108 -13.015 -18.570 -11.881
  809   1HZ   LYS 108           HZ1      LYS 108 -14.513 -19.638 -13.337
  810   2HZ   LYS 108           HZ2      LYS 108 -13.611 -19.217 -14.714
  811    H    LEU 109           HN       LEU 109  -9.778 -14.724 -16.760
  812    HA   LEU 109           HA       LEU 109 -11.803 -14.021 -18.801
  813   1HB   LEU 109           HB2      LEU 109  -9.220 -13.420 -18.802
  814   2HB   LEU 109           HB1      LEU 109  -8.997 -15.078 -19.345
  815    HG   LEU 109           HG       LEU 109 -11.048 -13.399 -20.754
  816   1HD1  LEU 109          HD12      LEU 109  -8.854 -12.066 -20.468
  817   2HD1  LEU 109          HD13      LEU 109  -8.113 -13.293 -21.492
  818   3HD1  LEU 109          HD11      LEU 109  -9.426 -12.300 -22.116
  819   1HD2  LEU 109          HD21      LEU 109  -9.120 -15.624 -21.470
  820   2HD2  LEU 109          HD22      LEU 109 -10.880 -15.675 -21.477
  821   3HD2  LEU 109          HD23      LEU 109 -10.022 -14.735 -22.692
  822    H    GLU 110           HN       GLU 110 -13.203 -15.808 -18.370
  823    HA   GLU 110           HA       GLU 110 -12.139 -18.401 -19.432
  824   1HB   GLU 110           HB2      GLU 110 -12.637 -18.305 -16.923
  825   2HB   GLU 110           HB1      GLU 110 -14.325 -18.043 -17.336
  826   1HG   GLU 110           HG1      GLU 110 -13.641 -20.255 -18.883
  827   2HG   GLU 110           HG2      GLU 110 -12.761 -20.529 -17.382
  828    H    ILE 111           HN       ILE 111 -13.154 -16.821 -21.313
  829    HA   ILE 111           HA       ILE 111 -14.821 -16.631 -22.933
  830    HB   ILE 111           HB       ILE 111 -14.436 -19.334 -22.261
  831   1HG1  ILE 111          HG11      ILE 111 -15.745 -19.654 -24.494
  832   2HG1  ILE 111          HG12      ILE 111 -15.821 -17.898 -24.509
  833   1HG2  ILE 111          HG22      ILE 111 -16.769 -19.033 -21.103
  834   2HG2  ILE 111          HG23      ILE 111 -17.411 -18.915 -22.736
  835   3HG2  ILE 111          HG21      ILE 111 -16.590 -20.382 -22.217
  836   1HD1  ILE 111          HD12      ILE 111 -13.301 -17.889 -24.162
  837   2HD1  ILE 111          HD13      ILE 111 -13.333 -19.627 -24.448
  838   3HD1  ILE 111          HD11      ILE 111 -13.833 -18.515 -25.718
  839    H    LYS 112           HN       LYS 112 -17.310 -16.916 -23.265
  840    HA   LYS 112           HA       LYS 112 -18.557 -15.266 -21.248
  841   1HB   LYS 112           HB2      LYS 112 -19.567 -16.728 -23.718
  842   2HB   LYS 112           HB1      LYS 112 -20.657 -15.807 -22.686
  843   1HG   LYS 112           HG1      LYS 112 -19.758 -13.777 -23.313
  844   2HG   LYS 112           HG2      LYS 112 -18.140 -14.437 -23.514
  845   1HD   LYS 112           HD1      LYS 112 -18.883 -13.934 -25.724
  846   2HD   LYS 112           HD2      LYS 112 -19.059 -15.677 -25.568
  847   1HE   LYS 112           HE1      LYS 112 -21.411 -15.529 -25.281
  848   2HE   LYS 112           HE2      LYS 112 -21.342 -13.811 -24.905
  849   1HZ   LYS 112           HZ1      LYS 112 -22.139 -14.070 -27.114
  850   2HZ   LYS 112           HZ2      LYS 112 -20.564 -13.440 -27.210
  851    NH1  ARG 113           NH1      ARG 113 -20.123 -20.699 -19.913
  852    NH2  ARG 113           NH2      ARG 113 -17.876 -20.708 -19.590
  853    H    ARG 113           HN       ARG 113 -19.497 -15.880 -19.439
  854    HA   ARG 113           HA       ARG 113 -20.630 -18.636 -19.269
  855   1HB   ARG 113           HB2      ARG 113 -18.382 -18.329 -18.069
  856   2HB   ARG 113           HB1      ARG 113 -19.184 -17.170 -17.017
  857   1HG   ARG 113           HG1      ARG 113 -19.972 -18.861 -15.744
  858   2HG   ARG 113           HG2      ARG 113 -20.825 -19.517 -17.134
  859   1HD   ARG 113           HD1      ARG 113 -17.874 -20.010 -16.968
  860   2HD   ARG 113           HD2      ARG 113 -18.919 -20.921 -15.879
  861    HE   ARG 113           HE       ARG 113 -19.645 -22.163 -17.747
  862   1HH1  ARG 113          HH11      ARG 113 -21.039 -20.852 -19.547
  863   2HH1  ARG 113          HH12      ARG 113 -20.005 -20.386 -20.854
  864   1HH2  ARG 113          HH21      ARG 113 -17.101 -20.865 -18.980
  865   2HH2  ARG 113          HH22      ARG 113 -17.721 -20.409 -20.529
   
  Start of MODEL           7
 Raw file had  865 H/Q atoms
  Start of MODEL    7
    1   1H    ASP   1           HT3      ASP   1   1.331  -1.100   0.409
    2   2H    ASP   1           HT1      ASP   1   2.232   0.316   0.676
    3   3H    ASP   1           HT2      ASP   1   0.567   0.417   0.352
    4    HA   ASP   1           HA       ASP   1   0.885   0.437  -1.818
    5   1HB   ASP   1           HB2      ASP   1   3.271   1.347  -0.644
    6   2HB   ASP   1           HB1      ASP   1   3.821   0.167  -1.831
    7    H    VAL   2           HN       VAL   2   2.264  -0.597  -3.691
    8    HA   VAL   2           HA       VAL   2   1.450  -3.264  -3.799
    9    HB   VAL   2           HB       VAL   2   3.650  -1.784  -5.305
   10   1HG1  VAL   2          HG13      VAL   2   2.452  -4.524  -5.848
   11   2HG1  VAL   2          HG11      VAL   2   3.437  -3.631  -7.001
   12   3HG1  VAL   2          HG12      VAL   2   4.138  -4.175  -5.480
   13   1HG2  VAL   2          HG22      VAL   2   0.716  -2.288  -5.681
   14   2HG2  VAL   2          HG23      VAL   2   1.635  -0.810  -5.944
   15   3HG2  VAL   2          HG21      VAL   2   1.732  -2.125  -7.108
   16    H    VAL   3           HN       VAL   3   2.070  -4.844  -2.487
   17    HA   VAL   3           HA       VAL   3   4.581  -4.881  -1.077
   18    HB   VAL   3           HB       VAL   3   2.705  -7.231  -1.611
   19   1HG1  VAL   3          HG12      VAL   3   4.795  -6.590   0.479
   20   2HG1  VAL   3          HG13      VAL   3   3.525  -7.769   0.790
   21   3HG1  VAL   3          HG11      VAL   3   4.663  -8.029  -0.528
   22   1HG2  VAL   3          HG23      VAL   3   2.540  -4.980   0.419
   23   2HG2  VAL   3          HG21      VAL   3   1.326  -5.433  -0.775
   24   3HG2  VAL   3          HG22      VAL   3   1.655  -6.494   0.592
   25    H    MET   4           HN       MET   4   6.187  -6.585  -1.201
   26    HA   MET   4           HA       MET   4   6.517  -7.808  -3.899
   27   1HB   MET   4           HB2      MET   4   8.528  -6.065  -2.400
   28   2HB   MET   4           HB1      MET   4   8.973  -7.077  -3.767
   29   1HG   MET   4           HG1      MET   4   6.767  -5.022  -3.899
   30   2HG   MET   4           HG2      MET   4   8.425  -4.629  -4.260
   31   1HE   MET   4           HE2      MET   4   9.796  -5.498  -6.009
   32   2HE   MET   4           HE3      MET   4   9.427  -7.223  -5.970
   33   3HE   MET   4           HE1      MET   4   9.270  -6.322  -7.478
   34    H    THR   5           HN       THR   5   6.363  -9.912  -3.232
   35    HA   THR   5           HA       THR   5   7.881 -10.768  -0.834
   36    HB   THR   5           HB       THR   5   5.810 -12.118  -2.642
   37    HG1  THR   5           HG1      THR   5   6.074 -11.661   0.156
   38   1HG2  THR   5          HG22      THR   5   7.556 -13.298  -0.407
   39   2HG2  THR   5          HG23      THR   5   6.036 -14.028  -0.914
   40   3HG2  THR   5          HG21      THR   5   7.387 -13.936  -2.039
   41    H    GLN   6           HN       GLN   6   9.987 -10.949  -1.278
   42    HA   GLN   6           HA       GLN   6  10.778 -12.431  -3.722
   43   1HB   GLN   6           HB2      GLN   6  13.084 -11.426  -3.164
   44   2HB   GLN   6           HB1      GLN   6  11.843 -10.286  -3.677
   45   1HG   GLN   6           HG1      GLN   6  11.765 -10.871  -0.825
   46   2HG   GLN   6           HG2      GLN   6  13.281 -10.134  -1.322
   47   1HE2  GLN   6          HE22      GLN   6  10.714  -7.459  -0.584
   48   2HE2  GLN   6          HE21      GLN   6  11.331  -8.760   0.314
   49    H    THR   7           HN       THR   7  12.748 -13.753  -3.543
   50    HA   THR   7           HA       THR   7  13.418 -14.886  -0.933
   51    HB   THR   7           HB       THR   7  12.634 -17.229  -2.364
   52    HG1  THR   7           HG1      THR   7  10.671 -15.174  -2.477
   53   1HG2  THR   7          HG21      THR   7  12.157 -16.300   0.156
   54   2HG2  THR   7          HG22      THR   7  10.619 -15.847  -0.573
   55   3HG2  THR   7          HG23      THR   7  11.122 -17.535  -0.555
   56    HA   PRO   8           HA       PRO   8  13.897 -17.201  -0.668
   57   1HB   PRO   8           HB2      PRO   8  16.320 -18.406   0.103
   58   2HB   PRO   8           HB1      PRO   8  15.113 -19.160  -0.938
   59   1HG   PRO   8           HG1      PRO   8  17.762 -18.115  -1.656
   60   2HG   PRO   8           HG2      PRO   8  16.683 -19.133  -2.611
   61   1HD   PRO   8           HD1      PRO   8  17.157 -16.297  -2.907
   62   2HD   PRO   8           HD2      PRO   8  16.066 -17.318  -3.861
   63    H    LEU   9           HN       LEU   9  14.705 -17.228   1.696
   64    HA   LEU   9           HA       LEU   9  15.536 -14.528   2.380
   65   1HB   LEU   9           HB2      LEU   9  15.321 -17.005   4.164
   66   2HB   LEU   9           HB1      LEU   9  15.349 -15.335   4.718
   67    HG   LEU   9           HG       LEU   9  13.193 -16.662   3.039
   68   1HD1  LEU   9          HD13      LEU   9  13.237 -17.019   5.555
   69   2HD1  LEU   9          HD11      LEU   9  13.026 -15.280   5.736
   70   3HD1  LEU   9          HD12      LEU   9  11.778 -16.242   4.951
   71   1HD2  LEU   9          HD22      LEU   9  13.723 -13.761   3.716
   72   2HD2  LEU   9          HD23      LEU   9  13.339 -14.464   2.146
   73   3HD2  LEU   9          HD21      LEU   9  12.092 -14.333   3.383
   74    H    SER  10           HN       SER  10  17.129 -17.426   1.688
   75    HA   SER  10           HA       SER  10  19.747 -16.205   2.210
   76   1HB   SER  10           HB2      SER  10  20.538 -17.971   3.709
   77   2HB   SER  10           HB1      SER  10  18.967 -17.478   4.364
   78    HG   SER  10           HG       SER  10  18.306 -19.166   2.578
   79    H    LEU  11           HN       LEU  11  21.224 -16.901   0.726
   80    HA   LEU  11           HA       LEU  11  20.403 -19.237  -0.959
   81   1HB   LEU  11           HB2      LEU  11  20.260 -16.852  -1.979
   82   2HB   LEU  11           HB1      LEU  11  22.016 -16.859  -1.948
   83    HG   LEU  11           HG       LEU  11  21.496 -19.313  -3.074
   84   1HD1  LEU  11          HD12      LEU  11  19.386 -17.354  -4.048
   85   2HD1  LEU  11          HD13      LEU  11  19.781 -18.878  -4.841
   86   3HD1  LEU  11          HD11      LEU  11  19.087 -18.882  -3.221
   87   1HD2  LEU  11          HD23      LEU  11  23.057 -17.447  -3.817
   88   2HD2  LEU  11          HD21      LEU  11  22.271 -18.322  -5.127
   89   3HD2  LEU  11          HD22      LEU  11  21.681 -16.732  -4.653
   90    HA   PRO  12           HA       PRO  12  24.527 -20.242   0.718
   91   1HB   PRO  12           HB2      PRO  12  23.787 -23.025   0.595
   92   2HB   PRO  12           HB1      PRO  12  23.926 -22.033   2.045
   93   1HG   PRO  12           HG1      PRO  12  21.513 -23.026   0.786
   94   2HG   PRO  12           HG2      PRO  12  21.654 -22.092   2.275
   95   1HD   PRO  12           HD1      PRO  12  20.717 -21.185  -0.306
   96   2HD   PRO  12           HD2      PRO  12  20.839 -20.252   1.197
   97    H    VAL  13           HN       VAL  13  26.014 -20.196  -0.887
   98    HA   VAL  13           HA       VAL  13  25.815 -22.223  -3.055
   99    HB   VAL  13           HB       VAL  13  26.386 -20.449  -4.749
  100   1HG1  VAL  13          HG11      VAL  13  23.987 -21.123  -4.159
  101   2HG1  VAL  13          HG12      VAL  13  23.910 -19.652  -3.195
  102   3HG1  VAL  13          HG13      VAL  13  24.171 -19.553  -4.934
  103   1HG2  VAL  13          HG23      VAL  13  26.002 -18.616  -2.357
  104   2HG2  VAL  13          HG21      VAL  13  27.476 -18.823  -3.299
  105   3HG2  VAL  13          HG22      VAL  13  26.066 -18.057  -4.025
  106    H    SER  14           HN       SER  14  27.907 -21.664  -4.582
  107    HA   SER  14           HA       SER  14  30.218 -21.724  -2.678
  108   1HB   SER  14           HB2      SER  14  29.643 -23.198  -5.282
  109   2HB   SER  14           HB1      SER  14  31.299 -23.060  -4.660
  110    HG   SER  14           HG       SER  14  29.693 -23.610  -2.624
  111    H    LEU  15           HN       LEU  15  32.075 -20.592  -3.190
  112    HA   LEU  15           HA       LEU  15  31.721 -18.234  -4.810
  113   1HB   LEU  15           HB2      LEU  15  34.246 -19.445  -3.588
  114   2HB   LEU  15           HB1      LEU  15  34.130 -17.821  -4.252
  115    HG   LEU  15           HG       LEU  15  32.645 -18.922  -1.845
  116   1HD1  LEU  15          HD11      LEU  15  34.646 -16.669  -2.235
  117   2HD1  LEU  15          HD12      LEU  15  33.822 -17.020  -0.720
  118   3HD1  LEU  15          HD13      LEU  15  34.944 -18.192  -1.403
  119   1HD2  LEU  15          HD21      LEU  15  32.214 -16.435  -3.500
  120   2HD2  LEU  15          HD22      LEU  15  31.012 -17.547  -2.852
  121   3HD2  LEU  15          HD23      LEU  15  31.845 -16.427  -1.780
  122    H    GLY  16           HN       GLY  16  31.273 -18.958  -6.853
  123   1HA   GLY  16           HA1      GLY  16  32.846 -18.867  -8.945
  124   2HA   GLY  16           HA2      GLY  16  33.441 -20.401  -8.314
  125    H    ASP  17           HN       ASP  17  30.301 -20.310  -7.472
  126    HA   ASP  17           HA       ASP  17  29.529 -22.005  -9.776
  127   1HB   ASP  17           HB2      ASP  17  29.253 -22.483  -7.155
  128   2HB   ASP  17           HB1      ASP  17  27.784 -21.533  -7.348
  129    H    GLN  18           HN       GLN  18  26.652 -21.321  -8.758
  130    HA   GLN  18           HA       GLN  18  26.362 -18.681 -10.105
  131   1HB   GLN  18           HB2      GLN  18  25.634 -21.280 -11.197
  132   2HB   GLN  18           HB1      GLN  18  24.174 -20.328 -10.951
  133   1HG   GLN  18           HG1      GLN  18  24.738 -18.812 -12.575
  134   2HG   GLN  18           HG2      GLN  18  26.442 -18.827 -12.134
  135   1HE2  GLN  18          HE22      GLN  18  26.959 -20.568 -15.161
  136   2HE2  GLN  18          HE21      GLN  18  27.207 -19.126 -14.301
  137    H    ALA  19           HN       ALA  19  24.078 -17.842  -9.874
  138    HA   ALA  19           HA       ALA  19  22.603 -18.943  -7.559
  139   1HB   ALA  19           HB1      ALA  19  24.189 -16.383  -7.560
  140   2HB   ALA  19           HB2      ALA  19  22.647 -16.378  -6.714
  141   3HB   ALA  19           HB3      ALA  19  23.909 -17.511  -6.240
  142    H    SER  20           HN       SER  20  20.593 -17.620  -7.122
  143    HA   SER  20           HA       SER  20  19.621 -15.928  -9.301
  144   1HB   SER  20           HB2      SER  20  17.677 -17.565  -9.785
  145   2HB   SER  20           HB1      SER  20  19.262 -18.120 -10.357
  146    HG   SER  20           HG       SER  20  17.960 -18.769  -7.918
  147    H    ILE  21           HN       ILE  21  19.174 -14.451  -7.674
  148    HA   ILE  21           HA       ILE  21  17.491 -15.201  -5.400
  149    HB   ILE  21           HB       ILE  21  18.176 -12.425  -6.451
  150   1HG1  ILE  21          HG11      ILE  21  19.738 -13.212  -4.159
  151   2HG1  ILE  21          HG12      ILE  21  19.937 -14.419  -5.422
  152   1HG2  ILE  21          HG22      ILE  21  17.039 -13.569  -3.894
  153   2HG2  ILE  21          HG23      ILE  21  17.997 -12.093  -3.806
  154   3HG2  ILE  21          HG21      ILE  21  16.530 -12.135  -4.779
  155   1HD1  ILE  21          HD12      ILE  21  20.178 -11.439  -5.930
  156   2HD1  ILE  21          HD13      ILE  21  21.558 -12.461  -5.541
  157   3HD1  ILE  21          HD11      ILE  21  20.638 -12.748  -7.015
  158    H    SER  22           HN       SER  22  15.399 -15.271  -5.386
  159    HA   SER  22           HA       SER  22  13.835 -14.458  -7.737
  160   1HB   SER  22           HB2      SER  22  13.404 -16.638  -6.546
  161   2HB   SER  22           HB1      SER  22  12.912 -15.729  -5.101
  162    HG   SER  22           HG       SER  22  11.065 -15.983  -6.255
  163    H    CYS  23           HN       CYS  23  11.920 -13.195  -7.609
  164    HA   CYS  23           HA       CYS  23  11.377 -11.524  -5.273
  165   1HB   CYS  23           HB2      CYS  23  12.899 -10.531  -7.669
  166   2HB   CYS  23           HB1      CYS  23  11.733  -9.452  -6.951
  167    NH1  ARG  24           NH2      ARG  24   5.400 -14.850  -9.675
  168    NH2  ARG  24           NH1      ARG  24   6.972 -16.424  -9.216
  169    H    ARG  24           HN       ARG  24   9.203 -11.841  -5.347
  170    HA   ARG  24           HA       ARG  24   7.832 -11.488  -7.983
  171   1HB   ARG  24           HB2      ARG  24   7.546 -13.635  -6.575
  172   2HB   ARG  24           HB1      ARG  24   6.664 -12.647  -5.417
  173   1HG   ARG  24           HG1      ARG  24   4.976 -12.094  -7.044
  174   2HG   ARG  24           HG2      ARG  24   5.933 -12.769  -8.357
  175   1HD   ARG  24           HD1      ARG  24   4.850 -14.379  -6.018
  176   2HD   ARG  24           HD2      ARG  24   4.103 -14.315  -7.612
  177    HE   ARG  24           HE       ARG  24   6.479 -15.838  -6.902
  178   1HH1  ARG  24          HH21      ARG  24   4.751 -14.166  -9.347
  179   2HH1  ARG  24          HH22      ARG  24   5.501 -15.012 -10.655
  180   1HH2  ARG  24          HH11      ARG  24   7.506 -16.931  -8.543
  181   2HH2  ARG  24          HH12      ARG  24   7.104 -16.597 -10.194
  182    H    SER  25           HN       SER  25   6.140 -10.066  -8.211
  183    HA   SER  25           HA       SER  25   5.948  -7.984  -6.095
  184   1HB   SER  25           HB2      SER  25   4.593  -7.700  -8.783
  185   2HB   SER  25           HB1      SER  25   5.469  -6.480  -7.841
  186    HG   SER  25           HG       SER  25   7.372  -7.850  -8.232
  187    H    SER  26           HN       SER  26   3.908  -7.155  -5.448
  188    HA   SER  26           HA       SER  26   1.947  -9.162  -4.890
  189   1HB   SER  26           HB2      SER  26   2.332  -7.022  -3.551
  190   2HB   SER  26           HB1      SER  26   1.537  -6.126  -4.856
  191    HG   SER  26           HG       SER  26   0.470  -8.304  -3.374
  192    H    GLN  27           HN       GLN  27   1.287  -6.162  -6.687
  193    HA   GLN  27           HA       GLN  27  -0.523  -7.761  -8.447
  194   1HB   GLN  27           HB2      GLN  27  -1.235  -5.683  -6.828
  195   2HB   GLN  27           HB1      GLN  27  -0.781  -4.773  -8.265
  196   1HG   GLN  27           HG1      GLN  27  -2.306  -6.183  -9.628
  197   2HG   GLN  27           HG2      GLN  27  -2.768  -7.073  -8.181
  198   1HE2  GLN  27          HE22      GLN  27  -4.398  -4.068  -6.782
  199   2HE2  GLN  27          HE21      GLN  27  -3.226  -5.189  -6.281
  200    H    SER  28           HN       SER  28   2.073  -7.790  -9.118
  201    HA   SER  28           HA       SER  28   3.451  -7.481 -10.977
  202   1HB   SER  28           HB2      SER  28   1.139  -7.507 -12.185
  203   2HB   SER  28           HB1      SER  28   1.270  -5.737 -12.202
  204    HG   SER  28           HG       SER  28   2.767  -7.649 -13.535
  205    H    LEU  29           HN       LEU  29   4.356  -5.620 -12.411
  206    HA   LEU  29           HA       LEU  29   4.542  -3.173 -10.705
  207   1HB   LEU  29           HB2      LEU  29   6.782  -4.446 -12.333
  208   2HB   LEU  29           HB1      LEU  29   6.936  -3.056 -11.269
  209    HG   LEU  29           HG       LEU  29   6.040  -5.799 -10.335
  210   1HD1  LEU  29          HD12      LEU  29   8.459  -5.572 -11.212
  211   2HD1  LEU  29          HD13      LEU  29   8.730  -4.500  -9.847
  212   3HD1  LEU  29          HD11      LEU  29   8.269  -6.176  -9.570
  213   1HD2  LEU  29          HD22      LEU  29   6.441  -3.121  -9.072
  214   2HD2  LEU  29          HD23      LEU  29   5.279  -4.381  -8.674
  215   3HD2  LEU  29          HD21      LEU  29   6.950  -4.525  -8.142
  216    H    VAL  30           HN       VAL  30   2.705  -3.115 -12.624
  217    HA   VAL  30           HA       VAL  30   4.006  -1.779 -14.951
  218    HB   VAL  30           HB       VAL  30   1.122  -2.715 -14.609
  219   1HG1  VAL  30          HG12      VAL  30   2.701  -1.398 -16.787
  220   2HG1  VAL  30          HG13      VAL  30   1.553  -2.643 -17.278
  221   3HG1  VAL  30          HG11      VAL  30   0.994  -1.233 -16.386
  222   1HG2  VAL  30          HG22      VAL  30   3.487  -4.272 -14.998
  223   2HG2  VAL  30          HG23      VAL  30   1.815  -4.819 -15.063
  224   3HG2  VAL  30          HG21      VAL  30   2.616  -4.259 -16.527
  225    H    HIS  31           HN       HIS  31   3.792   0.340 -15.226
  226    HA   HIS  31           HA       HIS  31   2.361   1.897 -13.195
  227   1HB   HIS  31           HB2      HIS  31   4.664   2.418 -14.374
  228   2HB   HIS  31           HB1      HIS  31   3.673   3.024 -15.696
  229    HD2  HIS  31           HD2      HIS  31   5.013   4.149 -12.301
  230    HE1  HIS  31           HE1      HIS  31   2.072   6.863 -13.343
  231    H    SER  32           HN       SER  32   1.059   3.837 -14.040
  232    HA   SER  32           HA       SER  32  -1.147   2.760 -15.622
  233   1HB   SER  32           HB2      SER  32  -0.622   5.574 -14.519
  234   2HB   SER  32           HB1      SER  32  -2.171   5.013 -15.176
  235    HG   SER  32           HG       SER  32  -0.799   3.535 -13.203
  236    H    ASN  33           HN       ASN  33   1.307   2.896 -17.045
  237    HA   ASN  33           HA       ASN  33   0.479   3.926 -19.539
  238   1HB   ASN  33           HB2      ASN  33   2.213   5.905 -19.563
  239   2HB   ASN  33           HB1      ASN  33   0.685   6.186 -18.734
  240   1HD2  ASN  33          HD22      ASN  33   2.250   6.749 -15.644
  241   2HD2  ASN  33          HD21      ASN  33   0.868   6.912 -16.616
  242    H    GLY  34           HN       GLY  34   3.073   3.148 -17.362
  243   1HA   GLY  34           HA1      GLY  34   5.070   2.715 -19.436
  244   2HA   GLY  34           HA2      GLY  34   5.222   2.268 -17.743
  245    H    ASN  35           HN       ASN  35   5.721   0.199 -17.694
  246    HA   ASN  35           HA       ASN  35   3.818  -1.769 -18.728
  247   1HB   ASN  35           HB2      ASN  35   6.419  -1.142 -20.051
  248   2HB   ASN  35           HB1      ASN  35   6.115  -2.860 -19.796
  249   1HD2  ASN  35          HD22      ASN  35   4.094  -0.895 -22.679
  250   2HD2  ASN  35          HD21      ASN  35   5.330  -0.157 -21.781
  251    H    THR  36           HN       THR  36   7.290  -1.828 -17.888
  252    HA   THR  36           HA       THR  36   6.692  -3.110 -15.316
  253    HB   THR  36           HB       THR  36   7.839  -4.651 -17.695
  254    HG1  THR  36           HG1      THR  36   5.609  -4.585 -16.451
  255   1HG2  THR  36          HG21      THR  36   8.259  -5.148 -14.697
  256   2HG2  THR  36          HG22      THR  36   8.435  -6.412 -15.908
  257   3HG2  THR  36          HG23      THR  36   9.522  -5.029 -15.918
  258    OH   TYR  37           OH       TYR  37   8.153   2.389 -18.477
  259    H    TYR  37           HN       TYR  37   8.153  -2.440 -13.895
  260    HA   TYR  37           HA       TYR  37  10.923  -1.866 -14.852
  261   1HB   TYR  37           HB2      TYR  37   9.257  -0.111 -12.981
  262   2HB   TYR  37           HB1      TYR  37  10.922   0.204 -13.459
  263    HD1  TYR  37           HD2      TYR  37   7.422   0.128 -14.622
  264    HD2  TYR  37           HD1      TYR  37  11.442   0.984 -15.708
  265    HE1  TYR  37           HE2      TYR  37   6.641   1.235 -16.669
  266    HE2  TYR  37           HE1      TYR  37  10.658   2.109 -17.739
  267    HH   TYR  37           HH       TYR  37   8.866   2.945 -18.802
  268    H    LEU  38           HN       LEU  38  12.528  -2.447 -13.460
  269    HA   LEU  38           HA       LEU  38  11.994  -2.971 -10.638
  270   1HB   LEU  38           HB2      LEU  38  11.076  -5.012 -11.819
  271   2HB   LEU  38           HB1      LEU  38  12.671  -5.299 -12.498
  272    HG   LEU  38           HG       LEU  38  12.998  -4.924  -9.680
  273   1HD1  LEU  38          HD13      LEU  38  10.605  -6.539 -10.489
  274   2HD1  LEU  38          HD11      LEU  38  11.600  -7.127  -9.160
  275   3HD1  LEU  38          HD12      LEU  38  10.846  -5.540  -9.061
  276   1HD2  LEU  38          HD23      LEU  38  13.328  -7.139 -11.688
  277   2HD2  LEU  38          HD21      LEU  38  14.556  -6.300 -10.746
  278   3HD2  LEU  38          HD22      LEU  38  13.525  -7.499  -9.974
  279    H    ASN  39           HN       ASN  39  13.875  -3.311  -9.427
  280    HA   ASN  39           HA       ASN  39  16.449  -3.277 -10.929
  281   1HB   ASN  39           HB2      ASN  39  17.268  -1.399  -9.612
  282   2HB   ASN  39           HB1      ASN  39  15.685  -0.923 -10.220
  283   1HD2  ASN  39          HD22      ASN  39  16.278  -1.344  -6.228
  284   2HD2  ASN  39          HD21      ASN  39  17.522  -1.665  -7.339
  285    CH2  TRP  40           CH2      TRP  40  16.307 -10.468  -7.287
  286    H    TRP  40           HN       TRP  40  18.333  -3.534  -9.368
  287    HA   TRP  40           HA       TRP  40  17.580  -5.306  -7.089
  288   1HB   TRP  40           HB2      TRP  40  19.540  -5.802  -9.363
  289   2HB   TRP  40           HB1      TRP  40  19.664  -6.690  -7.847
  290    HD1  TRP  40           HD1      TRP  40  17.251  -6.181 -10.843
  291    HE1  TRP  40           HE1      TRP  40  15.671  -8.153 -10.780
  292    HE3  TRP  40           HE3      TRP  40  18.704  -8.218  -6.561
  293    HZ2  TRP  40           HZ2      TRP  40  15.068 -10.431  -9.026
  294    HZ3  TRP  40           HZ3      TRP  40  17.670 -10.257  -5.658
  295    HH2  TRP  40           HH2      TRP  40  15.855 -11.364  -6.892
  296    OH   TYR  41           OH       TYR  41  20.674   2.196  -6.086
  297    H    TYR  41           HN       TYR  41  19.403  -5.625  -5.543
  298    HA   TYR  41           HA       TYR  41  21.547  -3.598  -5.639
  299   1HB   TYR  41           HB2      TYR  41  19.068  -3.348  -4.015
  300   2HB   TYR  41           HB1      TYR  41  20.547  -3.142  -3.083
  301    HD1  TYR  41           HD1      TYR  41  22.383  -1.620  -4.353
  302    HD2  TYR  41           HD2      TYR  41  18.183  -1.431  -5.007
  303    HE1  TYR  41           HE1      TYR  41  22.622   0.662  -5.215
  304    HE2  TYR  41           HE2      TYR  41  18.426   0.852  -5.879
  305    HH   TYR  41           HH       TYR  41  21.105   2.724  -5.409
  306    H    LEU  42           HN       LEU  42  23.337  -4.353  -4.670
  307    HA   LEU  42           HA       LEU  42  23.014  -6.662  -2.789
  308   1HB   LEU  42           HB2      LEU  42  24.175  -7.555  -4.660
  309   2HB   LEU  42           HB1      LEU  42  25.036  -6.055  -4.968
  310    HG   LEU  42           HG       LEU  42  26.434  -6.402  -2.981
  311   1HD1  LEU  42          HD13      LEU  42  24.358  -8.438  -2.418
  312   2HD1  LEU  42          HD11      LEU  42  26.005  -8.963  -2.086
  313   3HD1  LEU  42          HD12      LEU  42  25.364  -7.528  -1.298
  314   1HD2  LEU  42          HD21      LEU  42  26.562  -7.879  -5.308
  315   2HD2  LEU  42          HD22      LEU  42  27.813  -7.851  -4.069
  316   3HD2  LEU  42          HD23      LEU  42  26.609  -9.133  -4.075
  317    H    GLN  43           HN       GLN  43  23.468  -6.136  -0.776
  318    HA   GLN  43           HA       GLN  43  25.307  -3.851  -0.262
  319   1HB   GLN  43           HB2      GLN  43  22.842  -4.268   0.745
  320   2HB   GLN  43           HB1      GLN  43  23.742  -5.221   1.918
  321   1HG   GLN  43           HG1      GLN  43  24.751  -2.471   1.243
  322   2HG   GLN  43           HG2      GLN  43  23.348  -2.610   2.297
  323   1HE2  GLN  43          HE22      GLN  43  26.617  -2.786   4.242
  324   2HE2  GLN  43          HE21      GLN  43  26.094  -1.723   3.028
  325    H    LYS  44           HN       LYS  44  27.150  -4.067   0.906
  326    HA   LYS  44           HA       LYS  44  27.906  -6.859   1.667
  327   1HB   LYS  44           HB2      LYS  44  29.153  -5.120  -0.111
  328   2HB   LYS  44           HB1      LYS  44  30.060  -4.843   1.364
  329   1HG   LYS  44           HG1      LYS  44  31.248  -6.659   0.584
  330   2HG   LYS  44           HG2      LYS  44  29.987  -7.531   1.446
  331   1HD   LYS  44           HD1      LYS  44  29.975  -8.553  -0.681
  332   2HD   LYS  44           HD2      LYS  44  28.660  -7.391  -0.796
  333   1HE   LYS  44           HE1      LYS  44  31.433  -6.529  -1.577
  334   2HE   LYS  44           HE2      LYS  44  30.502  -7.513  -2.698
  335   1HZ   LYS  44           HZ1      LYS  44  28.728  -5.627  -1.885
  336   2HZ   LYS  44           HZ2      LYS  44  30.187  -4.756  -1.996
  337    H    ALA  45           HN       ALA  45  29.497  -6.977   3.451
  338    HA   ALA  45           HA       ALA  45  28.543  -5.945   5.847
  339   1HB   ALA  45           HB2      ALA  45  31.414  -6.637   5.076
  340   2HB   ALA  45           HB3      ALA  45  30.879  -6.405   6.737
  341   3HB   ALA  45           HB1      ALA  45  30.226  -7.730   5.779
  342    H    GLY  46           HN       GLY  46  28.193  -3.891   6.341
  343   1HA   GLY  46           HA1      GLY  46  28.487  -1.558   6.503
  344   2HA   GLY  46           HA2      GLY  46  30.118  -2.001   6.991
  345    H    GLN  47           HN       GLN  47  28.489  -2.307   3.850
  346    HA   GLN  47           HA       GLN  47  30.463  -0.364   2.733
  347   1HB   GLN  47           HB2      GLN  47  31.065  -2.847   2.383
  348   2HB   GLN  47           HB1      GLN  47  29.635  -2.953   1.366
  349   1HG   GLN  47           HG1      GLN  47  30.573  -1.034  -0.002
  350   2HG   GLN  47           HG2      GLN  47  32.061  -1.181   0.931
  351   1HE2  GLN  47          HE22      GLN  47  33.075  -4.191  -0.665
  352   2HE2  GLN  47          HE21      GLN  47  33.315  -3.181   0.678
  353    H    SER  48           HN       SER  48  29.815   0.657   0.794
  354    HA   SER  48           HA       SER  48  27.055   1.367   0.696
  355   1HB   SER  48           HB2      SER  48  27.742   2.394  -1.574
  356   2HB   SER  48           HB1      SER  48  28.790   2.872  -0.223
  357    HG   SER  48           HG       SER  48  29.256   0.539  -1.760
  358    HA   PRO  49           HA       PRO  49  25.536  -2.271  -1.331
  359   1HB   PRO  49           HB2      PRO  49  23.111  -0.806  -2.005
  360   2HB   PRO  49           HB1      PRO  49  23.315  -2.053  -0.775
  361   1HG   PRO  49           HG1      PRO  49  22.995   0.780  -0.363
  362   2HG   PRO  49           HG2      PRO  49  23.235  -0.463   0.865
  363   1HD   PRO  49           HD1      PRO  49  25.122   1.535  -0.024
  364   2HD   PRO  49           HD2      PRO  49  25.364   0.285   1.212
  365    H    LYS  50           HN       LYS  50  26.360  -2.695  -3.287
  366    HA   LYS  50           HA       LYS  50  26.458  -0.680  -5.379
  367   1HB   LYS  50           HB2      LYS  50  27.678  -2.332  -6.637
  368   2HB   LYS  50           HB1      LYS  50  28.179  -2.537  -4.960
  369   1HG   LYS  50           HG1      LYS  50  26.151  -4.181  -4.849
  370   2HG   LYS  50           HG2      LYS  50  26.315  -4.223  -6.596
  371   1HD   LYS  50           HD1      LYS  50  28.569  -4.794  -4.636
  372   2HD   LYS  50           HD2      LYS  50  27.640  -6.031  -5.472
  373   1HE   LYS  50           HE1      LYS  50  29.089  -5.861  -7.196
  374   2HE   LYS  50           HE2      LYS  50  28.469  -4.241  -7.488
  375   1HZ   LYS  50           HZ1      LYS  50  30.095  -3.550  -5.664
  376   2HZ   LYS  50           HZ2      LYS  50  30.832  -5.060  -5.924
  377    H    LEU  51           HN       LEU  51  25.528  -0.895  -7.490
  378    HA   LEU  51           HA       LEU  51  22.918  -2.355  -7.414
  379   1HB   LEU  51           HB2      LEU  51  22.332  -0.081  -7.575
  380   2HB   LEU  51           HB1      LEU  51  23.787   0.337  -8.463
  381    HG   LEU  51           HG       LEU  51  22.846  -0.910 -10.456
  382   1HD1  LEU  51          HD13      LEU  51  21.228  -2.240  -8.929
  383   2HD1  LEU  51          HD11      LEU  51  20.216  -0.802  -8.959
  384   3HD1  LEU  51          HD12      LEU  51  20.586  -1.651 -10.457
  385   1HD2  LEU  51          HD21      LEU  51  22.647   1.551 -10.226
  386   2HD2  LEU  51          HD22      LEU  51  21.234   0.874 -11.030
  387   3HD2  LEU  51          HD23      LEU  51  21.142   1.344  -9.335
  388    H    LEU  52           HN       LEU  52  22.361  -3.659  -9.064
  389    HA   LEU  52           HA       LEU  52  24.370  -4.017 -11.250
  390   1HB   LEU  52           HB2      LEU  52  22.361  -6.044 -10.145
  391   2HB   LEU  52           HB1      LEU  52  23.642  -6.380 -11.303
  392    HG   LEU  52           HG       LEU  52  24.260  -5.242  -8.568
  393   1HD1  LEU  52          HD12      LEU  52  23.468  -8.011  -9.338
  394   2HD1  LEU  52          HD13      LEU  52  24.868  -7.863  -8.281
  395   3HD1  LEU  52          HD11      LEU  52  23.317  -7.192  -7.787
  396   1HD2  LEU  52          HD23      LEU  52  25.812  -6.839 -10.634
  397   2HD2  LEU  52          HD21      LEU  52  26.067  -5.151 -10.202
  398   3HD2  LEU  52          HD22      LEU  52  26.435  -6.422  -9.041
  399    H    ILE  53           HN       ILE  53  21.201  -5.483 -11.189
  400    HA   ILE  53           HA       ILE  53  20.529  -4.287 -13.753
  401    HB   ILE  53           HB       ILE  53  19.131  -6.169 -11.805
  402   1HG1  ILE  53          HG11      ILE  53  19.532  -7.754 -13.777
  403   2HG1  ILE  53          HG12      ILE  53  20.574  -6.502 -14.431
  404   1HG2  ILE  53          HG23      ILE  53  18.253  -5.143 -14.545
  405   2HG2  ILE  53          HG21      ILE  53  17.576  -6.594 -13.809
  406   3HG2  ILE  53          HG22      ILE  53  17.356  -5.027 -13.033
  407   1HD1  ILE  53          HD11      ILE  53  21.010  -7.324 -11.599
  408   2HD1  ILE  53          HD12      ILE  53  21.541  -8.416 -12.875
  409   3HD1  ILE  53          HD13      ILE  53  22.174  -6.773 -12.806
  410    OH   TYR  54           OH       TYR  54  21.790  -0.271 -17.575
  411    H    TYR  54           HN       TYR  54  18.878  -2.846 -14.152
  412    HA   TYR  54           HA       TYR  54  17.399  -1.719 -11.827
  413   1HB   TYR  54           HB2      TYR  54  17.869   0.606 -12.939
  414   2HB   TYR  54           HB1      TYR  54  19.186  -0.131 -12.030
  415    HD1  TYR  54           HD1      TYR  54  17.856   0.428 -15.449
  416    HD2  TYR  54           HD2      TYR  54  21.179  -0.872 -13.137
  417    HE1  TYR  54           HE1      TYR  54  19.251   0.398 -17.467
  418    HE2  TYR  54           HE2      TYR  54  22.563  -0.889 -15.149
  419    HH   TYR  54           HH       TYR  54  22.340  -1.060 -17.543
  420    H    LYS  55           HN       LYS  55  17.405  -2.853 -14.943
  421    HA   LYS  55           HA       LYS  55  14.637  -1.857 -15.354
  422   1HB   LYS  55           HB2      LYS  55  16.868  -0.892 -16.799
  423   2HB   LYS  55           HB1      LYS  55  16.138  -2.070 -17.879
  424   1HG   LYS  55           HG1      LYS  55  14.933  -0.135 -18.411
  425   2HG   LYS  55           HG2      LYS  55  13.884  -0.889 -17.215
  426   1HD   LYS  55           HD1      LYS  55  14.987   0.506 -15.442
  427   2HD   LYS  55           HD2      LYS  55  15.911   1.316 -16.700
  428   1HE   LYS  55           HE1      LYS  55  14.132   2.576 -17.355
  429   2HE   LYS  55           HE2      LYS  55  13.016   1.221 -17.243
  430   1HZ   LYS  55           HZ1      LYS  55  13.483   1.619 -14.678
  431   2HZ   LYS  55           HZ2      LYS  55  13.736   3.204 -15.239
  432    H    VAL  56           HN       VAL  56  14.945  -4.214 -14.363
  433    HA   VAL  56           HA       VAL  56  14.190  -6.399 -14.682
  434    HB   VAL  56           HB       VAL  56  14.194  -5.857 -17.686
  435   1HG1  VAL  56          HG12      VAL  56  12.650  -7.734 -15.869
  436   2HG1  VAL  56          HG13      VAL  56  12.336  -7.539 -17.590
  437   3HG1  VAL  56          HG11      VAL  56  13.877  -8.192 -17.045
  438   1HG2  VAL  56          HG21      VAL  56  12.216  -5.059 -15.538
  439   2HG2  VAL  56          HG22      VAL  56  12.844  -4.082 -16.862
  440   3HG2  VAL  56          HG23      VAL  56  11.680  -5.361 -17.188
  441    H    SER  57           HN       SER  57  16.579  -5.407 -17.176
  442    HA   SER  57           HA       SER  57  18.511  -7.309 -16.152
  443   1HB   SER  57           HB2      SER  57  18.458  -8.927 -18.043
  444   2HB   SER  57           HB1      SER  57  16.828  -8.835 -17.352
  445    HG   SER  57           HG       SER  57  17.853  -7.458 -19.615
  446    H    ASN  58           HN       ASN  58  18.728  -4.616 -16.782
  447    HA   ASN  58           HA       ASN  58  20.158  -4.503 -19.377
  448   1HB   ASN  58           HB2      ASN  58  19.257  -2.430 -17.343
  449   2HB   ASN  58           HB1      ASN  58  20.351  -2.003 -18.658
  450   1HD2  ASN  58          HD22      ASN  58  17.631  -1.581 -20.823
  451   2HD2  ASN  58          HD21      ASN  58  19.135  -1.028 -20.266
  452    NH1  ARG  59           NH2      ARG  59  22.448  -7.487 -19.388
  453    NH2  ARG  59           NH1      ARG  59  22.122  -9.737 -19.446
  454    H    ARG  59           HN       ARG  59  20.791  -4.192 -15.927
  455    HA   ARG  59           HA       ARG  59  22.797  -4.369 -14.727
  456   1HB   ARG  59           HB2      ARG  59  24.124  -5.019 -17.398
  457   2HB   ARG  59           HB1      ARG  59  24.688  -5.457 -15.792
  458   1HG   ARG  59           HG1      ARG  59  22.696  -6.889 -15.476
  459   2HG   ARG  59           HG2      ARG  59  22.126  -6.455 -17.082
  460   1HD   ARG  59           HD1      ARG  59  24.484  -7.297 -17.873
  461   2HD   ARG  59           HD2      ARG  59  24.513  -8.126 -16.317
  462    HE   ARG  59           HE       ARG  59  22.762  -9.553 -17.082
  463   1HH1  ARG  59          HH21      ARG  59  22.759  -6.681 -18.884
  464   2HH1  ARG  59          HH22      ARG  59  22.086  -7.390 -20.314
  465   1HH2  ARG  59          HH11      ARG  59  22.188 -10.623 -18.985
  466   2HH2  ARG  59          HH12      ARG  59  21.758  -9.681 -20.373
  467    H    PHE  60           HN       PHE  60  24.161  -2.810 -14.049
  468    HA   PHE  60           HA       PHE  60  24.404  -0.391 -15.685
  469   1HB   PHE  60           HB2      PHE  60  24.179  -0.713 -13.022
  470   2HB   PHE  60           HB1      PHE  60  25.938  -0.763 -13.112
  471    HD1  PHE  60           HD2      PHE  60  23.022   1.272 -14.292
  472    HD2  PHE  60           HD1      PHE  60  27.138   1.263 -13.196
  473    HE1  PHE  60           HE2      PHE  60  23.090   3.715 -14.519
  474    HE2  PHE  60           HE1      PHE  60  27.202   3.707 -13.426
  475    HZ   PHE  60           HZ       PHE  60  25.179   4.935 -14.086
  476    H    SER  61           HN       SER  61  26.579   0.709 -15.831
  477    HA   SER  61           HA       SER  61  28.361  -0.910 -17.353
  478   1HB   SER  61           HB2      SER  61  28.222   1.630 -17.455
  479   2HB   SER  61           HB1      SER  61  29.061   1.691 -15.893
  480    HG   SER  61           HG       SER  61  30.435  -0.007 -17.239
  481    H    GLY  62           HN       GLY  62  28.328  -0.085 -13.946
  482   1HA   GLY  62           HA1      GLY  62  30.982  -1.186 -13.425
  483   2HA   GLY  62           HA2      GLY  62  29.813  -0.693 -12.204
  484    H    VAL  63           HN       VAL  63  28.459  -2.753 -14.506
  485    HA   VAL  63           HA       VAL  63  28.611  -5.013 -12.570
  486    HB   VAL  63           HB       VAL  63  26.691  -4.597 -14.909
  487   1HG1  VAL  63          HG13      VAL  63  26.772  -6.490 -12.542
  488   2HG1  VAL  63          HG11      VAL  63  25.305  -6.208 -13.475
  489   3HG1  VAL  63          HG12      VAL  63  26.722  -6.908 -14.254
  490   1HG2  VAL  63          HG23      VAL  63  26.430  -3.894 -11.966
  491   2HG2  VAL  63          HG21      VAL  63  26.380  -2.779 -13.325
  492   3HG2  VAL  63          HG22      VAL  63  25.074  -3.933 -13.088
  493    HA   PRO  64           HA       PRO  64  31.267  -7.021 -15.477
  494   1HB   PRO  64           HB2      PRO  64  30.955  -9.537 -14.118
  495   2HB   PRO  64           HB1      PRO  64  32.286  -8.397 -13.951
  496   1HG   PRO  64           HG1      PRO  64  30.168  -8.967 -12.050
  497   2HG   PRO  64           HG2      PRO  64  31.551  -7.892 -11.846
  498   1HD   PRO  64           HD1      PRO  64  28.794  -7.157 -12.270
  499   2HD   PRO  64           HD2      PRO  64  30.188  -6.080 -12.074
  500    H    ASP  65           HN       ASP  65  28.199  -7.042 -15.684
  501    HA   ASP  65           HA       ASP  65  26.650  -7.919 -17.181
  502   1HB   ASP  65           HB2      ASP  65  28.713  -7.970 -18.696
  503   2HB   ASP  65           HB1      ASP  65  28.906  -9.663 -18.246
  504    NH1  ARG  66           NH2      ARG  66  31.259 -12.572 -10.009
  505    NH2  ARG  66           NH1      ARG  66  32.740 -11.219 -11.073
  506    H    ARG  66           HN       ARG  66  28.706 -10.372 -15.624
  507    HA   ARG  66           HA       ARG  66  27.088 -12.630 -16.057
  508   1HB   ARG  66           HB2      ARG  66  27.957 -13.337 -13.723
  509   2HB   ARG  66           HB1      ARG  66  29.184 -12.948 -14.922
  510   1HG   ARG  66           HG1      ARG  66  29.716 -10.914 -13.908
  511   2HG   ARG  66           HG2      ARG  66  28.142 -10.763 -13.141
  512   1HD   ARG  66           HD1      ARG  66  29.145 -11.553 -11.260
  513   2HD   ARG  66           HD2      ARG  66  29.164 -13.123 -12.059
  514    HE   ARG  66           HE       ARG  66  31.447 -12.117 -13.037
  515   1HH1  ARG  66          HH21      ARG  66  30.431 -13.131 -10.044
  516   2HH1  ARG  66          HH22      ARG  66  31.776 -12.497  -9.158
  517   1HH2  ARG  66          HH11      ARG  66  33.029 -10.756 -11.908
  518   2HH2  ARG  66          HH12      ARG  66  33.281 -11.127 -10.237
  519    H    PHE  67           HN       PHE  67  26.381  -9.833 -14.237
  520    HA   PHE  67           HA       PHE  67  24.331 -11.167 -12.598
  521   1HB   PHE  67           HB2      PHE  67  25.333  -8.315 -12.899
  522   2HB   PHE  67           HB1      PHE  67  23.900  -8.679 -11.941
  523    HD1  PHE  67           HD1      PHE  67  24.087 -10.259 -10.007
  524    HD2  PHE  67           HD2      PHE  67  27.538  -8.857 -12.075
  525    HE1  PHE  67           HE1      PHE  67  25.498 -10.990  -8.149
  526    HE2  PHE  67           HE2      PHE  67  28.946  -9.564 -10.191
  527    HZ   PHE  67           HZ       PHE  67  27.929 -10.643  -8.229
  528    H    SER  68           HN       SER  68  22.830 -11.917 -14.067
  529    HA   SER  68           HA       SER  68  21.432  -9.827 -15.686
  530   1HB   SER  68           HB2      SER  68  21.719 -12.854 -16.005
  531   2HB   SER  68           HB1      SER  68  20.510 -11.928 -16.918
  532    HG   SER  68           HG       SER  68  23.288 -11.893 -17.074
  533    H    GLY  69           HN       GLY  69  19.081  -9.978 -15.792
  534   1HA   GLY  69           HA1      GLY  69  17.842 -11.485 -13.550
  535   2HA   GLY  69           HA2      GLY  69  17.619  -9.739 -13.588
  536    H    SER  70           HN       SER  70  15.353 -10.713 -13.584
  537    HA   SER  70           HA       SER  70  14.349 -10.561 -16.361
  538   1HB   SER  70           HB2      SER  70  14.625 -13.026 -15.892
  539   2HB   SER  70           HB1      SER  70  13.596 -12.848 -14.457
  540    HG   SER  70           HG       SER  70  12.884 -12.992 -17.064
  541    H    GLY  71           HN       GLY  71  11.897 -10.434 -16.336
  542   1HA   GLY  71           HA1      GLY  71  10.539  -9.777 -13.891
  543   2HA   GLY  71           HA2      GLY  71  11.059  -8.304 -14.697
  544    H    SER  72           HN       SER  72   9.028 -11.142 -14.952
  545    HA   SER  72           HA       SER  72   7.757 -10.047 -17.388
  546   1HB   SER  72           HB2      SER  72   7.620 -12.682 -15.885
  547   2HB   SER  72           HB1      SER  72   6.345 -12.269 -17.048
  548    HG   SER  72           HG       SER  72   9.060 -12.737 -17.456
  549    H    GLY  73           HN       GLY  73   7.307  -8.303 -15.436
  550   1HA   GLY  73           HA1      GLY  73   5.438  -7.077 -14.640
  551   2HA   GLY  73           HA2      GLY  73   4.396  -8.392 -15.169
  552    H    THR  74           HN       THR  74   4.963 -10.517 -13.797
  553    HA   THR  74           HA       THR  74   5.051  -9.689 -10.922
  554    HB   THR  74           HB       THR  74   3.419 -11.728 -10.639
  555    HG1  THR  74           HG1      THR  74   3.720 -12.496 -12.744
  556   1HG2  THR  74          HG23      THR  74   2.619  -9.198 -12.166
  557   2HG2  THR  74          HG21      THR  74   1.444 -10.334 -11.515
  558   3HG2  THR  74          HG22      THR  74   2.499  -9.441 -10.426
  559    H    ASP  75           HN       ASP  75   7.249 -10.688 -12.520
  560    HA   ASP  75           HA       ASP  75   8.101 -12.808 -10.702
  561   1HB   ASP  75           HB2      ASP  75   6.857 -13.545 -13.173
  562   2HB   ASP  75           HB1      ASP  75   8.580 -13.829 -13.395
  563    H    PHE  76           HN       PHE  76   9.974 -11.879 -10.166
  564    HA   PHE  76           HA       PHE  76  11.845 -11.187 -12.390
  565   1HB   PHE  76           HB2      PHE  76  11.629  -9.721  -9.719
  566   2HB   PHE  76           HB1      PHE  76  12.589  -9.235 -11.114
  567    HD1  PHE  76           HD1      PHE  76   9.057  -9.878 -10.052
  568    HD2  PHE  76           HD2      PHE  76  11.625  -7.849 -12.779
  569    HE1  PHE  76           HE1      PHE  76   7.123  -8.721 -11.018
  570    HE2  PHE  76           HE2      PHE  76   9.678  -6.715 -13.757
  571    HZ   PHE  76           HZ       PHE  76   7.433  -7.127 -12.859
  572    H    THR  77           HN       THR  77  13.987 -11.667 -12.090
  573    HA   THR  77           HA       THR  77  14.871 -12.833  -9.517
  574    HB   THR  77           HB       THR  77  15.139 -14.420 -12.136
  575    HG1  THR  77           HG1      THR  77  13.496 -15.507 -10.364
  576   1HG2  THR  77          HG22      THR  77  15.409 -15.111  -9.155
  577   2HG2  THR  77          HG23      THR  77  15.417 -16.313 -10.438
  578   3HG2  THR  77          HG21      THR  77  16.721 -15.135 -10.330
  579    H    LEU  78           HN       LEU  78  17.246 -13.484  -9.686
  580    HA   LEU  78           HA       LEU  78  18.679 -11.798 -11.685
  581   1HB   LEU  78           HB2      LEU  78  18.372 -11.016  -9.058
  582   2HB   LEU  78           HB1      LEU  78  19.883 -11.911  -8.961
  583    HG   LEU  78           HG       LEU  78  20.741 -10.558 -10.909
  584   1HD1  LEU  78          HD13      LEU  78  17.960  -9.655 -10.847
  585   2HD1  LEU  78          HD11      LEU  78  19.097  -8.311 -10.838
  586   3HD1  LEU  78          HD12      LEU  78  19.156  -9.503 -12.130
  587   1HD2  LEU  78          HD23      LEU  78  19.868  -9.226  -8.343
  588   2HD2  LEU  78          HD21      LEU  78  21.471  -9.800  -8.784
  589   3HD2  LEU  78          HD22      LEU  78  20.814  -8.355  -9.544
  590    H    LYS  79           HN       LYS  79  19.392 -13.530 -12.839
  591    HA   LYS  79           HA       LYS  79  20.651 -15.831 -11.561
  592   1HB   LYS  79           HB2      LYS  79  20.473 -14.874 -14.456
  593   2HB   LYS  79           HB1      LYS  79  21.237 -16.389 -13.994
  594   1HG   LYS  79           HG1      LYS  79  18.514 -15.942 -12.889
  595   2HG   LYS  79           HG2      LYS  79  18.597 -16.178 -14.631
  596   1HD   LYS  79           HD1      LYS  79  19.799 -18.283 -14.339
  597   2HD   LYS  79           HD2      LYS  79  19.902 -18.025 -12.601
  598   1HE   LYS  79           HE1      LYS  79  17.322 -17.921 -12.638
  599   2HE   LYS  79           HE2      LYS  79  17.437 -18.593 -14.261
  600   1HZ   LYS  79           HZ1      LYS  79  17.874 -20.596 -13.453
  601   2HZ   LYS  79           HZ2      LYS  79  19.065 -20.010 -12.392
  602    H    ILE  80           HN       ILE  80  22.580 -15.609 -10.637
  603    HA   ILE  80           HA       ILE  80  24.529 -13.671 -11.726
  604    HB   ILE  80           HB       ILE  80  24.559 -15.463  -9.261
  605   1HG1  ILE  80          HG11      ILE  80  24.381 -12.445  -9.355
  606   2HG1  ILE  80          HG12      ILE  80  22.943 -13.456  -9.402
  607   1HG2  ILE  80          HG23      ILE  80  26.853 -14.894 -10.214
  608   2HG2  ILE  80          HG21      ILE  80  26.453 -13.188 -10.038
  609   3HG2  ILE  80          HG22      ILE  80  26.587 -14.214  -8.614
  610   1HD1  ILE  80          HD12      ILE  80  24.915 -14.144  -7.287
  611   2HD1  ILE  80          HD13      ILE  80  24.091 -12.598  -7.086
  612   3HD1  ILE  80          HD11      ILE  80  23.154 -14.087  -7.208
  613    H    SER  81           HN       SER  81  25.881 -14.216 -13.184
  614    HA   SER  81           HA       SER  81  26.514 -17.053 -13.512
  615   1HB   SER  81           HB2      SER  81  25.991 -15.152 -15.389
  616   2HB   SER  81           HB1      SER  81  27.758 -15.006 -15.324
  617    HG   SER  81           HG       SER  81  26.481 -16.834 -16.591
  618    NH1  ARG  82           NH1      ARG  82  31.293 -17.940 -16.676
  619    NH2  ARG  82           NH2      ARG  82  32.941 -16.414 -16.321
  620    H    ARG  82           HN       ARG  82  27.832 -17.394 -11.757
  621    HA   ARG  82           HA       ARG  82  30.135 -17.883 -11.201
  622   1HB   ARG  82           HB2      ARG  82  30.724 -15.092 -12.312
  623   2HB   ARG  82           HB1      ARG  82  31.909 -16.193 -11.639
  624   1HG   ARG  82           HG1      ARG  82  30.338 -17.525 -13.691
  625   2HG   ARG  82           HG2      ARG  82  31.099 -16.068 -14.324
  626   1HD   ARG  82           HD1      ARG  82  33.282 -16.828 -13.382
  627   2HD   ARG  82           HD2      ARG  82  32.505 -18.308 -12.823
  628    HE   ARG  82           HE       ARG  82  33.082 -19.034 -15.013
  629   1HH1  ARG  82          HH11      ARG  82  30.820 -18.771 -16.386
  630   2HH1  ARG  82          HH12      ARG  82  30.993 -17.454 -17.496
  631   1HH2  ARG  82          HH21      ARG  82  33.707 -16.099 -15.763
  632   2HH2  ARG  82          HH22      ARG  82  32.669 -15.901 -17.133
  633    H    VAL  83           HN       VAL  83  28.856 -17.738  -9.238
  634    HA   VAL  83           HA       VAL  83  28.649 -15.259  -7.784
  635    HB   VAL  83           HB       VAL  83  28.624 -18.180  -6.874
  636   1HG1  VAL  83          HG12      VAL  83  28.830 -15.777  -5.312
  637   2HG1  VAL  83          HG13      VAL  83  27.221 -16.451  -5.075
  638   3HG1  VAL  83          HG11      VAL  83  28.645 -17.432  -4.741
  639   1HG2  VAL  83          HG21      VAL  83  26.799 -17.352  -8.436
  640   2HG2  VAL  83          HG22      VAL  83  26.216 -17.936  -6.880
  641   3HG2  VAL  83          HG23      VAL  83  26.339 -16.205  -7.182
  642    H    GLU  84           HN       GLU  84  30.536 -14.181  -7.503
  643    HA   GLU  84           HA       GLU  84  32.919 -15.664  -6.527
  644   1HB   GLU  84           HB2      GLU  84  32.429 -12.847  -7.565
  645   2HB   GLU  84           HB1      GLU  84  33.945 -13.275  -6.785
  646   1HG   GLU  84           HG1      GLU  84  34.079 -15.232  -8.462
  647   2HG   GLU  84           HG2      GLU  84  32.783 -14.428  -9.342
  648    H    ALA  85           HN       ALA  85  34.253 -14.196  -4.898
  649    HA   ALA  85           HA       ALA  85  32.946 -14.312  -2.401
  650   1HB   ALA  85           HB1      ALA  85  35.458 -14.094  -2.836
  651   2HB   ALA  85           HB2      ALA  85  35.195 -12.382  -3.151
  652   3HB   ALA  85           HB3      ALA  85  34.866 -13.044  -1.553
  653    H    GLU  86           HN       GLU  86  32.985 -11.787  -4.792
  654    HA   GLU  86           HA       GLU  86  32.138  -9.573  -3.226
  655   1HB   GLU  86           HB2      GLU  86  31.909 -10.420  -6.106
  656   2HB   GLU  86           HB1      GLU  86  30.867  -9.103  -5.579
  657   1HG   GLU  86           HG1      GLU  86  33.825  -9.118  -4.981
  658   2HG   GLU  86           HG2      GLU  86  33.189  -8.459  -6.485
  659    H    ASP  87           HN       ASP  87  30.243 -11.884  -5.080
  660    HA   ASP  87           HA       ASP  87  27.659 -11.022  -4.555
  661   1HB   ASP  87           HB2      ASP  87  28.840 -13.814  -4.765
  662   2HB   ASP  87           HB1      ASP  87  27.104 -13.564  -4.613
  663    H    LEU  88           HN       LEU  88  29.848 -12.522  -2.281
  664    HA   LEU  88           HA       LEU  88  27.973 -13.461  -0.381
  665   1HB   LEU  88           HB2      LEU  88  30.711 -12.188   0.046
  666   2HB   LEU  88           HB1      LEU  88  29.817 -13.036   1.301
  667    HG   LEU  88           HG       LEU  88  30.802 -14.221  -1.319
  668   1HD1  LEU  88          HD13      LEU  88  32.350 -13.801   0.767
  669   2HD1  LEU  88          HD11      LEU  88  31.466 -15.160   1.472
  670   3HD1  LEU  88          HD12      LEU  88  32.385 -15.382  -0.021
  671   1HD2  LEU  88          HD22      LEU  88  28.910 -15.225   0.804
  672   2HD2  LEU  88          HD23      LEU  88  28.786 -15.378  -0.946
  673   3HD2  LEU  88          HD21      LEU  88  29.937 -16.369  -0.054
  674    H    GLY  89           HN       GLY  89  26.934 -12.544   1.336
  675   1HA   GLY  89           HA1      GLY  89  26.845 -10.441   2.816
  676   2HA   GLY  89           HA2      GLY  89  26.764  -9.557   1.291
  677    H    ILE  90           HN       ILE  90  24.732  -8.771   1.239
  678    HA   ILE  90           HA       ILE  90  22.528 -10.777   1.393
  679    HB   ILE  90           HB       ILE  90  22.106  -7.945   2.377
  680   1HG1  ILE  90          HG11      ILE  90  22.502  -9.158   4.726
  681   2HG1  ILE  90          HG12      ILE  90  23.626 -10.117   3.772
  682   1HG2  ILE  90          HG22      ILE  90  20.957 -10.685   3.112
  683   2HG2  ILE  90          HG23      ILE  90  20.404  -9.153   3.780
  684   3HG2  ILE  90          HG21      ILE  90  20.177  -9.501   2.069
  685   1HD1  ILE  90          HD11      ILE  90  24.219  -7.580   2.899
  686   2HD1  ILE  90          HD12      ILE  90  23.787  -7.273   4.578
  687   3HD1  ILE  90          HD13      ILE  90  25.081  -8.403   4.195
  688    OH   TYR  91           OH       TYR  91  25.634 -10.044  -6.270
  689    H    TYR  91           HN       TYR  91  21.500 -10.818  -0.467
  690    HA   TYR  91           HA       TYR  91  21.682  -8.517  -2.301
  691   1HB   TYR  91           HB2      TYR  91  21.012 -11.423  -2.490
  692   2HB   TYR  91           HB1      TYR  91  20.125 -10.380  -3.600
  693    HD1  TYR  91           HD2      TYR  91  23.553 -11.256  -2.449
  694    HD2  TYR  91           HD1      TYR  91  21.216  -9.451  -5.511
  695    HE1  TYR  91           HE2      TYR  91  25.541 -11.074  -3.867
  696    HE2  TYR  91           HE1      TYR  91  23.213  -9.282  -6.931
  697    HH   TYR  91           HH       TYR  91  26.030 -10.916  -6.353
  698    H    PHE  92           HN       PHE  92  19.947  -7.399  -3.101
  699    HA   PHE  92           HA       PHE  92  17.274  -7.909  -1.892
  700   1HB   PHE  92           HB2      PHE  92  18.660  -5.180  -1.979
  701   2HB   PHE  92           HB1      PHE  92  17.066  -5.507  -1.308
  702    HD1  PHE  92           HD2      PHE  92  16.930  -7.155   0.678
  703    HD2  PHE  92           HD1      PHE  92  20.587  -5.408  -0.627
  704    HE1  PHE  92           HE2      PHE  92  17.935  -7.621   2.868
  705    HE2  PHE  92           HE1      PHE  92  21.587  -5.876   1.565
  706    HZ   PHE  92           HZ       PHE  92  20.263  -6.976   3.316
  707    H    CYS  93           HN       CYS  93  15.677  -6.265  -2.906
  708    HA   CYS  93           HA       CYS  93  16.325  -5.325  -5.584
  709   1HB   CYS  93           HB2      CYS  93  15.237  -6.920  -6.856
  710   2HB   CYS  93           HB1      CYS  93  15.803  -7.940  -5.563
  711    H    SER  94           HN       SER  94  14.503  -4.216  -6.588
  712    HA   SER  94           HA       SER  94  12.157  -3.765  -4.854
  713   1HB   SER  94           HB2      SER  94  13.975  -2.144  -4.085
  714   2HB   SER  94           HB1      SER  94  13.931  -1.423  -5.705
  715    HG   SER  94           HG       SER  94  12.443  -0.455  -4.166
  716    H    GLN  95           HN       GLN  95  10.814  -1.909  -5.877
  717    HA   GLN  95           HA       GLN  95  10.825  -2.224  -8.852
  718   1HB   GLN  95           HB2      GLN  95   8.226  -2.121  -8.525
  719   2HB   GLN  95           HB1      GLN  95   9.031  -3.633  -8.124
  720   1HG   GLN  95           HG1      GLN  95   8.544  -3.433  -5.909
  721   2HG   GLN  95           HG2      GLN  95   8.983  -1.731  -5.876
  722   1HE2  GLN  95          HE22      GLN  95   5.249  -2.273  -5.390
  723   2HE2  GLN  95          HE21      GLN  95   6.582  -3.060  -4.700
  724    H    THR  96           HN       THR  96  10.859  -0.316  -9.861
  725    HA   THR  96           HA       THR  96  10.269   2.133  -8.300
  726    HB   THR  96           HB       THR  96  11.321   3.295 -10.300
  727    HG1  THR  96           HG1      THR  96  10.581   1.847 -11.852
  728   1HG2  THR  96          HG23      THR  96  12.638   1.387  -8.573
  729   2HG2  THR  96          HG21      THR  96  13.265   1.120 -10.196
  730   3HG2  THR  96          HG22      THR  96  13.400   2.709  -9.450
  731    H    THR  97           HN       THR  97   8.441   0.082 -10.006
  732    HA   THR  97           HA       THR  97   7.019   1.855 -11.789
  733    HB   THR  97           HB       THR  97   6.139  -0.785 -10.485
  734    HG1  THR  97           HG1      THR  97   6.945  -1.569 -12.455
  735   1HG2  THR  97          HG21      THR  97   4.684   1.081 -12.132
  736   2HG2  THR  97          HG22      THR  97   5.203  -0.222 -13.197
  737   3HG2  THR  97          HG23      THR  97   4.225  -0.583 -11.778
  738    H    HIS  98           HN       HIS  98   6.023   0.442  -8.670
  739    HA   HIS  98           HA       HIS  98   3.911   2.501  -8.465
  740   1HB   HIS  98           HB2      HIS  98   4.625   0.176  -6.615
  741   2HB   HIS  98           HB1      HIS  98   3.163   1.155  -6.514
  742    HD2  HIS  98           HD2      HIS  98   4.773  -1.558  -8.865
  743    HE1  HIS  98           HE1      HIS  98   0.816  -1.065  -9.950
  744    H    VAL  99           HN       VAL  99   4.980   4.385  -8.017
  745    HA   VAL  99           HA       VAL  99   6.994   4.578  -5.937
  746    HB   VAL  99           HB       VAL  99   6.840   6.136  -7.915
  747   1HG1  VAL  99          HG12      VAL  99   4.258   6.177  -7.759
  748   2HG1  VAL  99          HG13      VAL  99   4.476   7.405  -6.517
  749   3HG1  VAL  99          HG11      VAL  99   5.059   7.695  -8.152
  750   1HG2  VAL  99          HG22      VAL  99   6.575   7.383  -5.161
  751   2HG2  VAL  99          HG23      VAL  99   8.064   6.978  -6.011
  752   3HG2  VAL  99          HG21      VAL  99   7.048   8.291  -6.593
  753    HA   PRO 100           HA       PRO 100   7.767   5.784  -4.375
  754   1HB   PRO 100           HB2      PRO 100   8.048   4.775  -1.717
  755   2HB   PRO 100           HB1      PRO 100   8.069   6.471  -2.200
  756   1HG   PRO 100           HG1      PRO 100   5.987   5.034  -0.760
  757   2HG   PRO 100           HG2      PRO 100   6.074   6.759  -1.118
  758   1HD   PRO 100           HD1      PRO 100   4.391   4.770  -2.372
  759   2HD   PRO 100           HD2      PRO 100   4.465   6.507  -2.719
  760    HA   PRO 101           HA       PRO 101   8.691   1.609  -5.409
  761   1HB   PRO 101           HB2      PRO 101  11.506   1.987  -4.739
  762   2HB   PRO 101           HB1      PRO 101  10.779   1.917  -6.341
  763   1HG   PRO 101           HG1      PRO 101  11.797   4.240  -4.985
  764   2HG   PRO 101           HG2      PRO 101  11.026   4.177  -6.570
  765   1HD   PRO 101           HD1      PRO 101   9.936   5.240  -4.115
  766   2HD   PRO 101           HD2      PRO 101   9.163   5.173  -5.710
  767    H    THR 102           HN       THR 102   8.062   0.105  -3.949
  768    HA   THR 102           HA       THR 102   8.864   0.233  -1.166
  769    HB   THR 102           HB       THR 102   7.696  -2.028  -1.040
  770    HG1  THR 102           HG1      THR 102   8.348  -2.696  -3.108
  771   1HG2  THR 102          HG22      THR 102   6.523   0.488  -1.889
  772   2HG2  THR 102          HG23      THR 102   5.739  -0.799  -2.799
  773   3HG2  THR 102          HG21      THR 102   5.714  -0.824  -1.039
  774    H    PHE 103           HN       PHE 103  11.112   0.243  -1.302
  775    HA   PHE 103           HA       PHE 103  12.573  -2.002  -2.453
  776   1HB   PHE 103           HB2      PHE 103  13.751   0.109  -2.371
  777   2HB   PHE 103           HB1      PHE 103  13.327   0.363  -0.682
  778    HD1  PHE 103           HD1      PHE 103  14.473  -0.925   1.102
  779    HD2  PHE 103           HD2      PHE 103  15.594  -1.375  -2.984
  780    HE1  PHE 103           HE1      PHE 103  16.538  -2.061   1.789
  781    HE2  PHE 103           HE2      PHE 103  17.657  -2.510  -2.290
  782    HZ   PHE 103           HZ       PHE 103  18.131  -2.856   0.097
  783    H    GLY 104           HN       GLY 104  13.841  -3.518  -1.243
  784   1HA   GLY 104           HA1      GLY 104  13.903  -3.847   1.529
  785   2HA   GLY 104           HA2      GLY 104  12.382  -4.579   1.033
  786    H    GLY 105           HN       GLY 105  12.940  -5.867  -1.259
  787   1HA   GLY 105           HA1      GLY 105  13.806  -7.953  -1.963
  788   2HA   GLY 105           HA2      GLY 105  15.364  -7.250  -1.541
  789    H    GLY 106           HN       GLY 106  16.351  -8.941  -0.491
  790   1HA   GLY 106           HA1      GLY 106  16.448  -9.563   2.022
  791   2HA   GLY 106           HA2      GLY 106  14.829 -10.190   1.757
  792    H    THR 107           HN       THR 107  18.218 -10.611   1.004
  793    HA   THR 107           HA       THR 107  17.792 -13.517   0.756
  794    HB   THR 107           HB       THR 107  19.225 -12.008  -1.514
  795    HG1  THR 107           HG1      THR 107  17.100 -11.438  -1.612
  796   1HG2  THR 107          HG23      THR 107  18.987 -14.775  -0.785
  797   2HG2  THR 107          HG21      THR 107  17.846 -14.527  -2.104
  798   3HG2  THR 107          HG22      THR 107  19.552 -14.154  -2.334
  799    H    LYS 108           HN       LYS 108  19.231 -14.179   2.247
  800    HA   LYS 108           HA       LYS 108  21.740 -12.697   2.634
  801   1HB   LYS 108           HB2      LYS 108  20.238 -14.855   4.059
  802   2HB   LYS 108           HB1      LYS 108  21.985 -14.877   4.262
  803   1HG   LYS 108           HG1      LYS 108  20.331 -12.366   4.642
  804   2HG   LYS 108           HG2      LYS 108  20.684 -13.472   5.963
  805   1HD   LYS 108           HD1      LYS 108  22.985 -12.551   4.275
  806   2HD   LYS 108           HD2      LYS 108  22.289 -11.394   5.403
  807   1HE   LYS 108           HE1      LYS 108  23.462 -14.115   6.043
  808   2HE   LYS 108           HE2      LYS 108  24.041 -12.543   6.585
  809   1HZ   LYS 108           HZ1      LYS 108  22.522 -14.070   8.079
  810   2HZ   LYS 108           HZ2      LYS 108  22.435 -12.376   8.146
  811    H    LEU 109           HN       LEU 109  23.059 -13.020   0.918
  812    HA   LEU 109           HA       LEU 109  23.621 -15.779   0.001
  813   1HB   LEU 109           HB2      LEU 109  23.593 -13.240  -1.231
  814   2HB   LEU 109           HB1      LEU 109  25.307 -13.601  -1.082
  815    HG   LEU 109           HG       LEU 109  24.000 -15.997  -1.944
  816   1HD1  LEU 109          HD12      LEU 109  23.299 -13.531  -3.580
  817   2HD1  LEU 109          HD13      LEU 109  23.017 -15.195  -4.080
  818   3HD1  LEU 109          HD11      LEU 109  22.150 -14.533  -2.698
  819   1HD2  LEU 109          HD21      LEU 109  26.073 -14.091  -2.890
  820   2HD2  LEU 109          HD22      LEU 109  26.139 -15.844  -2.757
  821   3HD2  LEU 109          HD23      LEU 109  25.338 -15.095  -4.135
  822    H    GLU 110           HN       GLU 110  24.626 -16.497   1.980
  823    HA   GLU 110           HA       GLU 110  27.341 -15.310   2.403
  824   1HB   GLU 110           HB2      GLU 110  25.247 -15.649   4.236
  825   2HB   GLU 110           HB1      GLU 110  26.315 -17.000   4.590
  826   1HG   GLU 110           HG1      GLU 110  27.223 -15.280   5.919
  827   2HG   GLU 110           HG2      GLU 110  28.220 -15.194   4.470
  828    H    ILE 111           HN       ILE 111  27.452 -17.018   0.436
  829    HA   ILE 111           HA       ILE 111  28.393 -19.027  -0.306
  830    HB   ILE 111           HB       ILE 111  29.898 -17.979   1.828
  831   1HG1  ILE 111          HG11      ILE 111  30.996 -20.352   0.405
  832   2HG1  ILE 111          HG12      ILE 111  30.408 -19.036  -0.604
  833   1HG2  ILE 111          HG23      ILE 111  28.869 -20.012   3.121
  834   2HG2  ILE 111          HG21      ILE 111  29.894 -21.009   2.097
  835   3HG2  ILE 111          HG22      ILE 111  30.617 -19.826   3.178
  836   1HD1  ILE 111          HD13      ILE 111  32.128 -18.342   1.754
  837   2HD1  ILE 111          HD11      ILE 111  32.905 -19.026   0.330
  838   3HD1  ILE 111          HD12      ILE 111  31.987 -17.529   0.197
  839    H    LYS 112           HN       LYS 112  28.812 -21.418   0.429
  840    HA   LYS 112           HA       LYS 112  26.189 -22.444   1.215
  841   1HB   LYS 112           HB2      LYS 112  27.858 -23.416  -0.556
  842   2HB   LYS 112           HB1      LYS 112  28.716 -24.094   0.821
  843   1HG   LYS 112           HG1      LYS 112  27.231 -25.826   0.195
  844   2HG   LYS 112           HG2      LYS 112  26.400 -25.043   1.533
  845   1HD   LYS 112           HD1      LYS 112  24.654 -24.996   0.039
  846   2HD   LYS 112           HD2      LYS 112  25.462 -23.536  -0.513
  847   1HE   LYS 112           HE1      LYS 112  26.839 -25.230  -2.011
  848   2HE   LYS 112           HE2      LYS 112  25.443 -26.270  -1.752
  849   1HZ   LYS 112           HZ1      LYS 112  24.628 -25.166  -3.504
  850   2HZ   LYS 112           HZ2      LYS 112  24.273 -23.943  -2.376
  851    NH1  ARG 113           NH2      ARG 113  24.997 -20.003   7.515
  852    NH2  ARG 113           NH1      ARG 113  23.410 -18.447   7.031
  853    H    ARG 113           HN       ARG 113  25.718 -23.720   2.997
  854    HA   ARG 113           HA       ARG 113  27.734 -24.288   5.029
  855   1HB   ARG 113           HB2      ARG 113  26.494 -22.903   6.785
  856   2HB   ARG 113           HB1      ARG 113  27.340 -21.943   5.578
  857   1HG   ARG 113           HG1      ARG 113  24.742 -22.507   4.532
  858   2HG   ARG 113           HG2      ARG 113  24.523 -21.970   6.191
  859   1HD   ARG 113           HD1      ARG 113  26.397 -20.168   5.328
  860   2HD   ARG 113           HD2      ARG 113  25.515 -20.465   3.834
  861    HE   ARG 113           HE       ARG 113  23.694 -19.291   4.758
  862   1HH1  ARG 113          HH21      ARG 113  25.635 -20.702   7.193
  863   2HH1  ARG 113          HH22      ARG 113  24.933 -19.794   8.489
  864   1HH2  ARG 113          HH11      ARG 113  22.855 -17.976   6.348
  865   2HH2  ARG 113          HH12      ARG 113  23.318 -18.215   7.998
   
  Start of MODEL           8
 Raw file had  865 H/Q atoms
  Start of MODEL    8
    1   1H    ASP   1           HT2      ASP   1   1.063  -0.031  -0.139
    2   2H    ASP   1           HT3      ASP   1   2.401  -0.899   0.445
    3   3H    ASP   1           HT1      ASP   1   2.396   0.798   0.511
    4    HA   ASP   1           HA       ASP   1   3.609   0.638  -1.349
    5   1HB   ASP   1           HB2      ASP   1   2.948  -1.463  -2.945
    6   2HB   ASP   1           HB1      ASP   1   4.077  -1.642  -1.603
    7    H    VAL   2           HN       VAL   2   3.189   0.642  -3.776
    8    HA   VAL   2           HA       VAL   2   0.948   2.384  -4.140
    9    HB   VAL   2           HB       VAL   2   2.867   1.056  -6.103
   10   1HG1  VAL   2          HG11      VAL   2   0.712   3.138  -6.614
   11   2HG1  VAL   2          HG12      VAL   2   1.985   2.728  -7.759
   12   3HG1  VAL   2          HG13      VAL   2   0.788   1.520  -7.305
   13   1HG2  VAL   2          HG23      VAL   2   2.618   3.828  -4.897
   14   2HG2  VAL   2          HG21      VAL   2   3.959   2.699  -4.718
   15   3HG2  VAL   2          HG22      VAL   2   3.661   3.475  -6.270
   16    H    VAL   3           HN       VAL   3  -1.091   1.839  -4.460
   17    HA   VAL   3           HA       VAL   3  -1.929  -0.889  -4.838
   18    HB   VAL   3           HB       VAL   3  -3.462   1.729  -5.235
   19   1HG1  VAL   3          HG12      VAL   3  -4.304  -1.168  -5.042
   20   2HG1  VAL   3          HG13      VAL   3  -5.408   0.121  -4.575
   21   3HG1  VAL   3          HG11      VAL   3  -4.797   0.041  -6.224
   22   1HG2  VAL   3          HG23      VAL   3  -2.429   1.413  -2.961
   23   2HG2  VAL   3          HG21      VAL   3  -4.189   1.421  -2.917
   24   3HG2  VAL   3          HG22      VAL   3  -3.312  -0.102  -2.810
   25    H    MET   4           HN       MET   4  -2.942  -1.830  -6.653
   26    HA   MET   4           HA       MET   4  -2.551  -0.426  -9.227
   27   1HB   MET   4           HB2      MET   4  -1.563  -3.146  -8.320
   28   2HB   MET   4           HB1      MET   4  -1.972  -2.911 -10.014
   29   1HG   MET   4           HG1      MET   4  -0.433  -1.006 -10.131
   30   2HG   MET   4           HG2      MET   4  -0.052  -1.186  -8.440
   31   1HE   MET   4           HE3      MET   4  -0.166  -2.485 -11.790
   32   2HE   MET   4           HE1      MET   4   1.548  -2.147 -12.033
   33   3HE   MET   4           HE2      MET   4   0.984  -3.814 -11.933
   34    H    THR   5           HN       THR   5  -3.494  -2.133 -10.896
   35    HA   THR   5           HA       THR   5  -5.977  -3.401 -10.013
   36    HB   THR   5           HB       THR   5  -6.094  -1.056 -12.001
   37    HG1  THR   5           HG1      THR   5  -6.413  -1.320  -9.208
   38   1HG2  THR   5          HG22      THR   5  -8.156  -2.729 -10.466
   39   2HG2  THR   5          HG23      THR   5  -8.565  -1.215 -11.267
   40   3HG2  THR   5          HG21      THR   5  -8.020  -2.595 -12.216
   41    H    GLN   6           HN       GLN   6  -6.907  -4.721 -11.647
   42    HA   GLN   6           HA       GLN   6  -5.387  -4.899 -14.197
   43   1HB   GLN   6           HB2      GLN   6  -5.498  -6.900 -11.987
   44   2HB   GLN   6           HB1      GLN   6  -5.756  -7.565 -13.597
   45   1HG   GLN   6           HG1      GLN   6  -3.550  -5.659 -13.590
   46   2HG   GLN   6           HG2      GLN   6  -3.282  -6.939 -12.412
   47   1HE2  GLN   6          HE22      GLN   6  -3.553  -9.499 -15.074
   48   2HE2  GLN   6          HE21      GLN   6  -4.291  -9.200 -13.576
   49    H    THR   7           HN       THR   7  -6.493  -5.852 -15.893
   50    HA   THR   7           HA       THR   7  -9.208  -6.908 -15.551
   51    HB   THR   7           HB       THR   7  -9.691  -4.865 -17.458
   52    HG1  THR   7           HG1      THR   7  -8.842  -3.207 -15.643
   53   1HG2  THR   7          HG21      THR   7 -11.053  -5.568 -15.298
   54   2HG2  THR   7          HG22      THR   7 -10.035  -4.404 -14.456
   55   3HG2  THR   7          HG23      THR   7 -11.099  -3.868 -15.752
   56    HA   PRO   8           HA       PRO   8 -10.947  -6.569 -17.278
   57   1HB   PRO   8           HB2      PRO   8 -12.028  -8.869 -18.590
   58   2HB   PRO   8           HB1      PRO   8 -12.094  -7.206 -19.176
   59   1HG   PRO   8           HG1      PRO   8 -10.516  -9.410 -20.217
   60   2HG   PRO   8           HG2      PRO   8 -10.661  -7.776 -20.864
   61   1HD   PRO   8           HD1      PRO   8  -8.430  -8.932 -19.410
   62   2HD   PRO   8           HD2      PRO   8  -8.550  -7.313 -20.123
   63    H    LEU   9           HN       LEU   9 -12.658  -8.153 -16.281
   64    HA   LEU   9           HA       LEU   9 -11.336  -9.556 -14.131
   65   1HB   LEU   9           HB2      LEU   9 -14.252  -9.847 -14.985
   66   2HB   LEU   9           HB1      LEU   9 -13.592 -10.066 -13.369
   67    HG   LEU   9           HG       LEU   9 -13.766  -7.458 -14.920
   68   1HD1  LEU   9          HD12      LEU   9 -15.860  -8.253 -13.828
   69   2HD1  LEU   9          HD13      LEU   9 -15.003  -8.354 -12.293
   70   3HD1  LEU   9          HD11      LEU   9 -15.241  -6.791 -13.068
   71   1HD2  LEU   9          HD22      LEU   9 -12.386  -8.175 -12.317
   72   2HD2  LEU   9          HD23      LEU   9 -11.691  -7.366 -13.720
   73   3HD2  LEU   9          HD21      LEU   9 -12.856  -6.523 -12.703
   74    H    SER  10           HN       SER  10 -12.904 -10.568 -17.105
   75    HA   SER  10           HA       SER  10 -11.667 -13.257 -16.775
   76   1HB   SER  10           HB2      SER  10 -14.087 -13.413 -16.050
   77   2HB   SER  10           HB1      SER  10 -14.577 -12.780 -17.634
   78    HG   SER  10           HG       SER  10 -14.203 -14.680 -18.447
   79    H    LEU  11           HN       LEU  11 -11.145 -14.268 -18.713
   80    HA   LEU  11           HA       LEU  11 -11.676 -12.693 -21.193
   81   1HB   LEU  11           HB2      LEU  11  -9.332 -12.350 -20.101
   82   2HB   LEU  11           HB1      LEU  11  -8.993 -14.001 -20.602
   83    HG   LEU  11           HG       LEU  11  -9.894 -13.145 -22.947
   84   1HD1  LEU  11          HD11      LEU  11 -10.464 -10.886 -21.805
   85   2HD1  LEU  11          HD12      LEU  11  -8.731 -10.576 -21.855
   86   3HD1  LEU  11          HD13      LEU  11  -9.626 -10.821 -23.351
   87   1HD2  LEU  11          HD23      LEU  11  -7.572 -13.934 -22.408
   88   2HD2  LEU  11          HD21      LEU  11  -7.590 -12.618 -23.578
   89   3HD2  LEU  11          HD22      LEU  11  -7.170 -12.298 -21.898
   90    HA   PRO  12           HA       PRO  12 -12.678 -17.113 -21.869
   91   1HB   PRO  12           HB2      PRO  12 -14.784 -16.279 -23.629
   92   2HB   PRO  12           HB1      PRO  12 -14.971 -16.922 -21.998
   93   1HG   PRO  12           HG1      PRO  12 -15.357 -14.188 -22.903
   94   2HG   PRO  12           HG2      PRO  12 -15.646 -14.852 -21.295
   95   1HD   PRO  12           HD1      PRO  12 -13.478 -13.141 -22.135
   96   2HD   PRO  12           HD2      PRO  12 -13.762 -13.817 -20.520
   97    H    VAL  13           HN       VAL  13 -10.963 -17.584 -23.170
   98    HA   VAL  13           HA       VAL  13 -11.134 -16.655 -26.014
   99    HB   VAL  13           HB       VAL  13  -8.642 -16.768 -26.059
  100   1HG1  VAL  13          HG12      VAL  13 -10.138 -14.786 -24.980
  101   2HG1  VAL  13          HG13      VAL  13  -9.135 -15.180 -23.588
  102   3HG1  VAL  13          HG11      VAL  13  -8.385 -14.692 -25.105
  103   1HG2  VAL  13          HG22      VAL  13  -9.114 -17.865 -23.300
  104   2HG2  VAL  13          HG23      VAL  13  -7.972 -18.398 -24.528
  105   3HG2  VAL  13          HG21      VAL  13  -7.648 -16.939 -23.598
  106    H    SER  14           HN       SER  14  -9.215 -18.186 -27.142
  107    HA   SER  14           HA       SER  14 -10.107 -20.993 -26.614
  108   1HB   SER  14           HB2      SER  14  -9.590 -19.707 -29.351
  109   2HB   SER  14           HB1      SER  14 -10.206 -21.347 -29.063
  110    HG   SER  14           HG       SER  14 -11.725 -19.910 -27.604
  111    H    LEU  15           HN       LEU  15  -8.579 -22.601 -26.959
  112    HA   LEU  15           HA       LEU  15  -5.846 -21.846 -26.512
  113   1HB   LEU  15           HB2      LEU  15  -6.946 -24.539 -27.441
  114   2HB   LEU  15           HB1      LEU  15  -5.396 -24.263 -26.656
  115    HG   LEU  15           HG       LEU  15  -8.163 -23.951 -25.456
  116   1HD1  LEU  15          HD11      LEU  15  -5.727 -25.657 -24.902
  117   2HD1  LEU  15          HD12      LEU  15  -7.000 -25.445 -23.706
  118   3HD1  LEU  15          HD13      LEU  15  -7.366 -26.190 -25.259
  119   1HD2  LEU  15          HD22      LEU  15  -5.503 -22.831 -24.572
  120   2HD2  LEU  15          HD23      LEU  15  -7.077 -22.044 -24.586
  121   3HD2  LEU  15          HD21      LEU  15  -6.718 -23.272 -23.379
  122    H    GLY  16           HN       GLY  16  -5.271 -20.530 -28.186
  123   1HA   GLY  16           HA1      GLY  16  -3.656 -21.188 -30.179
  124   2HA   GLY  16           HA2      GLY  16  -5.172 -21.681 -30.929
  125    H    ASP  17           HN       ASP  17  -6.130 -19.250 -29.091
  126    HA   ASP  17           HA       ASP  17  -6.019 -17.323 -31.324
  127   1HB   ASP  17           HB2      ASP  17  -8.030 -18.025 -29.633
  128   2HB   ASP  17           HB1      ASP  17  -7.366 -16.679 -28.714
  129    H    GLN  18           HN       GLN  18  -6.381 -15.024 -29.564
  130    HA   GLN  18           HA       GLN  18  -3.595 -14.781 -28.489
  131   1HB   GLN  18           HB2      GLN  18  -5.229 -12.907 -30.236
  132   2HB   GLN  18           HB1      GLN  18  -3.936 -12.273 -29.223
  133   1HG   GLN  18           HG1      GLN  18  -2.476 -14.150 -30.283
  134   2HG   GLN  18           HG2      GLN  18  -3.736 -14.247 -31.506
  135   1HE2  GLN  18          HE22      GLN  18  -1.722 -10.667 -31.217
  136   2HE2  GLN  18          HE21      GLN  18  -2.083 -11.526 -29.798
  137    H    ALA  19           HN       ALA  19  -3.321 -13.260 -26.761
  138    HA   ALA  19           HA       ALA  19  -5.869 -12.570 -25.347
  139   1HB   ALA  19           HB2      ALA  19  -3.408 -14.035 -24.380
  140   2HB   ALA  19           HB3      ALA  19  -4.300 -13.041 -23.232
  141   3HB   ALA  19           HB1      ALA  19  -5.101 -14.382 -24.045
  142    H    SER  20           HN       SER  20  -5.602 -10.906 -23.684
  143    HA   SER  20           HA       SER  20  -3.233  -9.216 -23.689
  144   1HB   SER  20           HB2      SER  20  -4.488  -7.188 -24.624
  145   2HB   SER  20           HB1      SER  20  -4.241  -8.460 -25.837
  146    HG   SER  20           HG       SER  20  -6.541  -7.975 -24.248
  147    H    ILE  21           HN       ILE  21  -3.314  -9.350 -21.483
  148    HA   ILE  21           HA       ILE  21  -5.803  -8.535 -20.096
  149    HB   ILE  21           HB       ILE  21  -3.088  -9.423 -19.031
  150   1HG1  ILE  21          HG11      ILE  21  -5.102 -11.318 -18.437
  151   2HG1  ILE  21          HG12      ILE  21  -5.338 -10.895 -20.128
  152   1HG2  ILE  21          HG21      ILE  21  -5.767  -8.803 -17.737
  153   2HG2  ILE  21          HG22      ILE  21  -4.600  -9.855 -16.943
  154   3HG2  ILE  21          HG23      ILE  21  -4.182  -8.181 -17.291
  155   1HD1  ILE  21          HD13      ILE  21  -2.913 -11.314 -20.541
  156   2HD1  ILE  21          HD11      ILE  21  -2.734 -11.805 -18.859
  157   3HD1  ILE  21          HD12      ILE  21  -3.740 -12.752 -19.949
  158    H    SER  22           HN       SER  22  -6.100  -6.602 -19.329
  159    HA   SER  22           HA       SER  22  -4.022  -4.548 -19.674
  160   1HB   SER  22           HB2      SER  22  -6.983  -4.489 -18.914
  161   2HB   SER  22           HB1      SER  22  -5.977  -3.025 -18.923
  162    HG   SER  22           HG       SER  22  -7.032  -3.583 -20.980
  163    H    CYS  23           HN       CYS  23  -3.532  -3.012 -18.016
  164    HA   CYS  23           HA       CYS  23  -4.151  -3.620 -15.223
  165   1HB   CYS  23           HB2      CYS  23  -2.393  -5.210 -15.417
  166   2HB   CYS  23           HB1      CYS  23  -1.456  -4.186 -16.464
  167    NH1  ARG  24           NH2      ARG  24  -6.539   2.970 -18.260
  168    NH2  ARG  24           NH1      ARG  24  -7.508   3.136 -16.211
  169    H    ARG  24           HN       ARG  24  -3.938  -1.853 -13.978
  170    HA   ARG  24           HA       ARG  24  -2.316   0.422 -15.016
  171   1HB   ARG  24           HB2      ARG  24  -5.262   0.279 -14.550
  172   2HB   ARG  24           HB1      ARG  24  -4.479   1.703 -13.876
  173   1HG   ARG  24           HG1      ARG  24  -4.686   2.565 -15.975
  174   2HG   ARG  24           HG2      ARG  24  -3.304   1.552 -16.362
  175   1HD   ARG  24           HD1      ARG  24  -4.832   0.865 -17.994
  176   2HD   ARG  24           HD2      ARG  24  -5.140  -0.315 -16.723
  177    HE   ARG  24           HE       ARG  24  -7.318   0.572 -16.654
  178   1HH1  ARG  24          HH21      ARG  24  -6.064   2.412 -18.939
  179   2HH1  ARG  24          HH22      ARG  24  -6.745   3.928 -18.456
  180   1HH2  ARG  24          HH11      ARG  24  -7.760   2.702 -15.347
  181   2HH2  ARG  24          HH12      ARG  24  -7.735   4.095 -16.373
  182    H    SER  25           HN       SER  25  -1.402   1.705 -13.446
  183    HA   SER  25           HA       SER  25  -1.694   0.665 -10.659
  184   1HB   SER  25           HB2      SER  25   0.651   2.244 -11.829
  185   2HB   SER  25           HB1      SER  25   0.629   1.325 -10.310
  186    HG   SER  25           HG       SER  25   1.455   0.257 -12.345
  187    H    SER  26           HN       SER  26  -1.895   2.077  -8.945
  188    HA   SER  26           HA       SER  26  -3.434   4.399  -9.279
  189   1HB   SER  26           HB2      SER  26  -3.098   3.184  -7.091
  190   2HB   SER  26           HB1      SER  26  -1.451   3.836  -7.009
  191    HG   SER  26           HG       SER  26  -2.364   5.559  -6.225
  192    H    GLN  27           HN       GLN  27   0.075   4.090  -9.108
  193    HA   GLN  27           HA       GLN  27   0.273   6.899 -10.075
  194   1HB   GLN  27           HB2      GLN  27   0.838   6.649  -7.599
  195   2HB   GLN  27           HB1      GLN  27   2.147   5.566  -8.064
  196   1HG   GLN  27           HG1      GLN  27   3.394   7.268  -9.034
  197   2HG   GLN  27           HG2      GLN  27   1.974   8.241  -9.405
  198   1HE2  GLN  27          HE22      GLN  27   1.742   9.498  -5.996
  199   2HE2  GLN  27          HE21      GLN  27   0.734   8.904  -7.225
  200    H    SER  28           HN       SER  28   2.467   7.329 -11.044
  201    HA   SER  28           HA       SER  28   3.018   5.384 -13.072
  202   1HB   SER  28           HB2      SER  28   3.526   7.877 -13.236
  203   2HB   SER  28           HB1      SER  28   4.879   7.621 -12.116
  204    HG   SER  28           HG       SER  28   5.520   7.374 -14.317
  205    H    LEU  29           HN       LEU  29   4.508   3.800 -13.238
  206    HA   LEU  29           HA       LEU  29   5.931   3.071 -10.741
  207   1HB   LEU  29           HB2      LEU  29   5.503   1.573 -13.360
  208   2HB   LEU  29           HB1      LEU  29   6.327   0.902 -11.967
  209    HG   LEU  29           HG       LEU  29   3.447   1.854 -12.029
  210   1HD1  LEU  29          HD11      LEU  29   4.718  -0.902 -11.832
  211   2HD1  LEU  29          HD12      LEU  29   3.002  -0.586 -11.595
  212   3HD1  LEU  29          HD13      LEU  29   3.742  -0.294 -13.166
  213   1HD2  LEU  29          HD21      LEU  29   5.274   0.910  -9.823
  214   2HD2  LEU  29          HD22      LEU  29   4.153   2.269  -9.818
  215   3HD2  LEU  29          HD23      LEU  29   3.540   0.622  -9.715
  216    H    VAL  30           HN       VAL  30   6.799   5.234 -12.674
  217    HA   VAL  30           HA       VAL  30   9.351   4.117 -13.675
  218    HB   VAL  30           HB       VAL  30   8.198   6.946 -13.838
  219   1HG1  VAL  30          HG12      VAL  30  10.652   5.620 -15.019
  220   2HG1  VAL  30          HG13      VAL  30   9.915   7.024 -15.785
  221   3HG1  VAL  30          HG11      VAL  30  10.550   7.148 -14.148
  222   1HG2  VAL  30          HG22      VAL  30   6.850   5.238 -15.045
  223   2HG2  VAL  30          HG23      VAL  30   7.658   6.324 -16.172
  224   3HG2  VAL  30          HG21      VAL  30   8.298   4.707 -15.895
  225    H    HIS  31           HN       HIS  31  11.312   4.572 -12.865
  226    HA   HIS  31           HA       HIS  31  11.398   5.707 -10.148
  227   1HB   HIS  31           HB2      HIS  31  12.618   3.560 -11.167
  228   2HB   HIS  31           HB1      HIS  31  13.827   4.739 -11.657
  229    HD2  HIS  31           HD2      HIS  31  12.237   3.302  -8.355
  230    HE1  HIS  31           HE1      HIS  31  15.702   5.348  -7.388
  231    H    SER  32           HN       SER  32  14.335   6.335 -10.718
  232    HA   SER  32           HA       SER  32  13.987   9.169 -11.028
  233   1HB   SER  32           HB2      SER  32  16.577   9.098 -11.159
  234   2HB   SER  32           HB1      SER  32  15.877   8.329  -9.723
  235    HG   SER  32           HG       SER  32  16.797   6.577 -10.426
  236    H    ASN  33           HN       ASN  33  16.138   7.194 -13.099
  237    HA   ASN  33           HA       ASN  33  14.973   8.660 -15.432
  238   1HB   ASN  33           HB2      ASN  33  17.460   8.646 -16.288
  239   2HB   ASN  33           HB1      ASN  33  17.011   9.837 -15.071
  240   1HD2  ASN  33          HD22      ASN  33  18.927   8.309 -12.487
  241   2HD2  ASN  33          HD21      ASN  33  17.652   9.379 -12.812
  242    H    GLY  34           HN       GLY  34  14.342   7.378 -16.983
  243   1HA   GLY  34           HA1      GLY  34  13.981   5.420 -18.228
  244   2HA   GLY  34           HA2      GLY  34  15.737   5.362 -18.291
  245    H    ASN  35           HN       ASN  35  14.256   5.149 -15.189
  246    HA   ASN  35           HA       ASN  35  14.989   2.257 -15.122
  247   1HB   ASN  35           HB2      ASN  35  15.058   4.514 -13.149
  248   2HB   ASN  35           HB1      ASN  35  14.657   2.925 -12.504
  249   1HD2  ASN  35          HD22      ASN  35  17.899   1.580 -13.076
  250   2HD2  ASN  35          HD21      ASN  35  16.272   1.193 -12.787
  251    H    THR  36           HN       THR  36  13.079   1.427 -15.929
  252    HA   THR  36           HA       THR  36  10.590   1.989 -14.388
  253    HB   THR  36           HB       THR  36  11.050   0.561 -17.076
  254    HG1  THR  36           HG1      THR  36   9.514   2.835 -16.762
  255   1HG2  THR  36          HG22      THR  36   8.555   1.225 -15.426
  256   2HG2  THR  36          HG23      THR  36   8.470   1.046 -17.176
  257   3HG2  THR  36          HG21      THR  36   8.955  -0.319 -16.174
  258    OH   TYR  37           OH       TYR  37  15.638   0.165 -10.887
  259    H    TYR  37           HN       TYR  37   9.310   0.264 -13.597
  260    HA   TYR  37           HA       TYR  37  10.657  -2.389 -13.459
  261   1HB   TYR  37           HB2      TYR  37   9.584  -0.773 -11.101
  262   2HB   TYR  37           HB1      TYR  37  10.096  -2.453 -10.992
  263    HD1  TYR  37           HD2      TYR  37  12.488  -3.044 -11.381
  264    HD2  TYR  37           HD1      TYR  37  11.208   1.011 -11.262
  265    HE1  TYR  37           HE2      TYR  37  14.815  -2.317 -11.117
  266    HE2  TYR  37           HE1      TYR  37  13.537   1.734 -10.995
  267    HH   TYR  37           HH       TYR  37  15.698   0.667 -10.070
  268    H    LEU  38           HN       LEU  38   9.325  -4.086 -13.535
  269    HA   LEU  38           HA       LEU  38   6.568  -4.069 -12.730
  270   1HB   LEU  38           HB2      LEU  38   6.388  -2.653 -14.807
  271   2HB   LEU  38           HB1      LEU  38   7.126  -3.948 -15.739
  272    HG   LEU  38           HG       LEU  38   5.199  -5.441 -14.880
  273   1HD1  LEU  38          HD12      LEU  38   4.612  -3.569 -13.133
  274   2HD1  LEU  38          HD13      LEU  38   3.761  -2.818 -14.479
  275   3HD1  LEU  38          HD11      LEU  38   3.296  -4.426 -13.926
  276   1HD2  LEU  38          HD22      LEU  38   4.790  -3.104 -16.762
  277   2HD2  LEU  38          HD23      LEU  38   5.192  -4.769 -17.179
  278   3HD2  LEU  38          HD21      LEU  38   3.586  -4.378 -16.566
  279    H    ASN  39           HN       ASN  39   5.598  -6.125 -12.961
  280    HA   ASN  39           HA       ASN  39   7.084  -8.252 -14.340
  281   1HB   ASN  39           HB2      ASN  39   8.325  -8.689 -12.437
  282   2HB   ASN  39           HB1      ASN  39   7.248  -7.752 -11.410
  283   1HD2  ASN  39          HD22      ASN  39   6.147 -10.790 -10.019
  284   2HD2  ASN  39          HD21      ASN  39   6.832  -9.261  -9.752
  285    CH2  TRP  40           CH2      TRP  40  -1.162  -7.845 -17.502
  286    H    TRP  40           HN       TRP  40   5.589  -9.467 -15.266
  287    HA   TRP  40           HA       TRP  40   2.823  -9.431 -14.262
  288   1HB   TRP  40           HB2      TRP  40   4.225 -10.405 -16.751
  289   2HB   TRP  40           HB1      TRP  40   2.614 -11.010 -16.391
  290    HD1  TRP  40           HD1      TRP  40   4.471  -7.677 -17.122
  291    HE1  TRP  40           HE1      TRP  40   2.665  -6.042 -17.804
  292    HE3  TRP  40           HE3      TRP  40   0.501 -10.536 -16.353
  293    HZ2  TRP  40           HZ2      TRP  40  -0.265  -5.991 -18.078
  294    HZ3  TRP  40           HZ3      TRP  40  -1.783  -9.782 -16.855
  295    HH2  TRP  40           HH2      TRP  40  -2.162  -7.524 -17.737
  296    OH   TYR  41           OH       TYR  41   6.021 -14.227  -7.874
  297    H    TYR  41           HN       TYR  41   1.640 -11.232 -13.724
  298    HA   TYR  41           HA       TYR  41   3.233 -13.676 -13.030
  299   1HB   TYR  41           HB2      TYR  41   1.591 -11.870 -11.385
  300   2HB   TYR  41           HB1      TYR  41   0.990 -13.520 -11.295
  301    HD1  TYR  41           HD1      TYR  41   4.555 -12.614 -11.837
  302    HD2  TYR  41           HD2      TYR  41   1.657 -13.987  -9.041
  303    HE1  TYR  41           HE1      TYR  41   6.343 -13.190 -10.266
  304    HE2  TYR  41           HE2      TYR  41   3.450 -14.570  -7.473
  305    HH   TYR  41           HH       TYR  41   6.436 -13.407  -7.597
  306    H    LEU  42           HN       LEU  42   2.059 -15.654 -13.043
  307    HA   LEU  42           HA       LEU  42  -0.647 -15.682 -14.214
  308   1HB   LEU  42           HB2      LEU  42   0.486 -15.716 -16.295
  309   2HB   LEU  42           HB1      LEU  42   1.884 -16.547 -15.634
  310    HG   LEU  42           HG       LEU  42   0.548 -18.633 -15.437
  311   1HD1  LEU  42          HD12      LEU  42  -1.621 -16.751 -15.972
  312   2HD1  LEU  42          HD13      LEU  42  -1.669 -18.124 -17.074
  313   3HD1  LEU  42          HD11      LEU  42  -1.705 -18.390 -15.335
  314   1HD2  LEU  42          HD21      LEU  42   0.430 -17.341 -18.183
  315   2HD2  LEU  42          HD22      LEU  42   1.817 -18.192 -17.512
  316   3HD2  LEU  42          HD23      LEU  42   0.332 -19.070 -17.866
  317    H    GLN  43           HN       GLN  43  -1.710 -17.080 -12.983
  318    HA   GLN  43           HA       GLN  43  -0.220 -19.427 -11.875
  319   1HB   GLN  43           HB2      GLN  43  -1.385 -17.574 -10.376
  320   2HB   GLN  43           HB1      GLN  43  -2.868 -18.419 -10.803
  321   1HG   GLN  43           HG1      GLN  43  -1.641 -20.573 -10.046
  322   2HG   GLN  43           HG2      GLN  43  -0.471 -19.490  -9.297
  323   1HE2  GLN  43          HE22      GLN  43  -4.316 -19.522  -7.832
  324   2HE2  GLN  43          HE21      GLN  43  -4.045 -19.934  -9.457
  325    H    LYS  44           HN       LYS  44  -0.849 -21.406 -12.452
  326    HA   LYS  44           HA       LYS  44  -3.005 -21.708 -14.395
  327   1HB   LYS  44           HB2      LYS  44  -0.669 -23.084 -13.815
  328   2HB   LYS  44           HB1      LYS  44  -1.882 -24.149 -13.118
  329   1HG   LYS  44           HG1      LYS  44  -1.893 -24.937 -15.298
  330   2HG   LYS  44           HG2      LYS  44  -3.114 -23.678 -15.442
  331   1HD   LYS  44           HD1      LYS  44  -1.832 -22.528 -16.902
  332   2HD   LYS  44           HD2      LYS  44  -0.482 -22.518 -15.777
  333   1HE   LYS  44           HE1      LYS  44  -1.193 -24.828 -17.617
  334   2HE   LYS  44           HE2      LYS  44   0.092 -23.664 -17.912
  335   1HZ   LYS  44           HZ1      LYS  44   0.819 -24.414 -15.525
  336   2HZ   LYS  44           HZ2      LYS  44  -0.041 -25.822 -15.947
  337    H    ALA  45           HN       ALA  45  -4.646 -23.462 -14.098
  338    HA   ALA  45           HA       ALA  45  -6.415 -22.898 -12.007
  339   1HB   ALA  45           HB1      ALA  45  -6.996 -24.205 -14.064
  340   2HB   ALA  45           HB2      ALA  45  -6.053 -25.564 -13.459
  341   3HB   ALA  45           HB3      ALA  45  -7.510 -25.056 -12.612
  342    H    GLY  46           HN       GLY  46  -3.790 -25.236 -12.078
  343   1HA   GLY  46           HA1      GLY  46  -3.916 -25.421  -9.135
  344   2HA   GLY  46           HA2      GLY  46  -4.166 -26.934 -10.003
  345    H    GLN  47           HN       GLN  47  -1.974 -24.200 -10.598
  346    HA   GLN  47           HA       GLN  47   0.347 -25.976 -10.063
  347   1HB   GLN  47           HB2      GLN  47  -0.442 -25.900 -12.582
  348   2HB   GLN  47           HB1      GLN  47   0.264 -24.293 -12.582
  349   1HG   GLN  47           HG1      GLN  47   2.403 -25.334 -11.686
  350   2HG   GLN  47           HG2      GLN  47   1.677 -26.910 -11.992
  351   1HE2  GLN  47          HE22      GLN  47   2.513 -26.814 -15.395
  352   2HE2  GLN  47          HE21      GLN  47   2.106 -27.737 -14.030
  353    H    SER  48           HN       SER  48   2.358 -24.816  -9.888
  354    HA   SER  48           HA       SER  48   2.131 -22.416  -8.372
  355   1HB   SER  48           HB2      SER  48   4.660 -22.344  -8.643
  356   2HB   SER  48           HB1      SER  48   4.093 -23.968  -8.209
  357    HG   SER  48           HG       SER  48   4.283 -23.096 -10.898
  358    HA   PRO  49           HA       PRO  49   1.723 -19.409 -11.543
  359   1HB   PRO  49           HB2      PRO  49   2.818 -17.310  -9.907
  360   2HB   PRO  49           HB1      PRO  49   1.112 -17.678 -10.152
  361   1HG   PRO  49           HG1      PRO  49   2.731 -18.150  -7.782
  362   2HG   PRO  49           HG2      PRO  49   0.996 -18.394  -7.983
  363   1HD   PRO  49           HD1      PRO  49   3.043 -20.412  -7.838
  364   2HD   PRO  49           HD2      PRO  49   1.305 -20.653  -8.101
  365    H    LYS  50           HN       LYS  50   3.170 -19.470 -13.179
  366    HA   LYS  50           HA       LYS  50   6.055 -19.206 -12.580
  367   1HB   LYS  50           HB2      LYS  50   4.399 -20.058 -14.955
  368   2HB   LYS  50           HB1      LYS  50   6.039 -19.490 -15.249
  369   1HG   LYS  50           HG1      LYS  50   6.659 -21.132 -13.279
  370   2HG   LYS  50           HG2      LYS  50   5.121 -21.889 -13.678
  371   1HD   LYS  50           HD1      LYS  50   6.075 -21.704 -16.165
  372   2HD   LYS  50           HD2      LYS  50   7.622 -21.684 -15.325
  373   1HE   LYS  50           HE1      LYS  50   5.483 -23.775 -14.814
  374   2HE   LYS  50           HE2      LYS  50   6.786 -23.997 -15.976
  375   1HZ   LYS  50           HZ1      LYS  50   8.266 -24.357 -14.367
  376   2HZ   LYS  50           HZ2      LYS  50   7.660 -23.116 -13.376
  377    H    LEU  51           HN       LEU  51   7.236 -17.463 -12.964
  378    HA   LEU  51           HA       LEU  51   5.960 -14.944 -13.589
  379   1HB   LEU  51           HB2      LEU  51   7.857 -14.901 -12.102
  380   2HB   LEU  51           HB1      LEU  51   8.831 -15.883 -13.185
  381    HG   LEU  51           HG       LEU  51   8.721 -13.945 -14.857
  382   1HD1  LEU  51          HD13      LEU  51   7.557 -12.618 -12.386
  383   2HD1  LEU  51          HD11      LEU  51   8.242 -11.713 -13.732
  384   3HD1  LEU  51          HD12      LEU  51   6.823 -12.724 -13.983
  385   1HD2  LEU  51          HD21      LEU  51  10.297 -14.303 -12.469
  386   2HD2  LEU  51          HD22      LEU  51  10.791 -13.618 -14.013
  387   3HD2  LEU  51          HD23      LEU  51  10.098 -12.580 -12.770
  388    H    LEU  52           HN       LEU  52   5.581 -14.098 -15.526
  389    HA   LEU  52           HA       LEU  52   6.846 -15.341 -17.906
  390   1HB   LEU  52           HB2      LEU  52   4.561 -13.325 -17.626
  391   2HB   LEU  52           HB1      LEU  52   5.094 -14.022 -19.151
  392    HG   LEU  52           HG       LEU  52   4.261 -15.779 -16.835
  393   1HD1  LEU  52          HD13      LEU  52   2.552 -14.376 -18.898
  394   2HD1  LEU  52          HD11      LEU  52   2.036 -15.884 -18.154
  395   3HD1  LEU  52          HD12      LEU  52   2.310 -14.460 -17.157
  396   1HD2  LEU  52          HD21      LEU  52   4.583 -16.086 -19.831
  397   2HD2  LEU  52          HD22      LEU  52   5.377 -17.001 -18.554
  398   3HD2  LEU  52          HD23      LEU  52   3.664 -17.247 -18.879
  399    H    ILE  53           HN       ILE  53   5.729 -12.035 -17.750
  400    HA   ILE  53           HA       ILE  53   8.360 -11.132 -18.744
  401    HB   ILE  53           HB       ILE  53   5.834  -9.555 -18.161
  402   1HG1  ILE  53          HG11      ILE  53   5.347 -11.308 -19.784
  403   2HG1  ILE  53          HG12      ILE  53   5.335  -9.733 -20.566
  404   1HG2  ILE  53          HG23      ILE  53   8.499  -8.868 -19.178
  405   2HG2  ILE  53          HG21      ILE  53   7.228  -8.364 -20.291
  406   3HG2  ILE  53          HG22      ILE  53   7.220  -7.796 -18.621
  407   1HD1  ILE  53          HD11      ILE  53   7.904 -10.293 -20.942
  408   2HD1  ILE  53          HD12      ILE  53   7.331 -11.947 -20.784
  409   3HD1  ILE  53          HD13      ILE  53   6.679 -10.907 -22.047
  410    OH   TYR  54           OH       TYR  54  15.653 -10.210 -17.812
  411    H    TYR  54           HN       TYR  54   9.848 -10.369 -17.379
  412    HA   TYR  54           HA       TYR  54   8.918  -9.457 -14.688
  413   1HB   TYR  54           HB2      TYR  54  11.047 -10.198 -13.786
  414   2HB   TYR  54           HB1      TYR  54  10.474 -11.497 -14.824
  415    HD1  TYR  54           HD1      TYR  54  12.949  -8.800 -14.479
  416    HD2  TYR  54           HD2      TYR  54  11.569 -11.968 -16.956
  417    HE1  TYR  54           HE1      TYR  54  15.029  -8.695 -15.767
  418    HE2  TYR  54           HE2      TYR  54  13.654 -11.858 -18.249
  419    HH   TYR  54           HH       TYR  54  15.964 -11.107 -17.948
  420    H    LYS  55           HN       LYS  55   9.269  -8.039 -17.297
  421    HA   LYS  55           HA       LYS  55  10.197  -5.535 -16.236
  422   1HB   LYS  55           HB2      LYS  55  12.302  -7.148 -16.996
  423   2HB   LYS  55           HB1      LYS  55  11.958  -6.342 -18.520
  424   1HG   LYS  55           HG1      LYS  55  13.216  -4.632 -17.723
  425   2HG   LYS  55           HG2      LYS  55  11.843  -4.261 -16.686
  426   1HD   LYS  55           HD1      LYS  55  12.759  -5.466 -14.851
  427   2HD   LYS  55           HD2      LYS  55  13.913  -6.314 -15.875
  428   1HE   LYS  55           HE1      LYS  55  14.042  -3.320 -15.783
  429   2HE   LYS  55           HE2      LYS  55  14.664  -4.222 -14.406
  430   1HZ   LYS  55           HZ1      LYS  55  15.468  -5.061 -17.096
  431   2HZ   LYS  55           HZ2      LYS  55  16.181  -3.666 -16.434
  432    H    VAL  56           HN       VAL  56   9.557  -3.848 -17.591
  433    HA   VAL  56           HA       VAL  56   7.456  -4.221 -19.354
  434    HB   VAL  56           HB       VAL  56   9.631  -2.087 -19.336
  435   1HG1  VAL  56          HG13      VAL  56   7.301  -2.480 -21.190
  436   2HG1  VAL  56          HG11      VAL  56   7.677  -0.841 -20.665
  437   3HG1  VAL  56          HG12      VAL  56   8.886  -1.790 -21.524
  438   1HG2  VAL  56          HG23      VAL  56   6.735  -2.189 -18.413
  439   2HG2  VAL  56          HG21      VAL  56   8.160  -2.117 -17.382
  440   3HG2  VAL  56          HG22      VAL  56   7.730  -0.737 -18.387
  441    H    SER  57           HN       SER  57   7.431  -5.649 -20.917
  442    HA   SER  57           HA       SER  57   7.866  -6.695 -22.940
  443   1HB   SER  57           HB2      SER  57   8.197  -4.051 -23.483
  444   2HB   SER  57           HB1      SER  57   9.857  -4.597 -23.789
  445    HG   SER  57           HG       SER  57   7.576  -5.989 -24.742
  446    H    ASN  58           HN       ASN  58   8.996  -8.155 -21.444
  447    HA   ASN  58           HA       ASN  58  11.500  -8.962 -22.599
  448   1HB   ASN  58           HB2      ASN  58  12.889  -7.687 -21.285
  449   2HB   ASN  58           HB1      ASN  58  11.542  -7.132 -20.303
  450   1HD2  ASN  58          HD22      ASN  58  12.122  -9.451 -17.703
  451   2HD2  ASN  58          HD21      ASN  58  11.035  -8.326 -18.358
  452    NH1  ARG  59           NH2      ARG  59   7.500 -12.373 -26.603
  453    NH2  ARG  59           NH1      ARG  59   9.319 -11.012 -26.605
  454    H    ARG  59           HN       ARG  59  11.044 -11.049 -22.686
  455    HA   ARG  59           HA       ARG  59   9.377 -12.368 -20.694
  456   1HB   ARG  59           HB2      ARG  59  11.001 -13.392 -23.062
  457   2HB   ARG  59           HB1      ARG  59   9.944 -14.415 -22.098
  458   1HG   ARG  59           HG1      ARG  59   8.007 -13.047 -22.682
  459   2HG   ARG  59           HG2      ARG  59   9.034 -11.899 -23.535
  460   1HD   ARG  59           HD1      ARG  59   9.329 -14.724 -24.391
  461   2HD   ARG  59           HD2      ARG  59   7.770 -13.992 -24.753
  462    HE   ARG  59           HE       ARG  59  10.345 -13.241 -25.944
  463   1HH1  ARG  59          HH21      ARG  59   7.086 -13.248 -26.354
  464   2HH1  ARG  59          HH22      ARG  59   6.960 -11.688 -27.088
  465   1HH2  ARG  59          HH11      ARG  59  10.275 -10.861 -26.357
  466   2HH2  ARG  59          HH12      ARG  59   8.810 -10.302 -27.088
  467    H    PHE  60           HN       PHE  60   9.956 -13.739 -19.095
  468    HA   PHE  60           HA       PHE  60  12.648 -13.564 -18.068
  469   1HB   PHE  60           HB2      PHE  60  10.648 -13.870 -16.593
  470   2HB   PHE  60           HB1      PHE  60  10.358 -15.446 -17.314
  471    HD1  PHE  60           HD1      PHE  60  13.148 -13.548 -15.674
  472    HD2  PHE  60           HD2      PHE  60  11.237 -17.316 -16.220
  473    HE1  PHE  60           HE1      PHE  60  14.719 -14.576 -14.092
  474    HE2  PHE  60           HE2      PHE  60  12.813 -18.340 -14.639
  475    HZ   PHE  60           HZ       PHE  60  14.553 -16.972 -13.573
  476    H    SER  61           HN       SER  61  14.044 -15.413 -17.649
  477    HA   SER  61           HA       SER  61  14.943 -16.769 -19.853
  478   1HB   SER  61           HB2      SER  61  14.818 -18.093 -17.098
  479   2HB   SER  61           HB1      SER  61  16.094 -18.262 -18.322
  480    HG   SER  61           HG       SER  61  16.896 -16.641 -17.169
  481    H    GLY  62           HN       GLY  62  12.623 -18.198 -17.542
  482   1HA   GLY  62           HA1      GLY  62  12.078 -20.380 -19.463
  483   2HA   GLY  62           HA2      GLY  62  11.441 -20.268 -17.827
  484    H    VAL  63           HN       VAL  63  11.285 -18.246 -20.771
  485    HA   VAL  63           HA       VAL  63   8.324 -18.450 -20.660
  486    HB   VAL  63           HB       VAL  63   9.898 -15.836 -20.677
  487   1HG1  VAL  63          HG11      VAL  63   6.932 -16.413 -20.990
  488   2HG1  VAL  63          HG12      VAL  63   7.570 -14.819 -20.601
  489   3HG1  VAL  63          HG13      VAL  63   7.978 -15.580 -22.135
  490   1HG2  VAL  63          HG23      VAL  63   9.667 -16.921 -18.458
  491   2HG2  VAL  63          HG21      VAL  63   8.724 -15.441 -18.546
  492   3HG2  VAL  63          HG22      VAL  63   7.923 -17.001 -18.685
  493    HA   PRO  64           HA       PRO  64   9.353 -18.972 -24.968
  494   1HB   PRO  64           HB2      PRO  64   6.530 -19.273 -25.528
  495   2HB   PRO  64           HB1      PRO  64   7.749 -20.545 -25.441
  496   1HG   PRO  64           HG1      PRO  64   5.651 -19.967 -23.536
  497   2HG   PRO  64           HG2      PRO  64   6.847 -21.262 -23.468
  498   1HD   PRO  64           HD1      PRO  64   6.747 -18.862 -21.868
  499   2HD   PRO  64           HD2      PRO  64   7.952 -20.161 -21.802
  500    H    ASP  65           HN       ASP  65   8.801 -17.891 -26.950
  501    HA   ASP  65           HA       ASP  65   8.533 -15.081 -26.725
  502   1HB   ASP  65           HB2      ASP  65   8.366 -15.136 -29.183
  503   2HB   ASP  65           HB1      ASP  65   9.512 -16.373 -28.678
  504    NH1  ARG  66           NH2      ARG  66   5.412 -20.873 -27.285
  505    NH2  ARG  66           NH1      ARG  66   3.570 -21.883 -26.407
  506    H    ARG  66           HN       ARG  66   6.125 -17.562 -27.065
  507    HA   ARG  66           HA       ARG  66   3.912 -16.305 -28.101
  508   1HB   ARG  66           HB2      ARG  66   4.431 -18.513 -26.336
  509   2HB   ARG  66           HB1      ARG  66   3.090 -17.604 -25.651
  510   1HG   ARG  66           HG1      ARG  66   1.980 -19.036 -27.130
  511   2HG   ARG  66           HG2      ARG  66   2.187 -17.596 -28.118
  512   1HD   ARG  66           HD1      ARG  66   3.133 -19.043 -29.613
  513   2HD   ARG  66           HD2      ARG  66   4.556 -18.898 -28.585
  514    HE   ARG  66           HE       ARG  66   2.788 -21.234 -28.755
  515   1HH1  ARG  66          HH21      ARG  66   5.815 -20.305 -28.003
  516   2HH1  ARG  66          HH22      ARG  66   5.985 -21.233 -26.552
  517   1HH2  ARG  66          HH11      ARG  66   2.587 -22.071 -26.466
  518   2HH2  ARG  66          HH12      ARG  66   4.108 -22.268 -25.659
  519    H    PHE  67           HN       PHE  67   5.121 -15.893 -24.794
  520    HA   PHE  67           HA       PHE  67   2.952 -14.033 -24.146
  521   1HB   PHE  67           HB2      PHE  67   5.463 -14.947 -22.686
  522   2HB   PHE  67           HB1      PHE  67   4.334 -13.783 -21.995
  523    HD1  PHE  67           HD1      PHE  67   4.583 -17.248 -23.349
  524    HD2  PHE  67           HD2      PHE  67   2.272 -14.514 -21.038
  525    HE1  PHE  67           HE1      PHE  67   3.102 -19.081 -22.654
  526    HE2  PHE  67           HE2      PHE  67   0.795 -16.350 -20.349
  527    HZ   PHE  67           HZ       PHE  67   1.202 -18.631 -21.163
  528    H    SER  68           HN       SER  68   2.930 -11.957 -24.524
  529    HA   SER  68           HA       SER  68   5.524 -10.502 -24.885
  530   1HB   SER  68           HB2      SER  68   2.909  -9.761 -26.287
  531   2HB   SER  68           HB1      SER  68   4.558  -9.275 -26.728
  532    HG   SER  68           HG       SER  68   3.449 -11.893 -26.781
  533    H    GLY  69           HN       GLY  69   5.538  -8.313 -24.146
  534   1HA   GLY  69           HA1      GLY  69   3.143  -7.343 -22.714
  535   2HA   GLY  69           HA2      GLY  69   4.543  -7.689 -21.707
  536    H    SER  70           HN       SER  70   3.257  -5.186 -22.057
  537    HA   SER  70           HA       SER  70   5.600  -3.555 -22.832
  538   1HB   SER  70           HB2      SER  70   2.795  -3.128 -24.020
  539   2HB   SER  70           HB1      SER  70   4.201  -2.084 -24.304
  540    HG   SER  70           HG       SER  70   5.021  -4.541 -24.700
  541    H    GLY  71           HN       GLY  71   5.710  -1.657 -21.636
  542   1HA   GLY  71           HA1      GLY  71   3.348  -1.020 -19.926
  543   2HA   GLY  71           HA2      GLY  71   4.916  -1.254 -19.169
  544    H    SER  72           HN       SER  72   2.874   1.044 -19.893
  545    HA   SER  72           HA       SER  72   4.807   2.988 -21.017
  546   1HB   SER  72           HB2      SER  72   1.896   3.479 -20.197
  547   2HB   SER  72           HB1      SER  72   2.858   4.407 -21.364
  548    HG   SER  72           HG       SER  72   1.498   2.072 -21.699
  549    H    GLY  73           HN       GLY  73   2.764   4.803 -19.264
  550   1HA   GLY  73           HA1      GLY  73   4.746   5.121 -17.070
  551   2HA   GLY  73           HA2      GLY  73   3.507   6.295 -17.509
  552    H    THR  74           HN       THR  74   1.211   5.054 -17.442
  553    HA   THR  74           HA       THR  74   1.053   3.704 -14.778
  554    HB   THR  74           HB       THR  74  -1.147   4.956 -14.465
  555    HG1  THR  74           HG1      THR  74  -1.386   6.685 -16.046
  556   1HG2  THR  74          HG23      THR  74   1.195   6.020 -13.832
  557   2HG2  THR  74          HG21      THR  74   0.989   6.972 -15.299
  558   3HG2  THR  74          HG22      THR  74  -0.172   7.119 -13.983
  559    H    ASP  75           HN       ASP  75   1.052   2.821 -17.670
  560    HA   ASP  75           HA       ASP  75  -1.420   1.154 -17.496
  561   1HB   ASP  75           HB2      ASP  75  -2.074   2.481 -19.307
  562   2HB   ASP  75           HB1      ASP  75  -0.417   2.899 -19.727
  563    H    PHE  76           HN       PHE  76  -1.207  -0.950 -18.111
  564    HA   PHE  76           HA       PHE  76   1.295  -1.894 -19.359
  565   1HB   PHE  76           HB2      PHE  76   0.370  -3.003 -16.663
  566   2HB   PHE  76           HB1      PHE  76   1.865  -3.391 -17.509
  567    HD1  PHE  76           HD2      PHE  76   3.639  -1.630 -17.743
  568    HD2  PHE  76           HD1      PHE  76   0.191  -1.002 -15.326
  569    HE1  PHE  76           HE2      PHE  76   4.726   0.304 -16.699
  570    HE2  PHE  76           HE1      PHE  76   1.288   0.926 -14.271
  571    HZ   PHE  76           HZ       PHE  76   3.559   1.577 -14.952
  572    H    THR  77           HN       THR  77   0.951  -3.693 -20.577
  573    HA   THR  77           HA       THR  77  -1.534  -5.263 -20.087
  574    HB   THR  77           HB       THR  77  -0.682  -4.022 -22.760
  575    HG1  THR  77           HG1      THR  77  -3.141  -3.860 -21.388
  576   1HG2  THR  77          HG21      THR  77  -2.417  -6.352 -22.109
  577   2HG2  THR  77          HG22      THR  77  -3.278  -5.089 -22.980
  578   3HG2  THR  77          HG23      THR  77  -1.840  -5.822 -23.687
  579    H    LEU  78           HN       LEU  78  -1.402  -7.384 -20.544
  580    HA   LEU  78           HA       LEU  78   1.200  -8.377 -21.647
  581   1HB   LEU  78           HB2      LEU  78   0.872  -8.903 -19.241
  582   2HB   LEU  78           HB1      LEU  78  -0.694  -9.615 -19.590
  583    HG   LEU  78           HG       LEU  78   1.389 -10.784 -21.262
  584   1HD1  LEU  78          HD12      LEU  78   2.816 -10.197 -19.315
  585   2HD1  LEU  78          HD13      LEU  78   1.688 -11.034 -18.253
  586   3HD1  LEU  78          HD11      LEU  78   2.601 -11.940 -19.455
  587   1HD2  LEU  78          HD23      LEU  78  -0.652 -11.737 -19.238
  588   2HD2  LEU  78          HD21      LEU  78  -0.696 -11.921 -20.989
  589   3HD2  LEU  78          HD22      LEU  78   0.450 -12.857 -20.035
  590    H    LYS  79           HN       LYS  79   0.839  -9.057 -23.676
  591    HA   LYS  79           HA       LYS  79  -1.676 -10.590 -24.161
  592   1HB   LYS  79           HB2      LYS  79  -1.357  -9.778 -26.604
  593   2HB   LYS  79           HB1      LYS  79  -1.897  -8.584 -25.435
  594   1HG   LYS  79           HG1      LYS  79   0.812  -8.318 -25.192
  595   2HG   LYS  79           HG2      LYS  79   0.683  -8.772 -26.886
  596   1HD   LYS  79           HD1      LYS  79  -0.727  -6.927 -27.388
  597   2HD   LYS  79           HD2      LYS  79  -1.100  -6.646 -25.692
  598   1HE   LYS  79           HE1      LYS  79   0.503  -5.035 -25.852
  599   2HE   LYS  79           HE2      LYS  79   1.620  -6.381 -25.660
  600   1HZ   LYS  79           HZ1      LYS  79   2.337  -5.234 -27.555
  601   2HZ   LYS  79           HZ2      LYS  79   1.507  -6.589 -28.166
  602    H    ILE  80           HN       ILE  80  -1.575 -12.491 -25.153
  603    HA   ILE  80           HA       ILE  80   1.143 -13.514 -25.828
  604    HB   ILE  80           HB       ILE  80  -1.452 -14.953 -25.104
  605   1HG1  ILE  80          HG11      ILE  80   0.715 -15.543 -23.329
  606   2HG1  ILE  80          HG12      ILE  80   0.630 -13.795 -23.499
  607   1HG2  ILE  80          HG22      ILE  80   0.996 -15.881 -26.419
  608   2HG2  ILE  80          HG23      ILE  80   0.800 -16.691 -24.870
  609   3HG2  ILE  80          HG21      ILE  80  -0.474 -16.784 -26.078
  610   1HD1  ILE  80          HD13      ILE  80  -1.793 -15.533 -22.932
  611   2HD1  ILE  80          HD11      ILE  80  -0.847 -14.751 -21.669
  612   3HD1  ILE  80          HD12      ILE  80  -1.704 -13.775 -22.858
  613    H    SER  81           HN       SER  81   1.616 -14.323 -27.740
  614    HA   SER  81           HA       SER  81  -0.102 -13.608 -29.916
  615   1HB   SER  81           HB2      SER  81   2.535 -15.106 -29.691
  616   2HB   SER  81           HB1      SER  81   1.718 -14.937 -31.257
  617    HG   SER  81           HG       SER  81   1.804 -12.667 -29.667
  618    NH1  ARG  82           NH2      ARG  82   2.025 -21.985 -33.609
  619    NH2  ARG  82           NH1      ARG  82   0.930 -20.839 -35.241
  620    H    ARG  82           HN       ARG  82   0.650 -16.623 -28.289
  621    HA   ARG  82           HA       ARG  82  -1.613 -17.885 -29.774
  622   1HB   ARG  82           HB2      ARG  82   1.143 -19.087 -29.239
  623   2HB   ARG  82           HB1      ARG  82  -0.235 -20.040 -29.757
  624   1HG   ARG  82           HG1      ARG  82  -0.157 -17.891 -31.561
  625   2HG   ARG  82           HG2      ARG  82   1.532 -18.342 -31.336
  626   1HD   ARG  82           HD1      ARG  82   0.419 -20.818 -31.553
  627   2HD   ARG  82           HD2      ARG  82  -0.697 -19.896 -32.563
  628    HE   ARG  82           HE       ARG  82   1.884 -19.110 -33.365
  629   1HH1  ARG  82          HH21      ARG  82   2.394 -22.007 -32.681
  630   2HH1  ARG  82          HH22      ARG  82   2.120 -22.780 -34.205
  631   1HH2  ARG  82          HH11      ARG  82   0.477 -20.000 -35.540
  632   2HH2  ARG  82          HH12      ARG  82   1.004 -21.616 -35.864
  633    H    VAL  83           HN       VAL  83  -2.861 -17.532 -27.899
  634    HA   VAL  83           HA       VAL  83  -2.059 -18.421 -25.285
  635    HB   VAL  83           HB       VAL  83  -4.856 -18.096 -26.482
  636   1HG1  VAL  83          HG12      VAL  83  -3.896 -18.143 -23.598
  637   2HG1  VAL  83          HG13      VAL  83  -5.545 -17.807 -24.113
  638   3HG1  VAL  83          HG11      VAL  83  -4.847 -19.401 -24.381
  639   1HG2  VAL  83          HG21      VAL  83  -3.140 -16.102 -26.432
  640   2HG2  VAL  83          HG22      VAL  83  -4.775 -15.837 -25.834
  641   3HG2  VAL  83          HG23      VAL  83  -3.455 -16.109 -24.700
  642    H    GLU  84           HN       GLU  84  -1.566 -20.481 -24.854
  643    HA   GLU  84           HA       GLU  84  -3.180 -22.627 -26.169
  644   1HB   GLU  84           HB2      GLU  84  -0.390 -22.535 -24.958
  645   2HB   GLU  84           HB1      GLU  84  -1.189 -24.069 -25.286
  646   1HG   GLU  84           HG1      GLU  84  -1.150 -23.752 -27.603
  647   2HG   GLU  84           HG2      GLU  84  -1.099 -21.998 -27.471
  648    H    ALA  85           HN       ALA  85  -3.165 -24.701 -24.687
  649    HA   ALA  85           HA       ALA  85  -4.935 -24.251 -22.550
  650   1HB   ALA  85           HB3      ALA  85  -4.125 -26.475 -23.782
  651   2HB   ALA  85           HB1      ALA  85  -2.987 -26.566 -22.441
  652   3HB   ALA  85           HB2      ALA  85  -4.720 -26.568 -22.127
  653    H    GLU  86           HN       GLU  86  -1.432 -24.256 -22.566
  654    HA   GLU  86           HA       GLU  86  -1.071 -24.369 -19.716
  655   1HB   GLU  86           HB2      GLU  86   0.661 -23.176 -21.931
  656   2HB   GLU  86           HB1      GLU  86   1.209 -23.415 -20.275
  657   1HG   GLU  86           HG1      GLU  86   0.142 -25.639 -22.046
  658   2HG   GLU  86           HG2      GLU  86   1.854 -25.296 -21.823
  659    H    ASP  87           HN       ASP  87  -1.660 -21.759 -21.966
  660    HA   ASP  87           HA       ASP  87  -1.033 -19.595 -20.189
  661   1HB   ASP  87           HB2      ASP  87  -3.003 -19.760 -22.521
  662   2HB   ASP  87           HB1      ASP  87  -2.489 -18.256 -21.766
  663    H    LEU  88           HN       LEU  88  -3.714 -21.749 -20.335
  664    HA   LEU  88           HA       LEU  88  -5.770 -20.138 -19.220
  665   1HB   LEU  88           HB2      LEU  88  -5.191 -23.101 -18.771
  666   2HB   LEU  88           HB1      LEU  88  -6.720 -22.314 -18.410
  667    HG   LEU  88           HG       LEU  88  -5.433 -22.545 -21.154
  668   1HD1  LEU  88          HD12      LEU  88  -7.912 -23.781 -19.903
  669   2HD1  LEU  88          HD13      LEU  88  -7.506 -23.892 -21.612
  670   3HD1  LEU  88          HD11      LEU  88  -6.458 -24.636 -20.410
  671   1HD2  LEU  88          HD22      LEU  88  -7.721 -20.936 -20.074
  672   2HD2  LEU  88          HD23      LEU  88  -6.576 -20.531 -21.350
  673   3HD2  LEU  88          HD21      LEU  88  -7.899 -21.645 -21.675
  674    H    GLY  89           HN       GLY  89  -6.324 -19.559 -17.205
  675   1HA   GLY  89           HA1      GLY  89  -5.933 -20.349 -14.722
  676   2HA   GLY  89           HA2      GLY  89  -4.258 -19.956 -15.101
  677    H    ILE  90           HN       ILE  90  -4.833 -18.527 -13.152
  678    HA   ILE  90           HA       ILE  90  -6.353 -16.096 -13.812
  679    HB   ILE  90           HB       ILE  90  -4.650 -16.823 -11.376
  680   1HG1  ILE  90          HG11      ILE  90  -7.154 -16.998 -10.459
  681   2HG1  ILE  90          HG12      ILE  90  -7.495 -17.370 -12.144
  682   1HG2  ILE  90          HG22      ILE  90  -6.692 -14.619 -11.936
  683   2HG2  ILE  90          HG23      ILE  90  -6.166 -15.036 -10.308
  684   3HG2  ILE  90          HG21      ILE  90  -5.006 -14.409 -11.474
  685   1HD1  ILE  90          HD13      ILE  90  -5.132 -18.803 -11.199
  686   2HD1  ILE  90          HD11      ILE  90  -6.543 -19.164 -10.210
  687   3HD1  ILE  90          HD12      ILE  90  -6.593 -19.441 -11.947
  688    OH   TYR  91           OH       TYR  91  -1.306 -16.375 -19.437
  689    H    TYR  91           HN       TYR  91  -5.404 -13.962 -13.634
  690    HA   TYR  91           HA       TYR  91  -2.474 -13.906 -14.191
  691   1HB   TYR  91           HB2      TYR  91  -4.767 -12.836 -15.817
  692   2HB   TYR  91           HB1      TYR  91  -3.293 -11.873 -15.770
  693    HD1  TYR  91           HD1      TYR  91  -1.190 -12.774 -16.696
  694    HD2  TYR  91           HD2      TYR  91  -4.774 -15.062 -16.841
  695    HE1  TYR  91           HE1      TYR  91  -0.157 -14.293 -18.324
  696    HE2  TYR  91           HE2      TYR  91  -3.742 -16.572 -18.477
  697    HH   TYR  91           HH       TYR  91  -1.737 -17.232 -19.366
  698    H    PHE  92           HN       PHE  92  -1.389 -12.075 -13.567
  699    HA   PHE  92           HA       PHE  92  -2.865  -9.932 -12.095
  700   1HB   PHE  92           HB2      PHE  92  -0.390 -11.029 -10.757
  701   2HB   PHE  92           HB1      PHE  92  -1.862 -10.446 -10.019
  702    HD1  PHE  92           HD2      PHE  92  -0.838 -13.309 -12.238
  703    HD2  PHE  92           HD1      PHE  92  -3.080 -12.054  -8.842
  704    HE1  PHE  92           HE2      PHE  92  -1.521 -15.627 -11.826
  705    HE2  PHE  92           HE1      PHE  92  -3.773 -14.373  -8.446
  706    HZ   PHE  92           HZ       PHE  92  -2.987 -16.164  -9.930
  707    H    CYS  93           HN       CYS  93  -1.282  -8.142 -11.530
  708    HA   CYS  93           HA       CYS  93   1.147  -8.189 -13.262
  709   1HB   CYS  93           HB2      CYS  93   0.678  -5.976 -14.102
  710   2HB   CYS  93           HB1      CYS  93  -0.725  -6.964 -14.395
  711    H    SER  94           HN       SER  94   2.664  -8.222 -11.761
  712    HA   SER  94           HA       SER  94   2.444  -6.675  -9.280
  713   1HB   SER  94           HB2      SER  94   4.885  -8.182 -10.334
  714   2HB   SER  94           HB1      SER  94   4.482  -7.828  -8.644
  715    HG   SER  94           HG       SER  94   2.370  -8.960  -9.462
  716    H    GLN  95           HN       GLN  95   4.219  -5.312  -8.558
  717    HA   GLN  95           HA       GLN  95   5.501  -3.784 -10.782
  718   1HB   GLN  95           HB2      GLN  95   5.074  -1.728  -9.261
  719   2HB   GLN  95           HB1      GLN  95   3.660  -2.399 -10.063
  720   1HG   GLN  95           HG1      GLN  95   2.689  -2.784  -8.056
  721   2HG   GLN  95           HG2      GLN  95   4.037  -3.809  -7.583
  722   1HE2  GLN  95          HE22      GLN  95   3.634  -0.572  -5.496
  723   2HE2  GLN  95          HE21      GLN  95   2.416  -1.536  -6.177
  724    H    THR  96           HN       THR  96   7.624  -3.868 -10.555
  725    HA   THR  96           HA       THR  96   8.801  -4.417  -7.895
  726    HB   THR  96           HB       THR  96  10.896  -4.122  -9.815
  727    HG1  THR  96           HG1      THR  96   8.930  -5.723 -10.983
  728   1HG2  THR  96          HG22      THR  96   9.235  -6.544  -8.936
  729   2HG2  THR  96          HG23      THR  96  10.669  -6.698  -9.945
  730   3HG2  THR  96          HG21      THR  96  10.809  -6.070  -8.307
  731    H    THR  97           HN       THR  97   7.619  -1.773  -8.787
  732    HA   THR  97           HA       THR  97   9.974   0.008  -8.750
  733    HB   THR  97           HB       THR  97   7.052   0.890  -8.564
  734    HG1  THR  97           HG1      THR  97   7.735   0.850 -11.036
  735   1HG2  THR  97          HG22      THR  97   8.988   2.598  -8.562
  736   2HG2  THR  97          HG23      THR  97   9.460   1.960 -10.134
  737   3HG2  THR  97          HG21      THR  97   7.904   2.760  -9.941
  738    H    HIS  98           HN       HIS  98   7.245  -0.808  -6.641
  739    HA   HIS  98           HA       HIS  98   8.653   0.686  -4.462
  740   1HB   HIS  98           HB2      HIS  98   5.664   0.092  -4.638
  741   2HB   HIS  98           HB1      HIS  98   6.463   1.192  -3.517
  742    HD2  HIS  98           HD2      HIS  98   5.302   1.047  -7.245
  743    HE1  HIS  98           HE1      HIS  98   6.782   4.838  -6.518
  744    H    VAL  99           HN       VAL  99   8.619  -0.192  -2.383
  745    HA   VAL  99           HA       VAL  99   8.119  -3.138  -2.320
  746    HB   VAL  99           HB       VAL  99  10.075  -1.417  -0.716
  747   1HG1  VAL  99          HG11      VAL  99   9.120  -3.526   0.415
  748   2HG1  VAL  99          HG12      VAL  99   9.965  -4.443  -0.829
  749   3HG1  VAL  99          HG13      VAL  99  10.873  -3.433   0.290
  750   1HG2  VAL  99          HG23      VAL  99  10.443  -3.348  -3.028
  751   2HG2  VAL  99          HG21      VAL  99  10.841  -1.633  -2.998
  752   3HG2  VAL  99          HG22      VAL  99  11.775  -2.770  -2.032
  753    HA   PRO 100           HA       PRO 100   7.865  -4.719  -0.979
  754   1HB   PRO 100           HB2      PRO 100   5.295  -5.910  -0.545
  755   2HB   PRO 100           HB1      PRO 100   6.726  -6.099   0.468
  756   1HG   PRO 100           HG1      PRO 100   4.303  -4.616   1.057
  757   2HG   PRO 100           HG2      PRO 100   5.699  -4.876   2.103
  758   1HD   PRO 100           HD1      PRO 100   4.951  -2.457   0.691
  759   2HD   PRO 100           HD2      PRO 100   6.318  -2.699   1.795
  760    HA   PRO 101           HA       PRO 101   6.131  -4.192  -5.002
  761   1HB   PRO 101           HB2      PRO 101   6.841  -6.863  -5.822
  762   2HB   PRO 101           HB1      PRO 101   7.751  -5.384  -6.128
  763   1HG   PRO 101           HG1      PRO 101   8.391  -7.533  -4.280
  764   2HG   PRO 101           HG2      PRO 101   9.355  -6.109  -4.667
  765   1HD   PRO 101           HD1      PRO 101   7.876  -6.622  -2.250
  766   2HD   PRO 101           HD2      PRO 101   8.806  -5.169  -2.662
  767    H    THR 102           HN       THR 102   3.945  -4.248  -5.065
  768    HA   THR 102           HA       THR 102   2.338  -6.357  -3.978
  769    HB   THR 102           HB       THR 102   0.448  -5.158  -5.071
  770    HG1  THR 102           HG1      THR 102   1.383  -3.374  -6.510
  771   1HG2  THR 102          HG22      THR 102   1.799  -3.881  -3.226
  772   2HG2  THR 102          HG23      THR 102   2.605  -3.048  -4.550
  773   3HG2  THR 102          HG21      THR 102   0.869  -2.867  -4.324
  774    H    PHE 103           HN       PHE 103   1.178  -7.992  -4.975
  775    HA   PHE 103           HA       PHE 103   2.445  -9.060  -7.404
  776   1HB   PHE 103           HB2      PHE 103   0.065 -10.238  -5.900
  777   2HB   PHE 103           HB1      PHE 103   1.250 -11.098  -6.878
  778    HD1  PHE 103           HD2      PHE 103   3.733 -10.967  -6.064
  779    HD2  PHE 103           HD1      PHE 103   0.402 -10.047  -3.574
  780    HE1  PHE 103           HE2      PHE 103   5.129 -11.294  -4.071
  781    HE2  PHE 103           HE1      PHE 103   1.804 -10.370  -1.583
  782    HZ   PHE 103           HZ       PHE 103   4.168 -10.993  -1.830
  783    H    GLY 104           HN       GLY 104  -1.022  -8.999  -6.582
  784   1HA   GLY 104           HA1      GLY 104  -2.257  -7.285  -8.166
  785   2HA   GLY 104           HA2      GLY 104  -1.550  -8.294  -9.420
  786    H    GLY 105           HN       GLY 105  -3.269  -9.239 -10.271
  787   1HA   GLY 105           HA1      GLY 105  -4.583 -11.355 -10.139
  788   2HA   GLY 105           HA2      GLY 105  -5.019 -10.894  -8.489
  789    H    GLY 106           HN       GLY 106  -5.553 -10.269 -11.893
  790   1HA   GLY 106           HA1      GLY 106  -8.102  -8.989 -11.135
  791   2HA   GLY 106           HA2      GLY 106  -6.977  -8.016 -12.053
  792    H    THR 107           HN       THR 107  -6.729 -11.228 -13.028
  793    HA   THR 107           HA       THR 107  -8.929 -10.966 -14.992
  794    HB   THR 107           HB       THR 107  -6.016 -11.351 -15.893
  795    HG1  THR 107           HG1      THR 107  -7.812  -9.145 -15.815
  796   1HG2  THR 107          HG21      THR 107  -8.734 -11.103 -17.234
  797   2HG2  THR 107          HG22      THR 107  -7.338 -10.394 -18.038
  798   3HG2  THR 107          HG23      THR 107  -7.378 -12.123 -17.705
  799    H    LYS 108           HN       LYS 108  -9.735 -12.842 -15.684
  800    HA   LYS 108           HA       LYS 108  -8.368 -15.332 -14.744
  801   1HB   LYS 108           HB2      LYS 108 -11.211 -14.400 -14.794
  802   2HB   LYS 108           HB1      LYS 108 -10.957 -16.092 -15.208
  803   1HG   LYS 108           HG1      LYS 108  -9.773 -16.485 -13.117
  804   2HG   LYS 108           HG2      LYS 108  -9.817 -14.769 -12.724
  805   1HD   LYS 108           HD1      LYS 108 -11.604 -15.813 -11.488
  806   2HD   LYS 108           HD2      LYS 108 -12.350 -14.915 -12.804
  807   1HE   LYS 108           HE1      LYS 108 -12.288 -17.079 -14.154
  808   2HE   LYS 108           HE2      LYS 108 -11.842 -17.901 -12.665
  809   1HZ   LYS 108           HZ1      LYS 108 -14.271 -17.856 -13.234
  810   2HZ   LYS 108           HZ2      LYS 108 -13.869 -17.323 -11.671
  811    H    LEU 109           HN       LEU 109  -7.276 -16.056 -16.496
  812    HA   LEU 109           HA       LEU 109  -8.495 -15.892 -19.167
  813   1HB   LEU 109           HB2      LEU 109  -5.935 -15.682 -18.431
  814   2HB   LEU 109           HB1      LEU 109  -5.965 -17.435 -18.565
  815    HG   LEU 109           HG       LEU 109  -7.300 -16.233 -20.848
  816   1HD1  LEU 109          HD11      LEU 109  -5.682 -14.360 -20.194
  817   2HD1  LEU 109          HD12      LEU 109  -4.376 -15.489 -20.542
  818   3HD1  LEU 109          HD13      LEU 109  -5.482 -15.001 -21.822
  819   1HD2  LEU 109          HD21      LEU 109  -6.217 -18.546 -20.527
  820   2HD2  LEU 109          HD22      LEU 109  -5.885 -17.732 -22.051
  821   3HD2  LEU 109          HD23      LEU 109  -4.673 -17.738 -20.775
  822    H    GLU 110           HN       GLU 110 -10.289 -17.238 -18.872
  823    HA   GLU 110           HA       GLU 110  -9.650 -20.138 -18.543
  824   1HB   GLU 110           HB2      GLU 110 -11.862 -18.387 -17.666
  825   2HB   GLU 110           HB1      GLU 110 -12.441 -19.848 -18.459
  826   1HG   GLU 110           HG1      GLU 110 -11.925 -21.088 -16.636
  827   2HG   GLU 110           HG2      GLU 110 -10.257 -20.527 -16.685
  828    H    ILE 111           HN       ILE 111 -10.161 -21.566 -20.090
  829    HA   ILE 111           HA       ILE 111 -10.371 -20.780 -22.781
  830    HB   ILE 111           HB       ILE 111  -9.706 -23.050 -21.782
  831   1HG1  ILE 111          HG11      ILE 111 -11.748 -23.318 -24.001
  832   2HG1  ILE 111          HG12      ILE 111 -10.189 -22.544 -24.266
  833   1HG2  ILE 111          HG21      ILE 111 -12.023 -23.031 -20.534
  834   2HG2  ILE 111          HG22      ILE 111 -12.662 -23.656 -22.048
  835   3HG2  ILE 111          HG23      ILE 111 -11.437 -24.565 -21.169
  836   1HD1  ILE 111          HD12      ILE 111 -10.575 -25.352 -23.165
  837   2HD1  ILE 111          HD13      ILE 111 -10.110 -24.970 -24.820
  838   3HD1  ILE 111          HD11      ILE 111  -9.027 -24.576 -23.488
  839    H    LYS 112           HN       LYS 112 -12.097 -21.079 -24.313
  840    HA   LYS 112           HA       LYS 112 -14.659 -20.103 -23.233
  841   1HB   LYS 112           HB2      LYS 112 -13.383 -20.370 -25.953
  842   2HB   LYS 112           HB1      LYS 112 -15.138 -20.281 -25.878
  843   1HG   LYS 112           HG1      LYS 112 -14.668 -18.241 -24.266
  844   2HG   LYS 112           HG2      LYS 112 -13.103 -18.227 -25.065
  845   1HD   LYS 112           HD1      LYS 112 -15.734 -18.227 -26.573
  846   2HD   LYS 112           HD2      LYS 112 -14.863 -16.756 -26.156
  847   1HE   LYS 112           HE1      LYS 112 -13.947 -17.139 -28.245
  848   2HE   LYS 112           HE2      LYS 112 -12.827 -18.089 -27.275
  849   1HZ   LYS 112           HZ1      LYS 112 -14.994 -18.990 -29.029
  850   2HZ   LYS 112           HZ2      LYS 112 -13.418 -19.603 -28.846
  851    NH1  ARG 113           NH2      ARG 113 -15.731 -19.470 -19.481
  852    NH2  ARG 113           NH1      ARG 113 -17.137 -18.207 -20.744
  853    H    ARG 113           HN       ARG 113 -15.977 -21.612 -22.436
  854    HA   ARG 113           HA       ARG 113 -16.047 -24.312 -23.595
  855   1HB   ARG 113           HB2      ARG 113 -17.711 -24.733 -21.764
  856   2HB   ARG 113           HB1      ARG 113 -16.237 -24.010 -21.136
  857   1HG   ARG 113           HG1      ARG 113 -18.395 -22.129 -21.995
  858   2HG   ARG 113           HG2      ARG 113 -18.691 -23.055 -20.530
  859   1HD   ARG 113           HD1      ARG 113 -17.384 -21.595 -19.404
  860   2HD   ARG 113           HD2      ARG 113 -16.007 -22.148 -20.356
  861    HE   ARG 113           HE       ARG 113 -17.184 -20.342 -22.053
  862   1HH1  ARG 113          HH21      ARG 113 -15.343 -20.367 -19.272
  863   2HH1  ARG 113          HH22      ARG 113 -15.450 -18.670 -18.956
  864   1HH2  ARG 113          HH11      ARG 113 -17.808 -18.153 -21.482
  865   2HH2  ARG 113          HH12      ARG 113 -16.877 -17.383 -20.242
   
  Start of MODEL           9
 Raw file had  865 H/Q atoms
  Start of MODEL    9
    1   1H    ASP   1           HT3      ASP   1   2.409   0.265   0.552
    2   2H    ASP   1           HT1      ASP   1   0.981   0.645  -0.288
    3   3H    ASP   1           HT2      ASP   1   1.429  -0.978  -0.068
    4    HA   ASP   1           HA       ASP   1   2.870  -0.974  -1.763
    5   1HB   ASP   1           HB2      ASP   1   2.247   0.746  -3.518
    6   2HB   ASP   1           HB1      ASP   1   0.831  -0.030  -2.814
    7    H    VAL   2           HN       VAL   2   4.238   0.606  -3.270
    8    HA   VAL   2           HA       VAL   2   6.146   1.710  -1.363
    9    HB   VAL   2           HB       VAL   2   6.369   1.735  -4.403
   10   1HG1  VAL   2          HG13      VAL   2   8.052   3.019  -3.080
   11   2HG1  VAL   2          HG11      VAL   2   8.445   1.553  -2.188
   12   3HG1  VAL   2          HG12      VAL   2   8.781   1.651  -3.913
   13   1HG2  VAL   2          HG22      VAL   2   6.285  -0.541  -2.559
   14   2HG2  VAL   2          HG23      VAL   2   6.264  -0.532  -4.319
   15   3HG2  VAL   2          HG21      VAL   2   7.796  -0.472  -3.457
   16    H    VAL   3           HN       VAL   3   4.898   3.514  -0.636
   17    HA   VAL   3           HA       VAL   3   3.945   5.556  -2.425
   18    HB   VAL   3           HB       VAL   3   4.790   5.846   0.500
   19   1HG1  VAL   3          HG12      VAL   3   3.039   7.449  -1.376
   20   2HG1  VAL   3          HG13      VAL   3   2.868   7.577   0.372
   21   3HG1  VAL   3          HG11      VAL   3   4.390   8.016  -0.397
   22   1HG2  VAL   3          HG22      VAL   3   2.176   4.930  -0.747
   23   2HG2  VAL   3          HG23      VAL   3   3.209   4.007   0.340
   24   3HG2  VAL   3          HG21      VAL   3   2.334   5.413   0.939
   25    H    MET   4           HN       MET   4   4.813   7.712  -2.671
   26    HA   MET   4           HA       MET   4   7.760   7.886  -2.291
   27   1HB   MET   4           HB2      MET   4   6.124   8.376  -4.812
   28   2HB   MET   4           HB1      MET   4   7.726   9.074  -4.606
   29   1HG   MET   4           HG1      MET   4   7.326   6.151  -4.109
   30   2HG   MET   4           HG2      MET   4   7.392   6.715  -5.757
   31   1HE   MET   4           HE3      MET   4   9.094   8.747  -6.077
   32   2HE   MET   4           HE1      MET   4  10.822   8.454  -5.888
   33   3HE   MET   4           HE2      MET   4   9.875   7.461  -6.997
   34    H    THR   5           HN       THR   5   8.065   9.551  -0.998
   35    HA   THR   5           HA       THR   5   6.178  11.765  -0.802
   36    HB   THR   5           HB       THR   5   9.007  11.714   0.374
   37    HG1  THR   5           HG1      THR   5   6.625  10.331   1.074
   38   1HG2  THR   5          HG22      THR   5   7.036  13.587   0.678
   39   2HG2  THR   5          HG23      THR   5   6.463  12.407   1.854
   40   3HG2  THR   5          HG21      THR   5   8.064  13.122   2.030
   41    H    GLN   6           HN       GLN   6   6.208  13.594  -1.937
   42    HA   GLN   6           HA       GLN   6   8.557  14.139  -3.675
   43   1HB   GLN   6           HB2      GLN   6   5.898  14.046  -4.268
   44   2HB   GLN   6           HB1      GLN   6   6.033  15.751  -3.859
   45   1HG   GLN   6           HG1      GLN   6   6.709  15.983  -6.024
   46   2HG   GLN   6           HG2      GLN   6   8.258  15.408  -5.419
   47   1HE2  GLN   6          HE22      GLN   6   7.215  13.257  -8.299
   48   2HE2  GLN   6          HE21      GLN   6   7.480  14.921  -8.102
   49    H    THR   7           HN       THR   7   9.715  15.980  -3.553
   50    HA   THR   7           HA       THR   7   8.810  18.316  -2.061
   51    HB   THR   7           HB       THR   7  11.361  17.609  -0.823
   52    HG1  THR   7           HG1      THR   7   9.260  15.723  -0.499
   53   1HG2  THR   7          HG23      THR   7   8.467  17.933   0.078
   54   2HG2  THR   7          HG21      THR   7   9.663  17.313   1.211
   55   3HG2  THR   7          HG22      THR   7   9.856  18.920   0.521
   56    HA   PRO   8           HA       PRO   8   9.677  20.079  -1.290
   57   1HB   PRO   8           HB2      PRO   8   9.689  22.615  -2.574
   58   2HB   PRO   8           HB1      PRO   8  10.807  22.097  -1.312
   59   1HG   PRO   8           HG1      PRO   8  11.352  22.522  -4.144
   60   2HG   PRO   8           HG2      PRO   8  12.498  22.157  -2.854
   61   1HD   PRO   8           HD1      PRO   8  11.477  20.367  -4.905
   62   2HD   PRO   8           HD2      PRO   8  12.699  20.028  -3.662
   63    H    LEU   9           HN       LEU   9   7.721  21.693  -1.501
   64    HA   LEU   9           HA       LEU   9   5.831  20.438  -3.338
   65   1HB   LEU   9           HB2      LEU   9   5.748  22.371  -1.062
   66   2HB   LEU   9           HB1      LEU   9   4.486  22.594  -2.267
   67    HG   LEU   9           HG       LEU   9   4.055  20.070  -2.077
   68   1HD1  LEU   9          HD12      LEU   9   5.899  20.529   0.288
   69   2HD1  LEU   9          HD13      LEU   9   4.786  19.167   0.206
   70   3HD1  LEU   9          HD11      LEU   9   6.067  19.329  -0.990
   71   1HD2  LEU   9          HD23      LEU   9   2.621  21.839  -1.036
   72   2HD2  LEU   9          HD21      LEU   9   2.663  20.360  -0.081
   73   3HD2  LEU   9          HD22      LEU   9   3.617  21.754   0.414
   74    H    SER  10           HN       SER  10   7.640  23.413  -3.208
   75    HA   SER  10           HA       SER  10   6.597  24.093  -5.922
   76   1HB   SER  10           HB2      SER  10   7.283  26.314  -3.972
   77   2HB   SER  10           HB1      SER  10   6.105  26.323  -5.297
   78    HG   SER  10           HG       SER  10   5.632  25.803  -2.769
   79    H    LEU  11           HN       LEU  11   8.096  25.159  -7.279
   80    HA   LEU  11           HA       LEU  11  10.838  25.524  -6.185
   81   1HB   LEU  11           HB2      LEU  11  10.357  23.177  -7.291
   82   2HB   LEU  11           HB1      LEU  11  10.418  24.062  -8.809
   83    HG   LEU  11           HG       LEU  11  12.671  25.026  -7.875
   84   1HD1  LEU  11          HD13      LEU  11  12.255  24.035  -5.581
   85   2HD1  LEU  11          HD11      LEU  11  12.470  22.438  -6.294
   86   3HD1  LEU  11          HD12      LEU  11  13.806  23.586  -6.282
   87   1HD2  LEU  11          HD23      LEU  11  12.288  22.161  -8.803
   88   2HD2  LEU  11          HD21      LEU  11  12.629  23.567  -9.807
   89   3HD2  LEU  11          HD22      LEU  11  13.862  22.945  -8.714
   90    HA   PRO  12           HA       PRO  12   9.661  28.968  -8.984
   91   1HB   PRO  12           HB2      PRO  12  11.209  30.715  -7.286
   92   2HB   PRO  12           HB1      PRO  12   9.452  30.649  -7.422
   93   1HG   PRO  12           HG1      PRO  12  11.101  29.743  -5.221
   94   2HG   PRO  12           HG2      PRO  12   9.342  29.714  -5.337
   95   1HD   PRO  12           HD1      PRO  12  11.172  27.481  -5.526
   96   2HD   PRO  12           HD2      PRO  12   9.401  27.446  -5.608
   97    H    VAL  13           HN       VAL  13  10.938  28.849 -10.739
   98    HA   VAL  13           HA       VAL  13  13.824  29.524 -10.440
   99    HB   VAL  13           HB       VAL  13  14.387  27.636 -12.020
  100   1HG1  VAL  13          HG11      VAL  13  14.417  27.411  -9.467
  101   2HG1  VAL  13          HG12      VAL  13  12.870  26.585  -9.617
  102   3HG1  VAL  13          HG13      VAL  13  14.310  25.901 -10.366
  103   1HG2  VAL  13          HG23      VAL  13  11.441  27.011 -11.626
  104   2HG2  VAL  13          HG21      VAL  13  12.255  27.372 -13.146
  105   3HG2  VAL  13          HG22      VAL  13  12.595  25.865 -12.299
  106    H    SER  14           HN       SER  14  14.851  30.066 -12.514
  107    HA   SER  14           HA       SER  14  12.875  31.410 -14.286
  108   1HB   SER  14           HB2      SER  14  15.628  32.037 -14.978
  109   2HB   SER  14           HB1      SER  14  14.428  33.113 -14.241
  110    HG   SER  14           HG       SER  14  16.479  31.741 -13.084
  111    H    LEU  15           HN       LEU  15  13.225  31.352 -16.607
  112    HA   LEU  15           HA       LEU  15  13.795  28.639 -17.492
  113   1HB   LEU  15           HB2      LEU  15  13.067  31.139 -19.088
  114   2HB   LEU  15           HB1      LEU  15  13.055  29.494 -19.713
  115    HG   LEU  15           HG       LEU  15  11.283  30.657 -17.546
  116   1HD1  LEU  15          HD11      LEU  15  10.791  29.391 -20.260
  117   2HD1  LEU  15          HD12      LEU  15   9.508  29.764 -19.113
  118   3HD1  LEU  15          HD13      LEU  15  10.480  31.062 -19.799
  119   1HD2  LEU  15          HD21      LEU  15  12.022  27.822 -18.165
  120   2HD2  LEU  15          HD22      LEU  15  11.603  28.554 -16.620
  121   3HD2  LEU  15          HD23      LEU  15  10.339  28.158 -17.779
  122    H    GLY  16           HN       GLY  16  15.892  28.281 -17.275
  123   1HA   GLY  16           HA1      GLY  16  17.807  28.237 -19.027
  124   2HA   GLY  16           HA2      GLY  16  17.822  29.986 -18.793
  125    H    ASP  17           HN       ASP  17  17.063  28.143 -16.026
  126    HA   ASP  17           HA       ASP  17  19.811  28.598 -14.949
  127   1HB   ASP  17           HB2      ASP  17  17.109  28.379 -13.520
  128   2HB   ASP  17           HB1      ASP  17  18.650  28.641 -12.711
  129    H    GLN  18           HN       GLN  18  18.469  26.914 -12.630
  130    HA   GLN  18           HA       GLN  18  18.805  24.233 -13.877
  131   1HB   GLN  18           HB2      GLN  18  20.436  25.498 -11.676
  132   2HB   GLN  18           HB1      GLN  18  20.094  23.776 -11.554
  133   1HG   GLN  18           HG1      GLN  18  20.854  23.975 -14.186
  134   2HG   GLN  18           HG2      GLN  18  21.863  25.213 -13.445
  135   1HE2  GLN  18          HE22      GLN  18  23.557  22.820 -11.308
  136   2HE2  GLN  18          HE21      GLN  18  22.924  24.394 -11.266
  137    H    ALA  19           HN       ALA  19  18.247  22.491 -12.175
  138    HA   ALA  19           HA       ALA  19  16.219  23.449 -10.227
  139   1HB   ALA  19           HB3      ALA  19  15.456  22.593 -12.762
  140   2HB   ALA  19           HB1      ALA  19  15.305  21.120 -11.812
  141   3HB   ALA  19           HB2      ALA  19  14.414  22.565 -11.346
  142    H    SER  20           HN       SER  20  15.376  21.668  -8.874
  143    HA   SER  20           HA       SER  20  16.892  19.177  -8.765
  144   1HB   SER  20           HB2      SER  20  17.746  19.710  -6.384
  145   2HB   SER  20           HB1      SER  20  18.535  20.657  -7.661
  146    HG   SER  20           HG       SER  20  16.270  21.425  -6.121
  147    H    ILE  21           HN       ILE  21  14.671  18.483  -8.957
  148    HA   ILE  21           HA       ILE  21  12.931  18.977  -6.613
  149    HB   ILE  21           HB       ILE  21  12.463  17.203  -9.038
  150   1HG1  ILE  21          HG11      ILE  21  10.989  19.690  -9.077
  151   2HG1  ILE  21          HG12      ILE  21  12.709  20.031  -8.946
  152   1HG2  ILE  21          HG21      ILE  21  10.744  18.332  -6.808
  153   2HG2  ILE  21          HG22      ILE  21  10.014  17.887  -8.347
  154   3HG2  ILE  21          HG23      ILE  21  10.835  16.669  -7.377
  155   1HD1  ILE  21          HD12      ILE  21  12.999  18.284 -10.843
  156   2HD1  ILE  21          HD13      ILE  21  11.266  18.471 -11.092
  157   3HD1  ILE  21          HD11      ILE  21  12.337  19.855 -11.282
  158    H    SER  22           HN       SER  22  12.895  17.680  -4.952
  159    HA   SER  22           HA       SER  22  14.368  15.136  -5.043
  160   1HB   SER  22           HB2      SER  22  12.862  16.244  -2.636
  161   2HB   SER  22           HB1      SER  22  14.318  15.231  -2.649
  162    HG   SER  22           HG       SER  22  15.344  16.988  -3.807
  163    H    CYS  23           HN       CYS  23  13.539  13.165  -4.432
  164    HA   CYS  23           HA       CYS  23  10.673  12.756  -4.011
  165   1HB   CYS  23           HB2      CYS  23  11.951  12.540  -6.663
  166   2HB   CYS  23           HB1      CYS  23  11.170  11.056  -6.191
  167    NH1  ARG  24           NH2      ARG  24  12.479  10.557   3.966
  168    NH2  ARG  24           NH1      ARG  24  14.592  11.156   3.362
  169    H    ARG  24           HN       ARG  24  10.856  11.307  -2.376
  170    HA   ARG  24           HA       ARG  24  12.864   9.129  -2.722
  171   1HB   ARG  24           HB2      ARG  24  12.163   9.051  -0.042
  172   2HB   ARG  24           HB1      ARG  24  13.580   9.872  -0.683
  173   1HG   ARG  24           HG1      ARG  24  12.006  11.873  -1.079
  174   2HG   ARG  24           HG2      ARG  24  10.889  11.041  -0.009
  175   1HD   ARG  24           HD1      ARG  24  13.595  12.210   0.610
  176   2HD   ARG  24           HD2      ARG  24  12.088  12.378   1.508
  177    HE   ARG  24           HE       ARG  24  13.144   9.639   1.445
  178   1HH1  ARG  24          HH21      ARG  24  11.569  10.244   3.695
  179   2HH1  ARG  24          HH22      ARG  24  12.687  10.714   4.931
  180   1HH2  ARG  24          HH11      ARG  24  15.267  11.292   2.638
  181   2HH2  ARG  24          HH12      ARG  24  14.839  11.326   4.315
  182    H    SER  25           HN       SER  25  12.301   7.130  -1.481
  183    HA   SER  25           HA       SER  25   9.447   6.426  -2.033
  184   1HB   SER  25           HB2      SER  25  10.751   5.004  -3.434
  185   2HB   SER  25           HB1      SER  25  12.074   4.906  -2.258
  186    HG   SER  25           HG       SER  25  10.531   3.051  -2.422
  187    H    SER  26           HN       SER  26   8.414   4.966  -0.557
  188    HA   SER  26           HA       SER  26   9.087   5.547   2.210
  189   1HB   SER  26           HB2      SER  26   6.866   4.282   0.720
  190   2HB   SER  26           HB1      SER  26   7.199   3.480   2.269
  191    HG   SER  26           HG       SER  26   5.947   5.721   1.980
  192    H    GLN  27           HN       GLN  27   9.078   2.567   0.267
  193    HA   GLN  27           HA       GLN  27  10.591   1.213   2.423
  194   1HB   GLN  27           HB2      GLN  27   8.506   0.277   1.078
  195   2HB   GLN  27           HB1      GLN  27   9.696  -0.075  -0.170
  196   1HG   GLN  27           HG1      GLN  27   9.617  -2.045   1.160
  197   2HG   GLN  27           HG2      GLN  27  11.065  -1.201   1.697
  198   1HE2  GLN  27          HE22      GLN  27   7.787  -1.243   4.174
  199   2HE2  GLN  27          HE21      GLN  27   7.566  -1.439   2.504
  200    H    SER  28           HN       SER  28  10.755   1.096  -1.123
  201    HA   SER  28           HA       SER  28  13.274   2.177  -1.593
  202   1HB   SER  28           HB2      SER  28  14.233   0.503  -0.006
  203   2HB   SER  28           HB1      SER  28  13.463  -0.813  -0.913
  204    HG   SER  28           HG       SER  28  15.611   0.834  -1.592
  205    H    LEU  29           HN       LEU  29  14.279   1.346  -3.661
  206    HA   LEU  29           HA       LEU  29  12.210  -0.017  -5.340
  207   1HB   LEU  29           HB2      LEU  29  14.078   2.153  -6.343
  208   2HB   LEU  29           HB1      LEU  29  12.660   1.509  -7.152
  209    HG   LEU  29           HG       LEU  29  12.503   2.931  -4.484
  210   1HD1  LEU  29          HD12      LEU  29  13.418   4.330  -6.467
  211   2HD1  LEU  29          HD13      LEU  29  11.813   4.144  -7.168
  212   3HD1  LEU  29          HD11      LEU  29  12.009   4.964  -5.622
  213   1HD2  LEU  29          HD22      LEU  29  10.626   1.426  -5.123
  214   2HD2  LEU  29          HD23      LEU  29  10.126   3.113  -5.080
  215   3HD2  LEU  29          HD21      LEU  29  10.438   2.325  -6.623
  216    H    VAL  30           HN       VAL  30  14.810  -0.865  -3.983
  217    HA   VAL  30           HA       VAL  30  16.452  -1.570  -6.340
  218    HB   VAL  30           HB       VAL  30  16.781  -2.285  -3.381
  219   1HG1  VAL  30          HG11      VAL  30  18.439  -2.769  -5.858
  220   2HG1  VAL  30          HG12      VAL  30  19.237  -2.575  -4.299
  221   3HG1  VAL  30          HG13      VAL  30  18.075  -3.876  -4.538
  222   1HG2  VAL  30          HG22      VAL  30  17.029   0.214  -4.538
  223   2HG2  VAL  30          HG23      VAL  30  17.877  -0.300  -3.085
  224   3HG2  VAL  30          HG21      VAL  30  18.673  -0.404  -4.652
  225    H    HIS  31           HN       HIS  31  16.012  -3.320  -7.475
  226    HA   HIS  31           HA       HIS  31  14.042  -5.241  -6.758
  227   1HB   HIS  31           HB2      HIS  31  15.262  -4.627  -9.068
  228   2HB   HIS  31           HB1      HIS  31  16.293  -5.985  -8.631
  229    HD2  HIS  31           HD2      HIS  31  12.957  -5.342 -10.303
  230    HE1  HIS  31           HE1      HIS  31  12.817  -9.273  -9.032
  231    H    SER  32           HN       SER  32  14.306  -7.513  -6.365
  232    HA   SER  32           HA       SER  32  15.230  -8.554  -4.187
  233   1HB   SER  32           HB2      SER  32  14.590  -9.971  -6.182
  234   2HB   SER  32           HB1      SER  32  16.246  -9.797  -6.794
  235    HG   SER  32           HG       SER  32  16.919 -11.129  -5.307
  236    H    ASN  33           HN       ASN  33  17.718  -8.519  -6.724
  237    HA   ASN  33           HA       ASN  33  19.683  -7.442  -4.810
  238   1HB   ASN  33           HB2      ASN  33  21.237  -9.437  -5.353
  239   2HB   ASN  33           HB1      ASN  33  19.872  -9.820  -4.308
  240   1HD2  ASN  33          HD22      ASN  33  20.130 -11.503  -7.991
  241   2HD2  ASN  33          HD21      ASN  33  21.293 -10.390  -7.450
  242    H    GLY  34           HN       GLY  34  18.817  -6.112  -6.917
  243   1HA   GLY  34           HA1      GLY  34  20.956  -6.456  -8.986
  244   2HA   GLY  34           HA2      GLY  34  19.350  -5.847  -9.361
  245    H    ASN  35           HN       ASN  35  19.431  -3.772  -9.808
  246    HA   ASN  35           HA       ASN  35  21.281  -2.028  -8.224
  247   1HB   ASN  35           HB2      ASN  35  20.178  -1.738 -11.062
  248   2HB   ASN  35           HB1      ASN  35  21.146  -0.507 -10.257
  249   1HD2  ASN  35          HD22      ASN  35  22.957  -4.009 -11.412
  250   2HD2  ASN  35          HD21      ASN  35  21.280  -3.987 -11.154
  251    H    THR  36           HN       THR  36  20.464   0.352  -8.334
  252    HA   THR  36           HA       THR  36  17.835   0.349  -7.060
  253    HB   THR  36           HB       THR  36  19.420   2.847  -7.846
  254    HG1  THR  36           HG1      THR  36  20.796   2.361  -6.221
  255   1HG2  THR  36          HG23      THR  36  17.137   2.817  -6.495
  256   2HG2  THR  36          HG21      THR  36  18.093   2.111  -5.196
  257   3HG2  THR  36          HG22      THR  36  18.476   3.722  -5.794
  258    OH   TYR  37           OH       TYR  37  16.520  -3.493 -13.859
  259    H    TYR  37           HN       TYR  37  15.970   0.557  -8.119
  260    HA   TYR  37           HA       TYR  37  16.019   1.611 -10.902
  261   1HB   TYR  37           HB2      TYR  37  14.182  -0.151  -9.284
  262   2HB   TYR  37           HB1      TYR  37  13.487   0.746 -10.630
  263    HD1  TYR  37           HD2      TYR  37  16.352  -1.505  -9.798
  264    HD2  TYR  37           HD1      TYR  37  13.681  -0.130 -12.806
  265    HE1  TYR  37           HE2      TYR  37  17.267  -3.156 -11.363
  266    HE2  TYR  37           HE1      TYR  37  14.618  -1.757 -14.382
  267    HH   TYR  37           HH       TYR  37  15.956  -4.271 -13.833
  268    H    LEU  38           HN       LEU  38  14.325   3.082 -11.593
  269    HA   LEU  38           HA       LEU  38  12.598   4.480  -9.814
  270   1HB   LEU  38           HB2      LEU  38  14.778   5.254  -8.828
  271   2HB   LEU  38           HB1      LEU  38  15.251   5.881 -10.401
  272    HG   LEU  38           HG       LEU  38  13.043   7.250 -10.294
  273   1HD1  LEU  38          HD12      LEU  38  13.395   6.415  -7.393
  274   2HD1  LEU  38          HD13      LEU  38  12.357   7.739  -7.919
  275   3HD1  LEU  38          HD11      LEU  38  11.998   6.086  -8.420
  276   1HD2  LEU  38          HD22      LEU  38  15.569   7.929  -9.811
  277   2HD2  LEU  38          HD23      LEU  38  14.254   9.051  -9.467
  278   3HD2  LEU  38          HD21      LEU  38  14.964   8.108  -8.166
  279    H    ASN  39           HN       ASN  39  11.456   6.162 -10.811
  280    HA   ASN  39           HA       ASN  39  12.138   6.743 -13.651
  281   1HB   ASN  39           HB2      ASN  39   9.423   5.821 -12.582
  282   2HB   ASN  39           HB1      ASN  39   9.693   6.410 -14.221
  283   1HD2  ASN  39          HD22      ASN  39  11.297   3.440 -15.320
  284   2HD2  ASN  39          HD21      ASN  39  11.023   5.081 -15.657
  285    CH2  TRP  40           CH2      TRP  40  12.073  13.992  -9.081
  286    H    TRP  40           HN       TRP  40  11.356   8.725 -14.414
  287    HA   TRP  40           HA       TRP  40  10.264  10.526 -12.287
  288   1HB   TRP  40           HB2      TRP  40  12.481  10.846 -14.294
  289   2HB   TRP  40           HB1      TRP  40  11.530  12.276 -13.917
  290    HD1  TRP  40           HD1      TRP  40  14.216  10.005 -12.459
  291    HE1  TRP  40           HE1      TRP  40  14.835  10.989 -10.213
  292    HE3  TRP  40           HE3      TRP  40  10.554  13.322 -12.013
  293    HZ2  TRP  40           HZ2      TRP  40  13.831  13.015  -8.351
  294    HZ3  TRP  40           HZ3      TRP  40  10.339  14.784 -10.046
  295    HH2  TRP  40           HH2      TRP  40  11.986  14.642  -8.224
  296    OH   TYR  41           OH       TYR  41   5.474   6.991 -17.521
  297    H    TYR  41           HN       TYR  41   8.937  12.289 -13.031
  298    HA   TYR  41           HA       TYR  41   7.865  12.066 -15.785
  299   1HB   TYR  41           HB2      TYR  41   6.456  11.288 -13.262
  300   2HB   TYR  41           HB1      TYR  41   5.510  12.255 -14.388
  301    HD1  TYR  41           HD1      TYR  41   5.308  11.452 -16.798
  302    HD2  TYR  41           HD2      TYR  41   6.877   8.985 -13.709
  303    HE1  TYR  41           HE1      TYR  41   4.928   9.469 -18.187
  304    HE2  TYR  41           HE2      TYR  41   6.498   7.003 -15.101
  305    HH   TYR  41           HH       TYR  41   4.616   6.625 -17.289
  306    H    LEU  42           HN       LEU  42   6.125  13.759 -16.135
  307    HA   LEU  42           HA       LEU  42   6.177  16.110 -14.409
  308   1HB   LEU  42           HB2      LEU  42   8.156  16.841 -15.403
  309   2HB   LEU  42           HB1      LEU  42   7.919  15.859 -16.836
  310    HG   LEU  42           HG       LEU  42   6.112  17.488 -17.552
  311   1HD1  LEU  42          HD12      LEU  42   6.639  18.498 -14.908
  312   2HD1  LEU  42          HD13      LEU  42   7.050  19.747 -16.078
  313   3HD1  LEU  42          HD11      LEU  42   5.433  19.053 -16.062
  314   1HD2  LEU  42          HD23      LEU  42   8.422  17.556 -18.450
  315   2HD2  LEU  42          HD21      LEU  42   7.730  19.170 -18.328
  316   3HD2  LEU  42          HD22      LEU  42   8.896  18.620 -17.129
  317    H    GLN  43           HN       GLN  43   4.168  16.872 -14.513
  318    HA   GLN  43           HA       GLN  43   2.485  16.219 -16.852
  319   1HB   GLN  43           HB2      GLN  43   1.663  15.957 -14.458
  320   2HB   GLN  43           HB1      GLN  43   1.751  17.708 -14.291
  321   1HG   GLN  43           HG1      GLN  43   0.187  17.921 -16.251
  322   2HG   GLN  43           HG2      GLN  43   0.020  16.168 -16.257
  323   1HE2  GLN  43          HE22      GLN  43  -2.742  16.723 -14.112
  324   2HE2  GLN  43          HE21      GLN  43  -2.247  16.264 -15.667
  325    H    LYS  44           HN       LYS  44   2.414  17.566 -18.505
  326    HA   LYS  44           HA       LYS  44   2.138  20.465 -17.998
  327   1HB   LYS  44           HB2      LYS  44   4.632  19.667 -18.397
  328   2HB   LYS  44           HB1      LYS  44   4.124  19.513 -20.072
  329   1HG   LYS  44           HG1      LYS  44   3.388  21.880 -20.066
  330   2HG   LYS  44           HG2      LYS  44   3.912  22.032 -18.393
  331   1HD   LYS  44           HD1      LYS  44   5.794  22.820 -19.536
  332   2HD   LYS  44           HD2      LYS  44   6.198  21.120 -19.331
  333   1HE   LYS  44           HE1      LYS  44   6.619  21.601 -21.638
  334   2HE   LYS  44           HE2      LYS  44   5.094  20.726 -21.611
  335   1HZ   LYS  44           HZ1      LYS  44   4.931  23.617 -21.373
  336   2HZ   LYS  44           HZ2      LYS  44   5.418  23.012 -22.884
  337    H    ALA  45           HN       ALA  45   1.686  21.631 -20.081
  338    HA   ALA  45           HA       ALA  45  -0.562  20.520 -21.372
  339   1HB   ALA  45           HB2      ALA  45   1.373  22.713 -22.247
  340   2HB   ALA  45           HB3      ALA  45  -0.152  22.389 -23.066
  341   3HB   ALA  45           HB1      ALA  45  -0.151  22.929 -21.390
  342    H    GLY  46           HN       GLY  46  -0.419  18.616 -22.397
  343   1HA   GLY  46           HA1      GLY  46   0.006  17.174 -24.208
  344   2HA   GLY  46           HA2      GLY  46   0.849  18.498 -24.996
  345    H    GLN  47           HN       GLN  47   2.005  17.807 -21.860
  346    HA   GLN  47           HA       GLN  47   4.205  16.151 -23.036
  347   1HB   GLN  47           HB2      GLN  47   4.451  18.749 -22.163
  348   2HB   GLN  47           HB1      GLN  47   4.828  17.869 -20.690
  349   1HG   GLN  47           HG1      GLN  47   6.634  16.695 -21.727
  350   2HG   GLN  47           HG2      GLN  47   6.120  17.180 -23.340
  351   1HE2  GLN  47          HE22      GLN  47   8.312  19.914 -23.222
  352   2HE2  GLN  47          HE21      GLN  47   7.663  18.620 -24.106
  353    H    SER  48           HN       SER  48   1.690  16.002 -21.039
  354    HA   SER  48           HA       SER  48   2.683  15.005 -18.586
  355   1HB   SER  48           HB2      SER  48   0.301  13.518 -19.394
  356   2HB   SER  48           HB1      SER  48   0.429  14.818 -18.196
  357    HG   SER  48           HG       SER  48  -0.746  15.753 -19.758
  358    HA   PRO  49           HA       PRO  49   2.667  10.607 -20.439
  359   1HB   PRO  49           HB2      PRO  49   2.694  10.627 -23.303
  360   2HB   PRO  49           HB1      PRO  49   1.359  10.117 -22.270
  361   1HG   PRO  49           HG1      PRO  49   1.559  12.526 -23.890
  362   2HG   PRO  49           HG2      PRO  49   0.176  11.948 -22.960
  363   1HD   PRO  49           HD1      PRO  49   1.958  14.130 -22.316
  364   2HD   PRO  49           HD2      PRO  49   0.555  13.562 -21.395
  365    H    LYS  50           HN       LYS  50   4.622  12.984 -20.614
  366    HA   LYS  50           HA       LYS  50   6.742  11.643 -22.223
  367   1HB   LYS  50           HB2      LYS  50   5.997  14.236 -22.344
  368   2HB   LYS  50           HB1      LYS  50   7.137  14.372 -21.011
  369   1HG   LYS  50           HG1      LYS  50   8.959  13.732 -22.325
  370   2HG   LYS  50           HG2      LYS  50   7.960  12.834 -23.461
  371   1HD   LYS  50           HD1      LYS  50   7.723  15.837 -23.210
  372   2HD   LYS  50           HD2      LYS  50   8.938  15.108 -24.247
  373   1HE   LYS  50           HE1      LYS  50   6.088  14.175 -24.472
  374   2HE   LYS  50           HE2      LYS  50   6.550  15.697 -25.224
  375   1HZ   LYS  50           HZ1      LYS  50   8.522  14.200 -26.083
  376   2HZ   LYS  50           HZ2      LYS  50   7.360  12.976 -25.885
  377    H    LEU  51           HN       LEU  51   8.322  10.626 -21.239
  378    HA   LEU  51           HA       LEU  51   8.656  11.014 -18.301
  379   1HB   LEU  51           HB2      LEU  51   8.373   8.726 -18.447
  380   2HB   LEU  51           HB1      LEU  51   8.719   8.708 -20.166
  381    HG   LEU  51           HG       LEU  51  11.207   9.051 -19.468
  382   1HD1  LEU  51          HD13      LEU  51   9.832   8.712 -16.871
  383   2HD1  LEU  51          HD11      LEU  51  11.218   7.653 -17.091
  384   3HD1  LEU  51          HD12      LEU  51  11.417   9.395 -17.214
  385   1HD2  LEU  51          HD21      LEU  51   9.810   6.881 -20.187
  386   2HD2  LEU  51          HD22      LEU  51  11.491   6.766 -19.675
  387   3HD2  LEU  51          HD23      LEU  51  10.198   6.395 -18.540
  388    H    LEU  52           HN       LEU  52  10.730  11.239 -17.421
  389    HA   LEU  52           HA       LEU  52  12.736  12.301 -19.358
  390   1HB   LEU  52           HB2      LEU  52  12.404  12.634 -16.338
  391   2HB   LEU  52           HB1      LEU  52  13.751  13.311 -17.245
  392    HG   LEU  52           HG       LEU  52  10.870  13.886 -17.995
  393   1HD1  LEU  52          HD11      LEU  52  11.324  14.589 -15.629
  394   2HD1  LEU  52          HD12      LEU  52  12.680  15.550 -16.210
  395   3HD1  LEU  52          HD13      LEU  52  11.039  15.955 -16.703
  396   1HD2  LEU  52          HD21      LEU  52  13.578  15.089 -18.624
  397   2HD2  LEU  52          HD22      LEU  52  12.380  14.464 -19.754
  398   3HD2  LEU  52          HD23      LEU  52  12.084  15.977 -18.903
  399    H    ILE  53           HN       ILE  53  13.244  10.968 -16.121
  400    HA   ILE  53           HA       ILE  53  15.300   9.145 -17.297
  401    HB   ILE  53           HB       ILE  53  14.880  10.092 -14.428
  402   1HG1  ILE  53          HG11      ILE  53  15.659  11.734 -16.345
  403   2HG1  ILE  53          HG12      ILE  53  16.415  11.776 -14.761
  404   1HG2  ILE  53          HG22      ILE  53  16.805   8.205 -15.759
  405   2HG2  ILE  53          HG23      ILE  53  17.463   9.245 -14.498
  406   3HG2  ILE  53          HG21      ILE  53  16.137   8.141 -14.133
  407   1HD1  ILE  53          HD11      ILE  53  17.498   9.990 -16.924
  408   2HD1  ILE  53          HD12      ILE  53  17.950  11.687 -16.855
  409   3HD1  ILE  53          HD13      ILE  53  18.325  10.622 -15.507
  410    OH   TYR  54           OH       TYR  54  16.514   4.252 -21.550
  411    H    TYR  54           HN       TYR  54  15.151   6.951 -16.981
  412    HA   TYR  54           HA       TYR  54  12.918   5.983 -15.250
  413   1HB   TYR  54           HB2      TYR  54  12.387   4.273 -17.022
  414   2HB   TYR  54           HB1      TYR  54  12.141   5.916 -17.596
  415    HD1  TYR  54           HD2      TYR  54  13.964   6.997 -19.011
  416    HD2  TYR  54           HD1      TYR  54  13.985   2.847 -18.072
  417    HE1  TYR  54           HE2      TYR  54  15.521   6.582 -20.858
  418    HE2  TYR  54           HE1      TYR  54  15.534   2.436 -19.928
  419    HH   TYR  54           HH       TYR  54  17.382   4.549 -21.265
  420    H    LYS  55           HN       LYS  55  15.821   6.085 -14.867
  421    HA   LYS  55           HA       LYS  55  16.202   3.552 -13.628
  422   1HB   LYS  55           HB2      LYS  55  16.472   3.218 -16.320
  423   2HB   LYS  55           HB1      LYS  55  18.103   3.760 -15.959
  424   1HG   LYS  55           HG1      LYS  55  17.333   1.843 -13.962
  425   2HG   LYS  55           HG2      LYS  55  16.969   1.163 -15.542
  426   1HD   LYS  55           HD1      LYS  55  19.498   2.408 -15.815
  427   2HD   LYS  55           HD2      LYS  55  19.552   1.553 -14.279
  428   1HE   LYS  55           HE1      LYS  55  20.246  -0.036 -15.928
  429   2HE   LYS  55           HE2      LYS  55  18.590  -0.468 -15.521
  430   1HZ   LYS  55           HZ1      LYS  55  18.253   1.301 -17.522
  431   2HZ   LYS  55           HZ2      LYS  55  19.678   0.510 -18.000
  432    H    VAL  56           HN       VAL  56  16.603   5.574 -12.317
  433    HA   VAL  56           HA       VAL  56  18.069   7.356 -11.626
  434    HB   VAL  56           HB       VAL  56  19.729   6.308 -10.141
  435   1HG1  VAL  56          HG13      VAL  56  17.156   4.717 -10.351
  436   2HG1  VAL  56          HG11      VAL  56  18.201   4.773  -8.935
  437   3HG1  VAL  56          HG12      VAL  56  17.376   6.234  -9.478
  438   1HG2  VAL  56          HG21      VAL  56  19.299   3.954 -11.964
  439   2HG2  VAL  56          HG22      VAL  56  20.811   4.653 -11.386
  440   3HG2  VAL  56          HG23      VAL  56  19.806   3.695 -10.298
  441    H    SER  57           HN       SER  57  18.889   8.497 -13.292
  442    HA   SER  57           HA       SER  57  20.693   9.466 -14.401
  443   1HB   SER  57           HB2      SER  57  21.959   7.715 -12.572
  444   2HB   SER  57           HB1      SER  57  22.612   7.214 -14.144
  445    HG   SER  57           HG       SER  57  23.826   8.950 -13.605
  446    H    ASN  58           HN       ASN  58  18.962   8.626 -15.969
  447    HA   ASN  58           HA       ASN  58  20.316   7.637 -18.300
  448   1HB   ASN  58           HB2      ASN  58  20.095   5.389 -17.826
  449   2HB   ASN  58           HB1      ASN  58  18.994   5.703 -16.494
  450   1HD2  ASN  58          HD22      ASN  58  16.124   4.928 -18.342
  451   2HD2  ASN  58          HD21      ASN  58  16.785   5.384 -16.848
  452    NH1  ARG  59           NH1      ARG  59  21.681  11.506 -18.722
  453    NH2  ARG  59           NH2      ARG  59  22.458  13.396 -19.706
  454    H    ARG  59           HN       ARG  59  19.426   9.070 -19.616
  455    HA   ARG  59           HA       ARG  59  16.593   9.839 -19.339
  456   1HB   ARG  59           HB2      ARG  59  18.804  10.760 -21.226
  457   2HB   ARG  59           HB1      ARG  59  17.216  11.505 -21.110
  458   1HG   ARG  59           HG1      ARG  59  17.597  12.152 -18.816
  459   2HG   ARG  59           HG2      ARG  59  19.077  11.204 -18.738
  460   1HD   ARG  59           HD1      ARG  59  19.643  12.779 -20.878
  461   2HD   ARG  59           HD2      ARG  59  18.596  13.862 -19.964
  462    HE   ARG  59           HE       ARG  59  20.224  13.904 -18.203
  463   1HH1  ARG  59          HH11      ARG  59  20.928  11.022 -18.279
  464   2HH1  ARG  59          HH12      ARG  59  22.561  11.054 -18.849
  465   1HH2  ARG  59          HH21      ARG  59  22.293  14.336 -20.001
  466   2HH2  ARG  59          HH22      ARG  59  23.350  12.974 -19.863
  467    H    PHE  60           HN       PHE  60  15.088   9.780 -21.032
  468    HA   PHE  60           HA       PHE  60  15.322   7.383 -22.710
  469   1HB   PHE  60           HB2      PHE  60  13.170   7.810 -21.632
  470   2HB   PHE  60           HB1      PHE  60  13.110   9.444 -22.280
  471    HD1  PHE  60           HD1      PHE  60  13.588   5.956 -23.600
  472    HD2  PHE  60           HD2      PHE  60  11.709   9.744 -24.123
  473    HE1  PHE  60           HE1      PHE  60  12.470   5.125 -25.623
  474    HE2  PHE  60           HE2      PHE  60  10.593   8.908 -26.144
  475    HZ   PHE  60           HZ       PHE  60  10.972   6.599 -26.897
  476    H    SER  61           HN       SER  61  14.838   7.452 -25.024
  477    HA   SER  61           HA       SER  61  16.546   8.979 -26.558
  478   1HB   SER  61           HB2      SER  61  15.050   7.051 -27.355
  479   2HB   SER  61           HB1      SER  61  13.735   8.233 -27.505
  480    HG   SER  61           HG       SER  61  15.685   9.456 -28.585
  481    H    GLY  62           HN       GLY  62  13.285   9.922 -25.567
  482   1HA   GLY  62           HA1      GLY  62  13.637  12.539 -26.945
  483   2HA   GLY  62           HA2      GLY  62  12.119  11.927 -26.299
  484    H    VAL  63           HN       VAL  63  15.366  12.395 -24.899
  485    HA   VAL  63           HA       VAL  63  14.213  14.351 -22.991
  486    HB   VAL  63           HB       VAL  63  15.695  11.808 -22.177
  487   1HG1  VAL  63          HG12      VAL  63  14.587  14.090 -20.498
  488   2HG1  VAL  63          HG13      VAL  63  15.273  12.601 -19.855
  489   3HG1  VAL  63          HG11      VAL  63  16.294  13.730 -20.740
  490   1HG2  VAL  63          HG21      VAL  63  12.836  12.726 -21.715
  491   2HG2  VAL  63          HG22      VAL  63  13.341  11.405 -22.763
  492   3HG2  VAL  63          HG23      VAL  63  13.553  11.276 -21.022
  493    HA   PRO  64           HA       PRO  64  18.101  16.175 -24.169
  494   1HB   PRO  64           HB2      PRO  64  17.655  18.217 -22.152
  495   2HB   PRO  64           HB1      PRO  64  17.500  18.373 -23.900
  496   1HG   PRO  64           HG1      PRO  64  15.379  18.272 -21.952
  497   2HG   PRO  64           HG2      PRO  64  15.222  18.397 -23.703
  498   1HD   PRO  64           HD1      PRO  64  14.665  16.107 -22.030
  499   2HD   PRO  64           HD2      PRO  64  14.487  16.238 -23.790
  500    H    ASP  65           HN       ASP  65  20.118  15.990 -23.372
  501    HA   ASP  65           HA       ASP  65  20.727  14.422 -21.142
  502   1HB   ASP  65           HB2      ASP  65  22.226  16.326 -22.892
  503   2HB   ASP  65           HB1      ASP  65  23.008  15.885 -21.377
  504    NH1  ARG  66           NH1      ARG  66  17.231  20.756 -22.905
  505    NH2  ARG  66           NH2      ARG  66  18.591  22.511 -22.416
  506    H    ARG  66           HN       ARG  66  20.002  17.827 -21.168
  507    HA   ARG  66           HA       ARG  66  21.301  18.475 -18.687
  508   1HB   ARG  66           HB2      ARG  66  19.697  20.447 -18.712
  509   2HB   ARG  66           HB1      ARG  66  20.598  20.253 -20.209
  510   1HG   ARG  66           HG1      ARG  66  18.717  19.864 -21.404
  511   2HG   ARG  66           HG2      ARG  66  18.121  18.701 -20.231
  512   1HD   ARG  66           HD1      ARG  66  16.620  20.220 -19.498
  513   2HD   ARG  66           HD2      ARG  66  17.943  21.253 -18.985
  514    HE   ARG  66           HE       ARG  66  16.513  22.450 -20.679
  515   1HH1  ARG  66          HH11      ARG  66  16.507  20.130 -22.618
  516   2HH1  ARG  66          HH12      ARG  66  17.622  20.683 -23.822
  517   1HH2  ARG  66          HH21      ARG  66  18.888  23.203 -21.760
  518   2HH2  ARG  66          HH22      ARG  66  18.997  22.478 -23.327
  519    H    PHE  67           HN       PHE  67  19.200  16.122 -18.928
  520    HA   PHE  67           HA       PHE  67  17.716  16.880 -16.440
  521   1HB   PHE  67           HB2      PHE  67  16.977  15.246 -18.858
  522   2HB   PHE  67           HB1      PHE  67  16.289  14.772 -17.313
  523    HD1  PHE  67           HD2      PHE  67  14.953  16.418 -16.000
  524    HD2  PHE  67           HD1      PHE  67  16.224  17.259 -19.974
  525    HE1  PHE  67           HE2      PHE  67  13.311  18.229 -16.141
  526    HE2  PHE  67           HE1      PHE  67  14.568  19.071 -20.116
  527    HZ   PHE  67           HZ       PHE  67  13.107  19.554 -18.202
  528    H    SER  68           HN       SER  68  18.891  16.093 -14.810
  529    HA   SER  68           HA       SER  68  19.904  13.290 -15.007
  530   1HB   SER  68           HB2      SER  68  20.605  15.591 -13.105
  531   2HB   SER  68           HB1      SER  68  21.328  13.972 -13.025
  532    HG   SER  68           HG       SER  68  21.396  15.835 -15.163
  533    H    GLY  69           HN       GLY  69  18.735  11.778 -14.017
  534   1HA   GLY  69           HA1      GLY  69  17.215  12.542 -11.555
  535   2HA   GLY  69           HA2      GLY  69  16.463  11.568 -12.810
  536    H    SER  70           HN       SER  70  18.439  11.538 -10.031
  537    HA   SER  70           HA       SER  70  18.469   8.577 -10.101
  538   1HB   SER  70           HB2      SER  70  20.612   9.128 -11.201
  539   2HB   SER  70           HB1      SER  70  21.006  10.299  -9.929
  540    HG   SER  70           HG       SER  70  21.736   8.672  -8.831
  541    H    GLY  71           HN       GLY  71  19.604   7.768  -8.033
  542   1HA   GLY  71           HA1      GLY  71  19.861   9.332  -5.699
  543   2HA   GLY  71           HA2      GLY  71  18.178   8.832  -5.790
  544    H    SER  72           HN       SER  72  20.321   8.075  -3.889
  545    HA   SER  72           HA       SER  72  20.670   5.190  -4.481
  546   1HB   SER  72           HB2      SER  72  22.052   5.336  -2.276
  547   2HB   SER  72           HB1      SER  72  22.672   6.304  -3.626
  548    HG   SER  72           HG       SER  72  20.709   7.359  -1.898
  549    H    GLY  73           HN       GLY  73  20.204   3.609  -2.821
  550   1HA   GLY  73           HA1      GLY  73  18.559   2.513  -1.545
  551   2HA   GLY  73           HA2      GLY  73  18.786   3.880  -0.461
  552    H    THR  74           HN       THR  74  17.165   5.343  -0.242
  553    HA   THR  74           HA       THR  74  14.813   5.040  -2.069
  554    HB   THR  74           HB       THR  74  13.379   5.535  -0.027
  555    HG1  THR  74           HG1      THR  74  15.746   6.298   0.814
  556   1HG2  THR  74          HG23      THR  74  15.123   3.149  -0.325
  557   2HG2  THR  74          HG21      THR  74  14.680   3.451   1.352
  558   3HG2  THR  74          HG22      THR  74  13.428   3.219   0.140
  559    H    ASP  75           HN       ASP  75  17.139   7.047  -1.668
  560    HA   ASP  75           HA       ASP  75  15.402   9.481  -1.598
  561   1HB   ASP  75           HB2      ASP  75  17.752  10.586  -1.112
  562   2HB   ASP  75           HB1      ASP  75  16.961   9.704   0.190
  563    H    PHE  76           HN       PHE  76  15.202  10.559  -3.452
  564    HA   PHE  76           HA       PHE  76  17.432  10.472  -5.422
  565   1HB   PHE  76           HB2      PHE  76  14.541  10.133  -6.305
  566   2HB   PHE  76           HB1      PHE  76  15.997   9.800  -7.231
  567    HD1  PHE  76           HD2      PHE  76  13.988   8.633  -4.320
  568    HD2  PHE  76           HD1      PHE  76  17.017   7.626  -7.136
  569    HE1  PHE  76           HE2      PHE  76  13.883   6.296  -3.594
  570    HE2  PHE  76           HE1      PHE  76  16.922   5.289  -6.395
  571    HZ   PHE  76           HZ       PHE  76  15.354   4.619  -4.627
  572    H    THR  77           HN       THR  77  17.063  12.018  -7.233
  573    HA   THR  77           HA       THR  77  15.232  14.247  -6.774
  574    HB   THR  77           HB       THR  77  18.236  14.496  -6.207
  575    HG1  THR  77           HG1      THR  77  16.717  14.109  -4.532
  576   1HG2  THR  77          HG23      THR  77  16.173  16.638  -6.952
  577   2HG2  THR  77          HG21      THR  77  17.596  17.018  -5.989
  578   3HG2  THR  77          HG22      THR  77  17.780  16.439  -7.642
  579    H    LEU  78           HN       LEU  78  15.282  15.797  -8.516
  580    HA   LEU  78           HA       LEU  78  16.589  14.689 -10.967
  581   1HB   LEU  78           HB2      LEU  78  13.999  14.813 -10.763
  582   2HB   LEU  78           HB1      LEU  78  14.183  16.555 -10.889
  583    HG   LEU  78           HG       LEU  78  15.644  14.957 -12.941
  584   1HD1  LEU  78          HD11      LEU  78  12.638  14.982 -12.647
  585   2HD1  LEU  78          HD12      LEU  78  13.379  14.898 -14.243
  586   3HD1  LEU  78          HD13      LEU  78  13.694  13.635 -13.060
  587   1HD2  LEU  78          HD23      LEU  78  14.704  17.626 -12.533
  588   2HD2  LEU  78          HD21      LEU  78  15.633  17.003 -13.892
  589   3HD2  LEU  78          HD22      LEU  78  13.873  16.987 -13.947
  590    H    LYS  79           HN       LYS  79  18.443  15.822 -11.146
  591    HA   LYS  79           HA       LYS  79  18.439  18.734 -10.660
  592   1HB   LYS  79           HB2      LYS  79  20.327  16.826 -10.183
  593   2HB   LYS  79           HB1      LYS  79  20.842  17.335 -11.786
  594   1HG   LYS  79           HG1      LYS  79  21.516  19.397 -11.059
  595   2HG   LYS  79           HG2      LYS  79  20.171  19.554  -9.938
  596   1HD   LYS  79           HD1      LYS  79  22.490  17.662  -9.447
  597   2HD   LYS  79           HD2      LYS  79  22.486  19.325  -8.870
  598   1HE   LYS  79           HE1      LYS  79  20.182  18.749  -7.826
  599   2HE   LYS  79           HE2      LYS  79  20.629  17.069  -8.095
  600   1HZ   LYS  79           HZ1      LYS  79  22.091  17.114  -6.433
  601   2HZ   LYS  79           HZ2      LYS  79  22.693  18.647  -6.850
  602    H    ILE  80           HN       ILE  80  18.148  20.169 -12.229
  603    HA   ILE  80           HA       ILE  80  18.466  19.232 -15.048
  604    HB   ILE  80           HB       ILE  80  16.781  21.528 -13.949
  605   1HG1  ILE  80          HG11      ILE  80  15.824  18.865 -15.044
  606   2HG1  ILE  80          HG12      ILE  80  16.065  19.157 -13.326
  607   1HG2  ILE  80          HG23      ILE  80  17.327  20.374 -16.696
  608   2HG2  ILE  80          HG21      ILE  80  15.733  21.046 -16.373
  609   3HG2  ILE  80          HG22      ILE  80  17.162  22.062 -16.224
  610   1HD1  ILE  80          HD12      ILE  80  14.538  21.326 -14.503
  611   2HD1  ILE  80          HD13      ILE  80  13.769  19.780 -14.839
  612   3HD1  ILE  80          HD11      ILE  80  14.096  20.254 -13.178
  613    H    SER  81           HN       SER  81  19.878  20.101 -16.302
  614    HA   SER  81           HA       SER  81  21.576  22.176 -15.191
  615   1HB   SER  81           HB2      SER  81  21.711  20.778 -17.903
  616   2HB   SER  81           HB1      SER  81  23.012  21.733 -17.167
  617    HG   SER  81           HG       SER  81  22.747  20.286 -15.306
  618    NH1  ARG  82           NH2      ARG  82  21.493  27.498 -18.184
  619    NH2  ARG  82           NH1      ARG  82  20.812  29.095 -19.654
  620    H    ARG  82           HN       ARG  82  18.918  22.049 -17.317
  621    HA   ARG  82           HA       ARG  82  19.186  24.959 -17.788
  622   1HB   ARG  82           HB2      ARG  82  19.350  22.820 -19.888
  623   2HB   ARG  82           HB1      ARG  82  18.360  24.221 -20.277
  624   1HG   ARG  82           HG1      ARG  82  21.035  24.780 -19.093
  625   2HG   ARG  82           HG2      ARG  82  21.016  24.158 -20.738
  626   1HD   ARG  82           HD1      ARG  82  19.759  25.994 -21.547
  627   2HD   ARG  82           HD2      ARG  82  19.182  26.426 -19.937
  628    HE   ARG  82           HE       ARG  82  21.943  26.952 -20.956
  629   1HH1  ARG  82          HH21      ARG  82  21.758  26.550 -18.013
  630   2HH1  ARG  82          HH22      ARG  82  21.472  28.156 -17.430
  631   1HH2  ARG  82          HH11      ARG  82  20.563  29.346 -20.588
  632   2HH2  ARG  82          HH12      ARG  82  20.788  29.782 -18.926
  633    H    VAL  83           HN       VAL  83  17.364  25.244 -16.506
  634    HA   VAL  83           HA       VAL  83  14.910  23.762 -17.034
  635    HB   VAL  83           HB       VAL  83  15.478  26.302 -15.427
  636   1HG1  VAL  83          HG13      VAL  83  12.981  24.594 -15.684
  637   2HG1  VAL  83          HG11      VAL  83  13.240  25.722 -14.358
  638   3HG1  VAL  83          HG12      VAL  83  13.132  26.318 -16.010
  639   1HG2  VAL  83          HG21      VAL  83  15.015  23.415 -14.594
  640   2HG2  VAL  83          HG22      VAL  83  16.570  24.241 -14.585
  641   3HG2  VAL  83          HG23      VAL  83  15.289  24.764 -13.494
  642    H    GLU  84           HN       GLU  84  13.646  24.129 -18.736
  643    HA   GLU  84           HA       GLU  84  13.571  26.914 -19.840
  644   1HB   GLU  84           HB2      GLU  84  13.683  24.198 -21.116
  645   2HB   GLU  84           HB1      GLU  84  12.679  25.397 -21.921
  646   1HG   GLU  84           HG1      GLU  84  14.787  25.771 -22.903
  647   2HG   GLU  84           HG2      GLU  84  14.761  26.973 -21.617
  648    H    ALA  85           HN       ALA  85  11.457  27.069 -21.315
  649    HA   ALA  85           HA       ALA  85   9.256  27.228 -19.549
  650   1HB   ALA  85           HB1      ALA  85   9.442  28.406 -21.773
  651   2HB   ALA  85           HB2      ALA  85   9.184  26.866 -22.587
  652   3HB   ALA  85           HB3      ALA  85   7.903  27.569 -21.603
  653    H    GLU  86           HN       GLU  86  10.492  24.540 -21.323
  654    HA   GLU  86           HA       GLU  86   8.107  22.924 -21.362
  655   1HB   GLU  86           HB2      GLU  86  11.050  22.102 -21.339
  656   2HB   GLU  86           HB1      GLU  86   9.711  21.059 -21.804
  657   1HG   GLU  86           HG1      GLU  86   9.145  22.963 -23.516
  658   2HG   GLU  86           HG2      GLU  86  10.807  23.476 -23.242
  659    H    ASP  87           HN       ASP  87  10.456  23.647 -18.944
  660    HA   ASP  87           HA       ASP  87   9.872  21.351 -17.253
  661   1HB   ASP  87           HB2      ASP  87  11.415  23.935 -17.004
  662   2HB   ASP  87           HB1      ASP  87  11.035  23.043 -15.537
  663    H    LEU  88           HN       LEU  88   8.621  24.596 -17.590
  664    HA   LEU  88           HA       LEU  88   7.361  24.978 -15.120
  665   1HB   LEU  88           HB2      LEU  88   6.299  25.636 -17.903
  666   2HB   LEU  88           HB1      LEU  88   5.670  26.321 -16.411
  667    HG   LEU  88           HG       LEU  88   8.448  26.687 -17.576
  668   1HD1  LEU  88          HD13      LEU  88   6.528  28.126 -18.378
  669   2HD1  LEU  88          HD11      LEU  88   6.334  28.693 -16.722
  670   3HD1  LEU  88          HD12      LEU  88   7.821  29.035 -17.602
  671   1HD2  LEU  88          HD21      LEU  88   7.386  27.141 -14.791
  672   2HD2  LEU  88          HD22      LEU  88   8.951  26.503 -15.287
  673   3HD2  LEU  88          HD23      LEU  88   8.614  28.224 -15.441
  674    H    GLY  89           HN       GLY  89   5.486  24.355 -14.184
  675   1HA   GLY  89           HA1      GLY  89   3.173  23.334 -14.656
  676   2HA   GLY  89           HA2      GLY  89   4.068  22.060 -15.482
  677    H    ILE  90           HN       ILE  90   3.644  20.347 -14.170
  678    HA   ILE  90           HA       ILE  90   4.564  20.604 -11.331
  679    HB   ILE  90           HB       ILE  90   2.340  18.798 -12.397
  680   1HG1  ILE  90          HG11      ILE  90   1.084  20.532 -10.731
  681   2HG1  ILE  90          HG12      ILE  90   2.327  21.593 -11.381
  682   1HG2  ILE  90          HG23      ILE  90   3.312  19.528  -9.590
  683   2HG2  ILE  90          HG21      ILE  90   1.861  18.584  -9.911
  684   3HG2  ILE  90          HG22      ILE  90   3.442  17.947 -10.353
  685   1HD1  ILE  90          HD12      ILE  90   1.565  20.467 -13.689
  686   2HD1  ILE  90          HD13      ILE  90   0.067  20.228 -12.795
  687   3HD1  ILE  90          HD11      ILE  90   0.707  21.852 -13.023
  688    OH   TYR  91           OH       TYR  91  11.162  18.403 -16.088
  689    H    TYR  91           HN       TYR  91   6.000  19.094 -10.654
  690    HA   TYR  91           HA       TYR  91   6.785  17.062 -12.679
  691   1HB   TYR  91           HB2      TYR  91   8.215  18.715 -10.704
  692   2HB   TYR  91           HB1      TYR  91   8.704  17.021 -10.635
  693    HD1  TYR  91           HD2      TYR  91   7.975  19.697 -13.155
  694    HD2  TYR  91           HD1      TYR  91  10.309  16.274 -12.192
  695    HE1  TYR  91           HE2      TYR  91   9.224  19.956 -15.248
  696    HE2  TYR  91           HE1      TYR  91  11.558  16.541 -14.285
  697    HH   TYR  91           HH       TYR  91  11.404  19.328 -16.186
  698    H    PHE  92           HN       PHE  92   6.856  14.930 -12.263
  699    HA   PHE  92           HA       PHE  92   5.921  14.017  -9.573
  700   1HB   PHE  92           HB2      PHE  92   5.062  12.968 -12.315
  701   2HB   PHE  92           HB1      PHE  92   4.577  12.263 -10.776
  702    HD1  PHE  92           HD1      PHE  92   4.356  15.329 -12.857
  703    HD2  PHE  92           HD2      PHE  92   2.803  13.238  -9.489
  704    HE1  PHE  92           HE1      PHE  92   2.505  16.924 -12.713
  705    HE2  PHE  92           HE2      PHE  92   0.943  14.837  -9.358
  706    HZ   PHE  92           HZ       PHE  92   0.789  16.681 -10.974
  707    H    CYS  93           HN       CYS  93   6.198  11.531  -9.464
  708    HA   CYS  93           HA       CYS  93   8.472  10.488 -10.989
  709   1HB   CYS  93           HB2      CYS  93   9.855  10.097  -8.971
  710   2HB   CYS  93           HB1      CYS  93   9.620  11.798  -9.269
  711    H    SER  94           HN       SER  94   8.674   8.286 -10.848
  712    HA   SER  94           HA       SER  94   6.999   6.812  -8.922
  713   1HB   SER  94           HB2      SER  94   5.771   5.601 -10.718
  714   2HB   SER  94           HB1      SER  94   5.541   7.342 -10.958
  715    HG   SER  94           HG       SER  94   7.093   5.526 -12.389
  716    H    GLN  95           HN       GLN  95   7.102   4.337 -10.135
  717    HA   GLN  95           HA       GLN  95   9.888   3.783 -10.888
  718   1HB   GLN  95           HB2      GLN  95  10.012   2.084  -8.921
  719   2HB   GLN  95           HB1      GLN  95  10.194   3.783  -8.503
  720   1HG   GLN  95           HG1      GLN  95   7.383   2.937  -8.544
  721   2HG   GLN  95           HG2      GLN  95   8.341   2.032  -7.381
  722   1HE2  GLN  95          HE22      GLN  95   7.929   4.687  -5.123
  723   2HE2  GLN  95          HE21      GLN  95   7.737   3.032  -5.440
  724    H    THR  96           HN       THR  96  10.130   1.800 -11.885
  725    HA   THR  96           HA       THR  96   7.570   0.334 -12.372
  726    HB   THR  96           HB       THR  96  10.111   0.107 -14.070
  727    HG1  THR  96           HG1      THR  96   9.618   2.273 -13.970
  728   1HG2  THR  96          HG23      THR  96   7.107   0.021 -14.714
  729   2HG2  THR  96          HG21      THR  96   8.410  -0.299 -15.854
  730   3HG2  THR  96          HG22      THR  96   8.103  -1.421 -14.531
  731    H    THR  97           HN       THR  97  10.404   0.066 -10.648
  732    HA   THR  97           HA       THR  97  10.991  -2.733 -11.037
  733    HB   THR  97           HB       THR  97  11.977  -0.518  -9.363
  734    HG1  THR  97           HG1      THR  97  13.656  -2.407  -9.407
  735   1HG2  THR  97          HG21      THR  97  10.937  -2.236  -7.590
  736   2HG2  THR  97          HG22      THR  97  12.240  -3.289  -8.121
  737   3HG2  THR  97          HG23      THR  97  12.607  -1.728  -7.388
  738    H    HIS  98           HN       HIS  98   8.707  -0.992  -9.093
  739    HA   HIS  98           HA       HIS  98   7.986  -3.487  -7.631
  740   1HB   HIS  98           HB2      HIS  98   7.421  -0.532  -7.203
  741   2HB   HIS  98           HB1      HIS  98   6.465  -1.757  -6.374
  742    HD2  HIS  98           HD2      HIS  98  10.221  -0.564  -6.569
  743    HE1  HIS  98           HE1      HIS  98   9.715  -2.830  -3.148
  744    H    VAL  99           HN       VAL  99   5.940  -4.341  -7.723
  745    HA   VAL  99           HA       VAL  99   4.064  -3.108  -9.684
  746    HB   VAL  99           HB       VAL  99   4.535  -6.108  -9.442
  747   1HG1  VAL  99          HG11      VAL  99   3.316  -4.366 -11.617
  748   2HG1  VAL  99          HG12      VAL  99   3.457  -6.120 -11.671
  749   3HG1  VAL  99          HG13      VAL  99   2.409  -5.358 -10.479
  750   1HG2  VAL  99          HG23      VAL  99   5.874  -4.081 -11.264
  751   2HG2  VAL  99          HG21      VAL  99   6.659  -5.207 -10.160
  752   3HG2  VAL  99          HG22      VAL  99   5.852  -5.809 -11.604
  753    HA   PRO 100           HA       PRO 100   2.051  -3.013 -10.214
  754   1HB   PRO 100           HB2      PRO 100   0.358  -1.087  -8.913
  755   2HB   PRO 100           HB1      PRO 100  -0.156  -2.443  -9.916
  756   1HG   PRO 100           HG1      PRO 100  -0.378  -2.157  -7.032
  757   2HG   PRO 100           HG2      PRO 100  -0.999  -3.458  -8.049
  758   1HD   PRO 100           HD1      PRO 100   1.268  -3.546  -6.269
  759   2HD   PRO 100           HD2      PRO 100   0.664  -4.843  -7.316
  760    HA   PRO 101           HA       PRO 101   4.956   0.220  -9.620
  761   1HB   PRO 101           HB2      PRO 101   3.962   1.809 -11.806
  762   2HB   PRO 101           HB1      PRO 101   5.301   0.663 -11.854
  763   1HG   PRO 101           HG1      PRO 101   2.637   0.367 -12.990
  764   2HG   PRO 101           HG2      PRO 101   4.020  -0.715 -13.157
  765   1HD   PRO 101           HD1      PRO 101   1.658  -1.131 -11.572
  766   2HD   PRO 101           HD2      PRO 101   3.083  -2.181 -11.681
  767    H    THR 102           HN       THR 102   4.834   1.796  -8.142
  768    HA   THR 102           HA       THR 102   2.268   3.198  -7.739
  769    HB   THR 102           HB       THR 102   3.680   4.202  -5.733
  770    HG1  THR 102           HG1      THR 102   5.635   3.334  -5.540
  771   1HG2  THR 102          HG22      THR 102   3.065   1.237  -6.142
  772   2HG2  THR 102          HG23      THR 102   3.783   1.805  -4.639
  773   3HG2  THR 102          HG21      THR 102   2.194   2.382  -5.125
  774    H    PHE 103           HN       PHE 103   1.847   5.127  -8.507
  775    HA   PHE 103           HA       PHE 103   4.131   6.916  -9.232
  776   1HB   PHE 103           HB2      PHE 103   3.226   6.178 -11.336
  777   2HB   PHE 103           HB1      PHE 103   1.571   6.241 -10.740
  778    HD1  PHE 103           HD2      PHE 103   0.467   8.459 -10.381
  779    HD2  PHE 103           HD1      PHE 103   4.309   8.166 -12.192
  780    HE1  PHE 103           HE2      PHE 103   0.263  10.767 -11.193
  781    HE2  PHE 103           HE1      PHE 103   4.106  10.476 -12.994
  782    HZ   PHE 103           HZ       PHE 103   2.082  11.779 -12.499
  783    H    GLY 104           HN       GLY 104   3.980   8.980  -8.549
  784   1HA   GLY 104           HA1      GLY 104   1.514  10.333  -7.951
  785   2HA   GLY 104           HA2      GLY 104   2.224   9.715  -6.462
  786    H    GLY 105           HN       GLY 105   2.320  12.059  -5.961
  787   1HA   GLY 105           HA1      GLY 105   4.268  13.495  -5.400
  788   2HA   GLY 105           HA2      GLY 105   4.857  13.223  -7.036
  789    H    GLY 106           HN       GLY 106   4.900  15.693  -6.752
  790   1HA   GLY 106           HA1      GLY 106   3.171  16.925  -8.516
  791   2HA   GLY 106           HA2      GLY 106   2.332  17.059  -6.976
  792    H    THR 107           HN       THR 107   5.695  17.479  -8.125
  793    HA   THR 107           HA       THR 107   6.074  19.698  -6.245
  794    HB   THR 107           HB       THR 107   7.878  18.643  -8.513
  795    HG1  THR 107           HG1      THR 107   8.279  18.357  -5.753
  796   1HG2  THR 107          HG21      THR 107   8.087  20.925  -6.631
  797   2HG2  THR 107          HG22      THR 107   9.380  19.759  -6.372
  798   3HG2  THR 107          HG23      THR 107   9.169  20.503  -7.954
  799    H    LYS 108           HN       LYS 108   5.119  21.571  -6.697
  800    HA   LYS 108           HA       LYS 108   4.311  22.379  -9.323
  801   1HB   LYS 108           HB2      LYS 108   4.612  23.788  -6.658
  802   2HB   LYS 108           HB1      LYS 108   4.169  24.699  -8.098
  803   1HG   LYS 108           HG1      LYS 108   2.209  23.316  -8.451
  804   2HG   LYS 108           HG2      LYS 108   2.701  22.210  -7.171
  805   1HD   LYS 108           HD1      LYS 108   1.680  23.498  -5.628
  806   2HD   LYS 108           HD2      LYS 108   2.660  24.879  -6.106
  807   1HE   LYS 108           HE1      LYS 108   1.080  25.461  -7.866
  808   2HE   LYS 108           HE2      LYS 108   0.148  23.998  -7.566
  809   1HZ   LYS 108           HZ1      LYS 108   0.332  25.251  -5.131
  810   2HZ   LYS 108           HZ2      LYS 108   0.032  26.505  -6.240
  811    H    LEU 109           HN       LEU 109   5.829  22.575 -10.844
  812    HA   LEU 109           HA       LEU 109   8.293  24.118 -10.225
  813   1HB   LEU 109           HB2      LEU 109   7.917  21.782 -11.650
  814   2HB   LEU 109           HB1      LEU 109   7.893  22.965 -12.951
  815    HG   LEU 109           HG       LEU 109  10.021  23.823 -11.382
  816   1HD1  LEU 109          HD12      LEU 109   9.754  21.613 -10.132
  817   2HD1  LEU 109          HD13      LEU 109  10.213  20.806 -11.629
  818   3HD1  LEU 109          HD11      LEU 109  11.347  21.891 -10.830
  819   1HD2  LEU 109          HD22      LEU 109   9.850  23.604 -13.884
  820   2HD2  LEU 109          HD23      LEU 109  11.390  23.048 -13.236
  821   3HD2  LEU 109          HD21      LEU 109  10.162  21.879 -13.709
  822    H    GLU 110           HN       GLU 110   7.223  26.128 -10.121
  823    HA   GLU 110           HA       GLU 110   6.257  27.143 -12.757
  824   1HB   GLU 110           HB2      GLU 110   5.503  27.620  -9.929
  825   2HB   GLU 110           HB1      GLU 110   5.684  29.105 -10.858
  826   1HG   GLU 110           HG1      GLU 110   4.164  28.193 -12.601
  827   2HG   GLU 110           HG2      GLU 110   3.968  26.722 -11.652
  828    H    ILE 111           HN       ILE 111   7.025  29.047 -13.563
  829    HA   ILE 111           HA       ILE 111   9.762  29.570 -13.369
  830    HB   ILE 111           HB       ILE 111   7.739  30.423 -14.970
  831   1HG1  ILE 111          HG11      ILE 111  10.186  32.166 -14.779
  832   2HG1  ILE 111          HG12      ILE 111  10.356  30.468 -15.208
  833   1HG2  ILE 111          HG21      ILE 111   7.115  32.062 -13.071
  834   2HG2  ILE 111          HG22      ILE 111   8.608  32.911 -13.447
  835   3HG2  ILE 111          HG23      ILE 111   7.337  32.791 -14.657
  836   1HD1  ILE 111          HD11      ILE 111   8.302  32.174 -16.610
  837   2HD1  ILE 111          HD12      ILE 111   9.985  32.224 -17.123
  838   3HD1  ILE 111          HD13      ILE 111   9.093  30.706 -17.180
  839    H    LYS 112           HN       LYS 112  10.778  31.685 -12.690
  840    HA   LYS 112           HA       LYS 112  10.717  31.991  -9.908
  841   1HB   LYS 112           HB2      LYS 112  12.420  32.913 -11.633
  842   2HB   LYS 112           HB1      LYS 112  11.328  34.278 -11.827
  843   1HG   LYS 112           HG1      LYS 112  11.445  34.336  -9.173
  844   2HG   LYS 112           HG2      LYS 112  12.956  33.474  -9.430
  845   1HD   LYS 112           HD1      LYS 112  12.473  35.887 -11.130
  846   2HD   LYS 112           HD2      LYS 112  12.814  36.171  -9.429
  847   1HE   LYS 112           HE1      LYS 112  14.629  34.166 -10.467
  848   2HE   LYS 112           HE2      LYS 112  14.686  35.606 -11.476
  849   1HZ   LYS 112           HZ1      LYS 112  15.164  35.411  -8.563
  850   2HZ   LYS 112           HZ2      LYS 112  16.240  35.937  -9.768
  851    NH1  ARG 113           NH1      ARG 113   9.054  39.288 -14.957
  852    NH2  ARG 113           NH2      ARG 113   8.694  41.098 -13.626
  853    H    ARG 113           HN       ARG 113   9.222  34.222 -12.255
  854    HA   ARG 113           HA       ARG 113   6.933  34.617 -10.482
  855   1HB   ARG 113           HB2      ARG 113   7.323  37.068 -10.206
  856   2HB   ARG 113           HB1      ARG 113   8.639  36.148  -9.490
  857   1HG   ARG 113           HG1      ARG 113   9.853  37.702 -10.726
  858   2HG   ARG 113           HG2      ARG 113   9.710  36.410 -11.911
  859   1HD   ARG 113           HD1      ARG 113   8.032  37.532 -13.123
  860   2HD   ARG 113           HD2      ARG 113   7.576  38.537 -11.749
  861    HE   ARG 113           HE       ARG 113  10.179  39.313 -12.266
  862   1HH1  ARG 113          HH11      ARG 113   9.311  38.326 -15.039
  863   2HH1  ARG 113          HH12      ARG 113   8.818  39.814 -15.772
  864   1HH2  ARG 113          HH21      ARG 113   8.680  41.494 -12.709
  865   2HH2  ARG 113          HH22      ARG 113   8.451  41.657 -14.417
   
  Start of MODEL          10
 Raw file had  865 H/Q atoms
  Start of MODEL   10
    1   1H    ASP   1           HT3      ASP   1   1.976  -0.489  -0.324
    2   2H    ASP   1           HT1      ASP   1   1.483   0.607  -1.524
    3   3H    ASP   1           HT2      ASP   1   0.847  -0.968  -1.501
    4    HA   ASP   1           HA       ASP   1   2.881  -1.928  -2.132
    5   1HB   ASP   1           HB2      ASP   1   3.029   0.546  -3.830
    6   2HB   ASP   1           HB1      ASP   1   2.956  -1.141  -4.331
    7    H    VAL   2           HN       VAL   2   5.011  -0.943  -3.368
    8    HA   VAL   2           HA       VAL   2   6.673  -0.308  -1.148
    9    HB   VAL   2           HB       VAL   2   7.252  -0.048  -4.138
   10   1HG1  VAL   2          HG13      VAL   2   8.878   1.076  -2.529
   11   2HG1  VAL   2          HG11      VAL   2   9.200  -0.521  -1.861
   12   3HG1  VAL   2          HG12      VAL   2   9.585  -0.177  -3.542
   13   1HG2  VAL   2          HG23      VAL   2   7.388  -2.366  -2.198
   14   2HG2  VAL   2          HG21      VAL   2   6.595  -2.305  -3.769
   15   3HG2  VAL   2          HG22      VAL   2   8.353  -2.345  -3.671
   16    H    VAL   3           HN       VAL   3   7.073   1.606  -0.233
   17    HA   VAL   3           HA       VAL   3   6.052   4.060  -1.494
   18    HB   VAL   3           HB       VAL   3   7.592   3.705   1.125
   19   1HG1  VAL   3          HG12      VAL   3   5.857   5.920  -0.012
   20   2HG1  VAL   3          HG13      VAL   3   6.303   5.833   1.689
   21   3HG1  VAL   3          HG11      VAL   3   7.551   6.021   0.461
   22   1HG2  VAL   3          HG23      VAL   3   4.632   3.530   0.492
   23   2HG2  VAL   3          HG21      VAL   3   5.633   2.329   1.302
   24   3HG2  VAL   3          HG22      VAL   3   5.233   3.837   2.118
   25    H    MET   4           HN       MET   4   7.303   5.822  -2.114
   26    HA   MET   4           HA       MET   4  10.228   5.258  -2.373
   27   1HB   MET   4           HB2      MET   4   8.193   6.398  -4.286
   28   2HB   MET   4           HB1      MET   4   9.847   6.989  -4.393
   29   1HG   MET   4           HG1      MET   4  10.514   4.490  -4.354
   30   2HG   MET   4           HG2      MET   4   8.839   4.169  -4.714
   31   1HE   MET   4           HE2      MET   4  12.054   4.170  -5.777
   32   2HE   MET   4           HE3      MET   4  12.179   4.659  -7.468
   33   3HE   MET   4           HE1      MET   4  12.196   5.878  -6.194
   34    H    THR   5           HN       THR   5  10.990   6.393  -0.655
   35    HA   THR   5           HA       THR   5  10.036   9.117  -0.114
   36    HB   THR   5           HB       THR   5  12.482   7.745   1.132
   37    HG1  THR   5           HG1      THR   5  10.332   7.405   2.583
   38   1HG2  THR   5          HG22      THR   5  10.298   9.618   2.214
   39   2HG2  THR   5          HG23      THR   5  11.667   9.011   3.141
   40   3HG2  THR   5          HG21      THR   5  11.932  10.138   1.814
   41    H    GLN   6           HN       GLN   6  10.655  10.622  -1.541
   42    HA   GLN   6           HA       GLN   6  13.267  10.501  -2.864
   43   1HB   GLN   6           HB2      GLN   6  10.738  11.928  -3.191
   44   2HB   GLN   6           HB1      GLN   6  12.078  13.066  -3.254
   45   1HG   GLN   6           HG1      GLN   6  12.631  10.609  -4.762
   46   2HG   GLN   6           HG2      GLN   6  11.215  11.460  -5.364
   47   1HE2  GLN   6          HE22      GLN   6  13.061  14.296  -6.476
   48   2HE2  GLN   6          HE21      GLN   6  11.521  13.747  -6.027
   49    H    THR   7           HN       THR   7  15.034  11.706  -2.440
   50    HA   THR   7           HA       THR   7  14.960  13.993  -0.628
   51    HB   THR   7           HB       THR   7  16.929  12.270   0.606
   52    HG1  THR   7           HG1      THR   7  14.348  11.119   0.258
   53   1HG2  THR   7          HG21      THR   7  14.344  13.598   1.327
   54   2HG2  THR   7          HG22      THR   7  14.684  12.143   2.258
   55   3HG2  THR   7          HG23      THR   7  15.823  13.484   2.275
   56    HA   PRO   8           HA       PRO   8  16.627  14.809   0.740
   57   1HB   PRO   8           HB2      PRO   8  17.809  17.338   0.178
   58   2HB   PRO   8           HB1      PRO   8  18.523  16.061   1.163
   59   1HG   PRO   8           HG1      PRO   8  19.323  16.958  -1.490
   60   2HG   PRO   8           HG2      PRO   8  20.133  15.794  -0.441
   61   1HD   PRO   8           HD1      PRO   8  18.537  15.259  -2.807
   62   2HD   PRO   8           HD2      PRO   8  19.399  14.092  -1.782
   63    H    LEU   9           HN       LEU   9  15.521  17.036   1.178
   64    HA   LEU   9           HA       LEU   9  13.367  17.283  -0.763
   65   1HB   LEU   9           HB2      LEU   9  14.049  18.391   1.931
   66   2HB   LEU   9           HB1      LEU   9  13.015  19.410   0.937
   67    HG   LEU   9           HG       LEU   9  11.495  17.450   0.576
   68   1HD1  LEU   9          HD12      LEU   9  13.574  16.166   2.344
   69   2HD1  LEU   9          HD13      LEU   9  11.910  15.591   2.392
   70   3HD1  LEU   9          HD11      LEU   9  12.820  15.529   0.886
   71   1HD2  LEU   9          HD21      LEU   9  11.103  19.105   2.408
   72   2HD2  LEU   9          HD22      LEU   9  10.518  17.498   2.826
   73   3HD2  LEU   9          HD23      LEU   9  12.036  18.084   3.498
   74    H    SER  10           HN       SER  10  16.330  18.959  -0.128
   75    HA   SER  10           HA       SER  10  15.723  20.774  -2.414
   76   1HB   SER  10           HB2      SER  10  16.858  21.565   0.322
   77   2HB   SER  10           HB1      SER  10  16.884  22.637  -1.092
   78    HG   SER  10           HG       SER  10  14.873  22.220   0.549
   79    H    LEU  11           HN       LEU  11  17.463  21.245  -3.715
   80    HA   LEU  11           HA       LEU  11  20.135  20.233  -2.873
   81   1HB   LEU  11           HB2      LEU  11  18.590  18.687  -4.443
   82   2HB   LEU  11           HB1      LEU  11  19.201  19.752  -5.699
   83    HG   LEU  11           HG       LEU  11  21.542  19.258  -4.552
   84   1HD1  LEU  11          HD13      LEU  11  19.821  16.885  -3.747
   85   2HD1  LEU  11          HD11      LEU  11  21.580  16.909  -3.675
   86   3HD1  LEU  11          HD12      LEU  11  20.643  17.996  -2.656
   87   1HD2  LEU  11          HD23      LEU  11  19.995  17.354  -6.336
   88   2HD2  LEU  11          HD21      LEU  11  21.096  18.633  -6.839
   89   3HD2  LEU  11          HD22      LEU  11  21.722  17.198  -6.033
   90    HA   PRO  12           HA       PRO  12  20.282  24.420  -4.830
   91   1HB   PRO  12           HB2      PRO  12  22.101  25.253  -2.769
   92   2HB   PRO  12           HB1      PRO  12  20.410  25.724  -2.939
   93   1HG   PRO  12           HG1      PRO  12  21.585  23.927  -0.979
   94   2HG   PRO  12           HG2      PRO  12  19.921  24.501  -1.072
   95   1HD   PRO  12           HD1      PRO  12  20.921  21.876  -1.732
   96   2HD   PRO  12           HD2      PRO  12  19.250  22.459  -1.847
   97    H    VAL  13           HN       VAL  13  21.582  24.012  -6.548
   98    HA   VAL  13           HA       VAL  13  24.510  23.784  -6.021
   99    HB   VAL  13           HB       VAL  13  24.716  22.022  -7.721
  100   1HG1  VAL  13          HG11      VAL  13  23.913  21.461  -5.320
  101   2HG1  VAL  13          HG12      VAL  13  22.334  21.195  -6.051
  102   3HG1  VAL  13          HG13      VAL  13  23.710  20.218  -6.549
  103   1HG2  VAL  13          HG21      VAL  13  21.754  22.545  -8.122
  104   2HG2  VAL  13          HG22      VAL  13  23.041  22.676  -9.316
  105   3HG2  VAL  13          HG23      VAL  13  22.547  21.092  -8.723
  106    H    SER  14           HN       SER  14  25.847  24.562  -7.719
  107    HA   SER  14           HA       SER  14  24.552  26.685  -9.285
  108   1HB   SER  14           HB2      SER  14  27.469  25.920  -9.636
  109   2HB   SER  14           HB1      SER  14  26.746  27.539  -9.556
  110    HG   SER  14           HG       SER  14  27.680  25.973  -7.554
  111    H    LEU  15           HN       LEU  15  24.497  26.785 -11.553
  112    HA   LEU  15           HA       LEU  15  24.124  24.281 -12.884
  113   1HB   LEU  15           HB2      LEU  15  24.618  27.050 -14.072
  114   2HB   LEU  15           HB1      LEU  15  23.981  25.666 -14.953
  115    HG   LEU  15           HG       LEU  15  22.676  26.986 -12.544
  116   1HD1  LEU  15          HD12      LEU  15  21.897  26.907 -15.478
  117   2HD1  LEU  15          HD13      LEU  15  20.944  27.636 -14.191
  118   3HD1  LEU  15          HD11      LEU  15  22.510  28.317 -14.619
  119   1HD2  LEU  15          HD23      LEU  15  22.163  24.457 -14.053
  120   2HD2  LEU  15          HD21      LEU  15  21.880  24.820 -12.355
  121   3HD2  LEU  15          HD22      LEU  15  20.759  25.407 -13.580
  122    H    GLY  16           HN       GLY  16  25.996  23.150 -12.464
  123   1HA   GLY  16           HA1      GLY  16  27.839  22.778 -14.457
  124   2HA   GLY  16           HA2      GLY  16  28.584  24.050 -13.490
  125    H    ASP  17           HN       ASP  17  27.429  23.082 -10.996
  126    HA   ASP  17           HA       ASP  17  29.509  21.182 -10.299
  127   1HB   ASP  17           HB2      ASP  17  27.036  21.949  -8.676
  128   2HB   ASP  17           HB1      ASP  17  28.547  21.309  -8.045
  129    H    GLN  18           HN       GLN  18  28.891  19.186  -9.004
  130    HA   GLN  18           HA       GLN  18  27.056  17.599 -10.691
  131   1HB   GLN  18           HB2      GLN  18  29.023  16.859  -8.477
  132   2HB   GLN  18           HB1      GLN  18  28.032  15.678  -9.325
  133   1HG   GLN  18           HG1      GLN  18  29.073  16.250 -11.456
  134   2HG   GLN  18           HG2      GLN  18  29.957  17.581 -10.712
  135   1HE2  GLN  18          HE22      GLN  18  32.209  15.335  -8.946
  136   2HE2  GLN  18          HE21      GLN  18  31.354  16.780  -8.703
  137    H    ALA  19           HN       ALA  19  25.181  16.718 -10.002
  138    HA   ALA  19           HA       ALA  19  24.390  17.253  -7.159
  139   1HB   ALA  19           HB1      ALA  19  22.996  17.783  -9.761
  140   2HB   ALA  19           HB2      ALA  19  21.989  17.187  -8.445
  141   3HB   ALA  19           HB3      ALA  19  22.904  18.678  -8.248
  142    H    SER  20           HN       SER  20  23.497  15.587  -6.059
  143    HA   SER  20           HA       SER  20  22.852  13.095  -7.591
  144   1HB   SER  20           HB2      SER  20  24.374  13.289  -4.938
  145   2HB   SER  20           HB1      SER  20  23.971  11.786  -5.791
  146    HG   SER  20           HG       SER  20  25.143  13.782  -7.315
  147    H    ILE  21           HN       ILE  21  20.691  13.028  -7.394
  148    HA   ILE  21           HA       ILE  21  19.445  13.669  -4.777
  149    HB   ILE  21           HB       ILE  21  18.166  12.820  -7.417
  150   1HG1  ILE  21          HG11      ILE  21  17.758  15.593  -6.732
  151   2HG1  ILE  21          HG12      ILE  21  19.483  15.255  -6.751
  152   1HG2  ILE  21          HG21      ILE  21  17.107  14.070  -4.841
  153   2HG2  ILE  21          HG22      ILE  21  16.163  13.996  -6.325
  154   3HG2  ILE  21          HG23      ILE  21  16.656  12.510  -5.519
  155   1HD1  ILE  21          HD11      ILE  21  19.102  14.091  -8.995
  156   2HD1  ILE  21          HD12      ILE  21  17.484  14.786  -8.977
  157   3HD1  ILE  21          HD13      ILE  21  18.894  15.840  -9.004
  158    H    SER  22           HN       SER  22  18.618  12.170  -3.450
  159    HA   SER  22           HA       SER  22  19.074   9.329  -4.178
  160   1HB   SER  22           HB2      SER  22  18.497  10.689  -1.498
  161   2HB   SER  22           HB1      SER  22  18.805   8.952  -1.697
  162    HG   SER  22           HG       SER  22  20.776   9.908  -1.339
  163    H    CYS  23           HN       CYS  23  17.552   7.732  -3.322
  164    HA   CYS  23           HA       CYS  23  14.762   8.494  -2.915
  165   1HB   CYS  23           HB2      CYS  23  15.771   7.294  -5.507
  166   2HB   CYS  23           HB1      CYS  23  14.149   6.956  -4.963
  167    NH1  ARG  24           NH2      ARG  24  19.059   6.475   1.905
  168    NH2  ARG  24           NH1      ARG  24  18.720   7.294   3.997
  169    H    ARG  24           HN       ARG  24  14.113   7.094  -1.410
  170    HA   ARG  24           HA       ARG  24  15.376   4.395  -1.337
  171   1HB   ARG  24           HB2      ARG  24  14.015   6.187   0.687
  172   2HB   ARG  24           HB1      ARG  24  14.125   4.458   1.003
  173   1HG   ARG  24           HG1      ARG  24  16.434   4.503   1.209
  174   2HG   ARG  24           HG2      ARG  24  16.615   5.853   0.095
  175   1HD   ARG  24           HD1      ARG  24  16.285   7.432   1.745
  176   2HD   ARG  24           HD2      ARG  24  15.147   6.418   2.632
  177    HE   ARG  24           HE       ARG  24  17.034   5.265   3.646
  178   1HH1  ARG  24          HH21      ARG  24  18.727   5.925   1.137
  179   2HH1  ARG  24          HH22      ARG  24  19.952   6.919   1.851
  180   1HH2  ARG  24          HH11      ARG  24  18.134   7.360   4.804
  181   2HH2  ARG  24          HH12      ARG  24  19.602   7.760   3.980
  182    H    SER  25           HN       SER  25  14.170   2.515  -1.196
  183    HA   SER  25           HA       SER  25  11.264   2.800  -1.871
  184   1HB   SER  25           HB2      SER  25  13.262   0.674  -2.820
  185   2HB   SER  25           HB1      SER  25  11.541   0.716  -3.248
  186    HG   SER  25           HG       SER  25  12.025   2.984  -3.881
  187    H    SER  26           HN       SER  26   9.979   2.024  -0.369
  188    HA   SER  26           HA       SER  26  10.333   1.012   2.059
  189   1HB   SER  26           HB2      SER  26   8.377   0.003  -0.040
  190   2HB   SER  26           HB1      SER  26   8.299  -0.557   1.641
  191    HG   SER  26           HG       SER  26   8.067   1.532   2.325
  192    H    GLN  27           HN       GLN  27   9.711  -1.584  -0.281
  193    HA   GLN  27           HA       GLN  27  11.755  -3.191   1.173
  194   1HB   GLN  27           HB2      GLN  27   9.049  -3.689   0.807
  195   2HB   GLN  27           HB1      GLN  27   9.759  -4.599  -0.522
  196   1HG   GLN  27           HG1      GLN  27   9.909  -6.176   1.172
  197   2HG   GLN  27           HG2      GLN  27  11.459  -5.366   1.371
  198   1HE2  GLN  27          HE22      GLN  27  10.429  -3.626   4.355
  199   2HE2  GLN  27          HE21      GLN  27  11.419  -3.459   2.987
  200    H    SER  28           HN       SER  28  12.675  -1.545  -0.789
  201    HA   SER  28           HA       SER  28  14.050  -1.586  -2.680
  202   1HB   SER  28           HB2      SER  28  14.916  -3.726  -1.612
  203   2HB   SER  28           HB1      SER  28  13.700  -4.625  -2.536
  204    HG   SER  28           HG       SER  28  15.012  -4.470  -4.159
  205    H    LEU  29           HN       LEU  29  14.101  -2.227  -4.993
  206    HA   LEU  29           HA       LEU  29  11.302  -2.601  -5.985
  207   1HB   LEU  29           HB2      LEU  29  13.641  -1.245  -7.393
  208   2HB   LEU  29           HB1      LEU  29  11.968  -1.252  -7.927
  209    HG   LEU  29           HG       LEU  29  12.778  -0.117  -5.238
  210   1HD1  LEU  29          HD11      LEU  29  13.861   0.940  -7.406
  211   2HD1  LEU  29          HD12      LEU  29  12.249   1.603  -7.646
  212   3HD1  LEU  29          HD13      LEU  29  13.149   1.986  -6.183
  213   1HD2  LEU  29          HD23      LEU  29  10.374   0.199  -7.067
  214   2HD2  LEU  29          HD21      LEU  29  10.404  -0.615  -5.507
  215   3HD2  LEU  29          HD22      LEU  29  10.621   1.130  -5.593
  216    H    VAL  30           HN       VAL  30  12.961  -4.791  -5.362
  217    HA   VAL  30           HA       VAL  30  13.982  -5.756  -7.967
  218    HB   VAL  30           HB       VAL  30  13.969  -6.965  -5.160
  219   1HG1  VAL  30          HG13      VAL  30  14.909  -8.041  -7.823
  220   2HG1  VAL  30          HG11      VAL  30  15.681  -8.554  -6.326
  221   3HG1  VAL  30          HG12      VAL  30  13.966  -8.859  -6.581
  222   1HG2  VAL  30          HG22      VAL  30  15.498  -4.956  -5.835
  223   2HG2  VAL  30          HG23      VAL  30  16.254  -6.345  -5.061
  224   3HG2  VAL  30          HG21      VAL  30  16.366  -6.138  -6.806
  225    H    HIS  31           HN       HIS  31  12.613  -6.666  -9.317
  226    HA   HIS  31           HA       HIS  31   9.992  -7.590  -8.543
  227   1HB   HIS  31           HB2      HIS  31  10.737  -6.700 -10.845
  228   2HB   HIS  31           HB1      HIS  31  11.511  -8.258 -11.106
  229    HD2  HIS  31           HD2      HIS  31   7.972  -6.661 -11.072
  230    HE1  HIS  31           HE1      HIS  31   7.520 -10.681 -11.925
  231    H    SER  32           HN       SER  32   9.288  -9.860  -9.309
  232    HA   SER  32           HA       SER  32  10.706 -11.783  -7.682
  233   1HB   SER  32           HB2      SER  32   8.442 -12.090  -9.724
  234   2HB   SER  32           HB1      SER  32   8.984 -13.389  -8.643
  235    HG   SER  32           HG       SER  32   8.413 -10.811  -7.650
  236    H    ASN  33           HN       ASN  33  12.792 -11.460  -8.806
  237    HA   ASN  33           HA       ASN  33  13.516 -13.708 -10.353
  238   1HB   ASN  33           HB2      ASN  33  14.061 -12.223 -12.515
  239   2HB   ASN  33           HB1      ASN  33  12.460 -12.929 -12.324
  240   1HD2  ASN  33          HD22      ASN  33  10.964  -9.768 -12.471
  241   2HD2  ASN  33          HD21      ASN  33  10.904 -11.420 -12.856
  242    H    GLY  34           HN       GLY  34  14.124 -10.419  -9.411
  243   1HA   GLY  34           HA1      GLY  34  16.240  -9.967  -8.197
  244   2HA   GLY  34           HA2      GLY  34  17.050 -11.047  -9.326
  245    H    ASN  35           HN       ASN  35  14.650  -8.867 -10.524
  246    HA   ASN  35           HA       ASN  35  16.824  -7.161 -11.678
  247   1HB   ASN  35           HB2      ASN  35  14.223  -8.221 -12.847
  248   2HB   ASN  35           HB1      ASN  35  15.035  -6.829 -13.558
  249   1HD2  ASN  35          HD22      ASN  35  17.443  -8.783 -15.190
  250   2HD2  ASN  35          HD21      ASN  35  16.721  -7.262 -14.984
  251    H    THR  36           HN       THR  36  16.546  -4.972 -11.689
  252    HA   THR  36           HA       THR  36  14.159  -3.955 -10.198
  253    HB   THR  36           HB       THR  36  17.037  -2.890 -10.383
  254    HG1  THR  36           HG1      THR  36  15.366  -3.705  -8.230
  255   1HG2  THR  36          HG21      THR  36  14.442  -1.652  -9.452
  256   2HG2  THR  36          HG22      THR  36  15.822  -1.477  -8.372
  257   3HG2  THR  36          HG23      THR  36  15.902  -0.844 -10.013
  258    OH   TYR  37           OH       TYR  37  12.597  -7.525 -15.096
  259    H    TYR  37           HN       TYR  37  12.836  -2.589 -11.216
  260    HA   TYR  37           HA       TYR  37  13.788  -1.389 -13.791
  261   1HB   TYR  37           HB2      TYR  37  10.918  -2.037 -12.967
  262   2HB   TYR  37           HB1      TYR  37  11.462  -1.531 -14.564
  263    HD1  TYR  37           HD1      TYR  37  11.604  -4.292 -12.091
  264    HD2  TYR  37           HD2      TYR  37  12.419  -3.116 -16.098
  265    HE1  TYR  37           HE1      TYR  37  11.973  -6.635 -12.706
  266    HE2  TYR  37           HE2      TYR  37  12.785  -5.463 -16.709
  267    HH   TYR  37           HH       TYR  37  11.773  -7.995 -14.947
  268    H    LEU  38           HN       LEU  38  14.563   0.470 -12.658
  269    HA   LEU  38           HA       LEU  38  12.552   2.146 -11.272
  270   1HB   LEU  38           HB2      LEU  38  15.201   1.722 -10.794
  271   2HB   LEU  38           HB1      LEU  38  15.335   3.127 -11.840
  272    HG   LEU  38           HG       LEU  38  13.292   3.259  -9.659
  273   1HD1  LEU  38          HD13      LEU  38  16.295   3.283  -9.234
  274   2HD1  LEU  38          HD11      LEU  38  15.176   4.055  -8.111
  275   3HD1  LEU  38          HD12      LEU  38  15.093   2.318  -8.382
  276   1HD2  LEU  38          HD21      LEU  38  14.663   5.028 -11.465
  277   2HD2  LEU  38          HD22      LEU  38  13.383   5.421 -10.323
  278   3HD2  LEU  38          HD23      LEU  38  15.069   5.502  -9.819
  279    H    ASN  39           HN       ASN  39  12.478   4.486 -11.838
  280    HA   ASN  39           HA       ASN  39  13.129   5.133 -14.647
  281   1HB   ASN  39           HB2      ASN  39  10.481   4.311 -13.805
  282   2HB   ASN  39           HB1      ASN  39  10.423   6.022 -14.217
  283   1HD2  ASN  39          HD22      ASN  39  11.689   3.499 -17.200
  284   2HD2  ASN  39          HD21      ASN  39  12.167   3.182 -15.603
  285    CH2  TRP  40           CH2      TRP  40  16.491  10.312  -7.980
  286    H    TRP  40           HN       TRP  40  14.535   6.657 -13.651
  287    HA   TRP  40           HA       TRP  40  13.693   8.590 -11.741
  288   1HB   TRP  40           HB2      TRP  40  15.924   8.365 -13.739
  289   2HB   TRP  40           HB1      TRP  40  15.622   9.960 -13.061
  290    HD1  TRP  40           HD1      TRP  40  17.051   6.545 -12.148
  291    HE1  TRP  40           HE1      TRP  40  17.839   6.707  -9.752
  292    HE3  TRP  40           HE3      TRP  40  15.084  10.940 -10.977
  293    HZ2  TRP  40           HZ2      TRP  40  17.611   8.561  -7.488
  294    HZ3  TRP  40           HZ3      TRP  40  15.329  11.936  -8.741
  295    HH2  TRP  40           HH2      TRP  40  16.610  10.756  -7.004
  296    OH   TYR  41           OH       TYR  41   7.079  12.285 -17.701
  297    H    TYR  41           HN       TYR  41  13.219  10.860 -12.072
  298    HA   TYR  41           HA       TYR  41  12.230  11.591 -14.766
  299   1HB   TYR  41           HB2      TYR  41  10.502  10.401 -13.003
  300   2HB   TYR  41           HB1      TYR  41  10.321  12.078 -12.517
  301    HD1  TYR  41           HD2      TYR  41  10.885  10.604 -15.917
  302    HD2  TYR  41           HD1      TYR  41   8.268  12.781 -13.366
  303    HE1  TYR  41           HE2      TYR  41   9.357  10.975 -17.798
  304    HE2  TYR  41           HE1      TYR  41   6.744  13.153 -15.248
  305    HH   TYR  41           HH       TYR  41   6.266  11.813 -17.507
  306    H    LEU  42           HN       LEU  42  11.512  13.816 -14.895
  307    HA   LEU  42           HA       LEU  42  12.192  15.671 -12.734
  308   1HB   LEU  42           HB2      LEU  42  14.424  15.575 -13.526
  309   2HB   LEU  42           HB1      LEU  42  13.928  15.237 -15.176
  310    HG   LEU  42           HG       LEU  42  13.046  17.602 -15.321
  311   1HD1  LEU  42          HD12      LEU  42  13.487  17.526 -12.525
  312   2HD1  LEU  42          HD13      LEU  42  14.699  18.628 -13.165
  313   3HD1  LEU  42          HD11      LEU  42  12.991  18.923 -13.475
  314   1HD2  LEU  42          HD22      LEU  42  15.338  16.848 -16.109
  315   2HD2  LEU  42          HD23      LEU  42  15.224  18.561 -15.717
  316   3HD2  LEU  42          HD21      LEU  42  15.982  17.448 -14.584
  317    H    GLN  43           HN       GLN  43  11.155  17.623 -12.998
  318    HA   GLN  43           HA       GLN  43   9.981  18.279 -15.630
  319   1HB   GLN  43           HB2      GLN  43   8.209  16.911 -14.728
  320   2HB   GLN  43           HB1      GLN  43   8.393  17.598 -13.122
  321   1HG   GLN  43           HG1      GLN  43   6.384  18.496 -14.293
  322   2HG   GLN  43           HG2      GLN  43   7.542  19.764 -13.918
  323   1HE2  GLN  43          HE22      GLN  43   7.391  18.538 -17.847
  324   2HE2  GLN  43          HE21      GLN  43   7.240  17.379 -16.616
  325    H    LYS  44           HN       LYS  44   9.494  20.419 -15.888
  326    HA   LYS  44           HA       LYS  44  10.558  22.222 -13.779
  327   1HB   LYS  44           HB2      LYS  44  10.913  22.130 -16.534
  328   2HB   LYS  44           HB1      LYS  44   9.669  23.361 -16.379
  329   1HG   LYS  44           HG1      LYS  44  11.298  24.835 -15.849
  330   2HG   LYS  44           HG2      LYS  44  11.523  23.952 -14.343
  331   1HD   LYS  44           HD1      LYS  44  13.669  24.025 -15.453
  332   2HD   LYS  44           HD2      LYS  44  13.067  22.380 -15.597
  333   1HE   LYS  44           HE1      LYS  44  13.794  22.890 -17.787
  334   2HE   LYS  44           HE2      LYS  44  12.060  23.165 -17.863
  335   1HZ   LYS  44           HZ1      LYS  44  12.347  25.326 -18.218
  336   2HZ   LYS  44           HZ2      LYS  44  13.544  25.474 -17.021
  337    H    ALA  45           HN       ALA  45   9.272  24.559 -14.377
  338    HA   ALA  45           HA       ALA  45   6.713  24.142 -13.064
  339   1HB   ALA  45           HB2      ALA  45   8.098  26.583 -14.262
  340   2HB   ALA  45           HB3      ALA  45   6.528  26.682 -13.470
  341   3HB   ALA  45           HB1      ALA  45   7.944  26.174 -12.556
  342    H    GLY  46           HN       GLY  46   5.801  22.722 -14.737
  343   1HA   GLY  46           HA1      GLY  46   4.098  22.468 -16.358
  344   2HA   GLY  46           HA2      GLY  46   4.030  24.222 -16.494
  345    H    GLN  47           HN       GLN  47   6.413  21.660 -17.178
  346    HA   GLN  47           HA       GLN  47   6.674  22.781 -19.931
  347   1HB   GLN  47           HB2      GLN  47   8.548  23.214 -17.986
  348   2HB   GLN  47           HB1      GLN  47   9.119  21.672 -18.605
  349   1HG   GLN  47           HG1      GLN  47  10.194  23.000 -20.149
  350   2HG   GLN  47           HG2      GLN  47   8.625  22.995 -20.950
  351   1HE2  GLN  47          HE22      GLN  47   7.847  26.256 -19.268
  352   2HE2  GLN  47          HE21      GLN  47   7.174  24.700 -19.196
  353    H    SER  48           HN       SER  48   8.627  21.033 -20.834
  354    HA   SER  48           HA       SER  48   7.015  18.597 -21.122
  355   1HB   SER  48           HB2      SER  48   8.541  19.918 -22.917
  356   2HB   SER  48           HB1      SER  48   9.788  18.820 -22.292
  357    HG   SER  48           HG       SER  48   7.348  18.241 -23.556
  358    HA   PRO  49           HA       PRO  49   9.140  16.567 -17.799
  359   1HB   PRO  49           HB2      PRO  49   8.140  14.018 -18.768
  360   2HB   PRO  49           HB1      PRO  49   7.571  14.942 -17.378
  361   1HG   PRO  49           HG1      PRO  49   6.249  14.587 -19.914
  362   2HG   PRO  49           HG2      PRO  49   5.690  15.536 -18.536
  363   1HD   PRO  49           HD1      PRO  49   6.732  16.504 -21.056
  364   2HD   PRO  49           HD2      PRO  49   6.144  17.459 -19.682
  365    H    LYS  50           HN       LYS  50  10.858  15.043 -17.547
  366    HA   LYS  50           HA       LYS  50  12.063  14.015 -20.074
  367   1HB   LYS  50           HB2      LYS  50  12.999  16.313 -19.133
  368   2HB   LYS  50           HB1      LYS  50  13.787  15.298 -17.932
  369   1HG   LYS  50           HG1      LYS  50  15.407  14.801 -19.426
  370   2HG   LYS  50           HG2      LYS  50  14.204  14.076 -20.485
  371   1HD   LYS  50           HD1      LYS  50  15.177  15.787 -21.812
  372   2HD   LYS  50           HD2      LYS  50  13.677  16.503 -21.236
  373   1HE   LYS  50           HE1      LYS  50  15.064  17.434 -19.273
  374   2HE   LYS  50           HE2      LYS  50  16.485  16.985 -20.209
  375   1HZ   LYS  50           HZ1      LYS  50  15.757  19.312 -20.539
  376   2HZ   LYS  50           HZ2      LYS  50  15.801  18.411 -21.977
  377    H    LEU  51           HN       LEU  51  12.713  11.976 -19.892
  378    HA   LEU  51           HA       LEU  51  12.888  10.769 -17.168
  379   1HB   LEU  51           HB2      LEU  51  11.355   9.544 -18.566
  380   2HB   LEU  51           HB1      LEU  51  12.399   9.678 -19.970
  381    HG   LEU  51           HG       LEU  51  14.090   8.205 -18.693
  382   1HD1  LEU  51          HD13      LEU  51  11.829   8.339 -16.765
  383   2HD1  LEU  51          HD11      LEU  51  12.464   6.722 -17.053
  384   3HD1  LEU  51          HD12      LEU  51  13.531   7.997 -16.475
  385   1HD2  LEU  51          HD22      LEU  51  12.339   7.512 -20.497
  386   2HD2  LEU  51          HD23      LEU  51  13.079   6.244 -19.525
  387   3HD2  LEU  51          HD21      LEU  51  11.453   6.806 -19.148
  388    H    LEU  52           HN       LEU  52  14.794  10.039 -16.394
  389    HA   LEU  52           HA       LEU  52  17.164  10.321 -18.170
  390   1HB   LEU  52           HB2      LEU  52  16.985   9.928 -15.135
  391   2HB   LEU  52           HB1      LEU  52  18.448  10.300 -16.033
  392    HG   LEU  52           HG       LEU  52  17.788  12.399 -15.200
  393   1HD1  LEU  52          HD11      LEU  52  18.068  12.319 -17.741
  394   2HD1  LEU  52          HD12      LEU  52  16.310  12.357 -17.842
  395   3HD1  LEU  52          HD13      LEU  52  17.178  13.702 -17.111
  396   1HD2  LEU  52          HD21      LEU  52  15.269  11.202 -14.952
  397   2HD2  LEU  52          HD22      LEU  52  15.703  12.837 -14.463
  398   3HD2  LEU  52          HD23      LEU  52  15.010  12.547 -16.056
  399    H    ILE  53           HN       ILE  53  17.152   8.282 -15.363
  400    HA   ILE  53           HA       ILE  53  17.984   6.004 -16.965
  401    HB   ILE  53           HB       ILE  53  17.513   6.544 -14.008
  402   1HG1  ILE  53          HG11      ILE  53  19.984   6.294 -13.920
  403   2HG1  ILE  53          HG12      ILE  53  20.005   6.089 -15.658
  404   1HG2  ILE  53          HG22      ILE  53  18.296   3.995 -15.466
  405   2HG2  ILE  53          HG23      ILE  53  18.854   4.285 -13.823
  406   3HG2  ILE  53          HG21      ILE  53  17.130   4.190 -14.160
  407   1HD1  ILE  53          HD11      ILE  53  18.740   8.523 -14.426
  408   2HD1  ILE  53          HD12      ILE  53  20.481   8.448 -14.695
  409   3HD1  ILE  53          HD13      ILE  53  19.374   8.310 -16.060
  410    OH   TYR  54           OH       TYR  54  18.820   1.543 -21.267
  411    H    TYR  54           HN       TYR  54  16.890   4.013 -17.101
  412    HA   TYR  54           HA       TYR  54  14.026   4.050 -16.232
  413   1HB   TYR  54           HB2      TYR  54  13.543   2.794 -18.401
  414   2HB   TYR  54           HB1      TYR  54  14.089   4.450 -18.654
  415    HD1  TYR  54           HD2      TYR  54  16.391   4.899 -19.428
  416    HD2  TYR  54           HD1      TYR  54  14.968   0.914 -18.988
  417    HE1  TYR  54           HE2      TYR  54  18.319   4.055 -20.701
  418    HE2  TYR  54           HE1      TYR  54  16.890   0.080 -20.260
  419    HH   TYR  54           HH       TYR  54  18.669   1.721 -22.198
  420    H    LYS  55           HN       LYS  55  16.367   2.825 -14.996
  421    HA   LYS  55           HA       LYS  55  15.231   0.194 -14.523
  422   1HB   LYS  55           HB2      LYS  55  16.760   0.139 -16.713
  423   2HB   LYS  55           HB1      LYS  55  18.077   0.134 -15.549
  424   1HG   LYS  55           HG1      LYS  55  17.497  -1.948 -14.685
  425   2HG   LYS  55           HG2      LYS  55  15.800  -1.772 -15.117
  426   1HD   LYS  55           HD1      LYS  55  17.776  -1.841 -17.360
  427   2HD   LYS  55           HD2      LYS  55  17.470  -3.353 -16.516
  428   1HE   LYS  55           HE1      LYS  55  15.909  -3.134 -18.392
  429   2HE   LYS  55           HE2      LYS  55  15.023  -3.028 -16.876
  430   1HZ   LYS  55           HZ1      LYS  55  14.275  -1.318 -18.333
  431   2HZ   LYS  55           HZ2      LYS  55  15.149  -0.584 -17.075
  432    H    VAL  56           HN       VAL  56  18.388   1.812 -14.353
  433    HA   VAL  56           HA       VAL  56  18.283   2.121 -11.490
  434    HB   VAL  56           HB       VAL  56  18.644  -0.390 -11.713
  435   1HG1  VAL  56          HG12      VAL  56  20.020  -0.163 -13.840
  436   2HG1  VAL  56          HG13      VAL  56  21.357   0.389 -12.834
  437   3HG1  VAL  56          HG11      VAL  56  20.713  -1.236 -12.629
  438   1HG2  VAL  56          HG22      VAL  56  19.468   0.843  -9.729
  439   2HG2  VAL  56          HG23      VAL  56  20.555  -0.479 -10.141
  440   3HG2  VAL  56          HG21      VAL  56  20.984   1.177 -10.561
  441    H    SER  57           HN       SER  57  20.247   1.883 -14.409
  442    HA   SER  57           HA       SER  57  21.670   4.339 -13.568
  443   1HB   SER  57           HB2      SER  57  23.902   3.328 -13.949
  444   2HB   SER  57           HB1      SER  57  23.032   2.308 -12.788
  445    HG   SER  57           HG       SER  57  23.858   1.714 -15.287
  446    H    ASN  58           HN       ASN  58  21.025   1.960 -16.089
  447    HA   ASN  58           HA       ASN  58  22.297   3.192 -18.270
  448   1HB   ASN  58           HB2      ASN  58  19.683   1.650 -18.032
  449   2HB   ASN  58           HB1      ASN  58  20.267   2.216 -19.594
  450   1HD2  ASN  58          HD22      ASN  58  21.760  -1.168 -18.164
  451   2HD2  ASN  58          HD21      ASN  58  20.307  -0.461 -17.643
  452    NH1  ARG  59           NH2      ARG  59  25.413   7.091 -21.476
  453    NH2  ARG  59           NH1      ARG  59  26.510   6.531 -19.569
  454    H    ARG  59           HN       ARG  59  21.686   4.752 -19.774
  455    HA   ARG  59           HA       ARG  59  19.671   6.695 -18.739
  456   1HB   ARG  59           HB2      ARG  59  21.932   6.978 -20.758
  457   2HB   ARG  59           HB1      ARG  59  20.856   8.285 -20.275
  458   1HG   ARG  59           HG1      ARG  59  21.774   8.446 -18.156
  459   2HG   ARG  59           HG2      ARG  59  22.205   6.739 -18.099
  460   1HD   ARG  59           HD1      ARG  59  23.538   8.629 -20.021
  461   2HD   ARG  59           HD2      ARG  59  24.134   8.430 -18.377
  462    HE   ARG  59           HE       ARG  59  23.883   5.833 -19.386
  463   1HH1  ARG  59          HH21      ARG  59  24.549   7.268 -21.943
  464   2HH1  ARG  59          HH22      ARG  59  26.276   7.174 -21.973
  465   1HH2  ARG  59          HH11      ARG  59  26.471   6.287 -18.602
  466   2HH2  ARG  59          HH12      ARG  59  27.391   6.593 -20.036
  467    H    PHE  60           HN       PHE  60  17.879   7.177 -19.872
  468    HA   PHE  60           HA       PHE  60  17.059   5.523 -22.078
  469   1HB   PHE  60           HB2      PHE  60  15.605   6.783 -20.317
  470   2HB   PHE  60           HB1      PHE  60  15.819   8.202 -21.339
  471    HD1  PHE  60           HD1      PHE  60  14.460   4.751 -21.242
  472    HD2  PHE  60           HD2      PHE  60  14.672   8.383 -23.459
  473    HE1  PHE  60           HE1      PHE  60  12.682   3.948 -22.733
  474    HE2  PHE  60           HE2      PHE  60  12.893   7.576 -24.946
  475    HZ   PHE  60           HZ       PHE  60  11.896   5.358 -24.585
  476    H    SER  61           HN       SER  61  16.320   6.362 -24.183
  477    HA   SER  61           HA       SER  61  18.431   7.630 -25.609
  478   1HB   SER  61           HB2      SER  61  15.496   7.098 -26.242
  479   2HB   SER  61           HB1      SER  61  16.561   7.896 -27.416
  480    HG   SER  61           HG       SER  61  16.872   5.757 -27.771
  481    H    GLY  62           HN       GLY  62  19.011   9.684 -25.704
  482   1HA   GLY  62           HA1      GLY  62  18.293  12.010 -26.296
  483   2HA   GLY  62           HA2      GLY  62  16.936  11.786 -25.196
  484    H    VAL  63           HN       VAL  63  18.596  10.397 -23.208
  485    HA   VAL  63           HA       VAL  63  19.331  12.618 -21.604
  486    HB   VAL  63           HB       VAL  63  20.404   9.762 -21.455
  487   1HG1  VAL  63          HG11      VAL  63  21.416  11.709 -20.023
  488   2HG1  VAL  63          HG12      VAL  63  19.896  11.627 -19.135
  489   3HG1  VAL  63          HG13      VAL  63  20.954  10.221 -19.206
  490   1HG2  VAL  63          HG22      VAL  63  17.893   9.915 -21.547
  491   2HG2  VAL  63          HG23      VAL  63  18.484   9.294 -20.011
  492   3HG2  VAL  63          HG21      VAL  63  17.941  10.964 -20.136
  493    HA   PRO  64           HA       PRO  64  23.118  13.739 -23.622
  494   1HB   PRO  64           HB2      PRO  64  23.774  15.463 -21.391
  495   2HB   PRO  64           HB1      PRO  64  23.140  15.937 -22.967
  496   1HG   PRO  64           HG1      PRO  64  21.751  15.918 -20.440
  497   2HG   PRO  64           HG2      PRO  64  21.109  16.378 -22.016
  498   1HD   PRO  64           HD1      PRO  64  20.557  13.973 -20.499
  499   2HD   PRO  64           HD2      PRO  64  19.871  14.464 -22.059
  500    H    ASP  65           HN       ASP  65  22.972  11.517 -21.489
  501    HA   ASP  65           HA       ASP  65  24.556  10.099 -20.509
  502   1HB   ASP  65           HB2      ASP  65  25.963  11.507 -22.525
  503   2HB   ASP  65           HB1      ASP  65  26.981  11.633 -21.095
  504    NH1  ARG  66           NH2      ARG  66  24.253  19.251 -21.007
  505    NH2  ARG  66           NH1      ARG  66  25.631  18.821 -22.762
  506    H    ARG  66           HN       ARG  66  24.789  13.528 -19.938
  507    HA   ARG  66           HA       ARG  66  26.515  13.584 -17.700
  508   1HB   ARG  66           HB2      ARG  66  24.000  15.244 -18.225
  509   2HB   ARG  66           HB1      ARG  66  25.279  15.682 -17.100
  510   1HG   ARG  66           HG1      ARG  66  26.841  16.068 -18.830
  511   2HG   ARG  66           HG2      ARG  66  25.922  15.129 -19.999
  512   1HD   ARG  66           HD1      ARG  66  24.055  16.944 -19.586
  513   2HD   ARG  66           HD2      ARG  66  25.397  17.918 -18.983
  514    HE   ARG  66           HE       ARG  66  26.100  16.773 -21.522
  515   1HH1  ARG  66          HH21      ARG  66  23.888  18.980 -20.116
  516   2HH1  ARG  66          HH22      ARG  66  23.940  20.096 -21.436
  517   1HH2  ARG  66          HH11      ARG  66  26.304  18.224 -23.195
  518   2HH2  ARG  66          HH12      ARG  66  25.340  19.661 -23.218
  519    H    PHE  67           HN       PHE  67  23.314  12.358 -17.989
  520    HA   PHE  67           HA       PHE  67  22.829  12.401 -15.077
  521   1HB   PHE  67           HB2      PHE  67  21.259  11.334 -17.460
  522   2HB   PHE  67           HB1      PHE  67  20.693  11.198 -15.799
  523    HD1  PHE  67           HD1      PHE  67  21.792  13.707 -18.353
  524    HD2  PHE  67           HD2      PHE  67  19.619  13.018 -14.755
  525    HE1  PHE  67           HE1      PHE  67  20.911  15.998 -18.442
  526    HE2  PHE  67           HE2      PHE  67  18.735  15.297 -14.858
  527    HZ   PHE  67           HZ       PHE  67  19.384  16.798 -16.692
  528    H    SER  68           HN       SER  68  23.146  10.750 -13.743
  529    HA   SER  68           HA       SER  68  23.583   8.038 -14.879
  530   1HB   SER  68           HB2      SER  68  25.863   8.509 -14.553
  531   2HB   SER  68           HB1      SER  68  25.528   9.753 -13.335
  532    HG   SER  68           HG       SER  68  25.801   7.010 -13.058
  533    H    GLY  69           HN       GLY  69  22.662   6.471 -13.714
  534   1HA   GLY  69           HA1      GLY  69  21.568   7.221 -11.031
  535   2HA   GLY  69           HA2      GLY  69  20.732   6.147 -12.144
  536    H    SER  70           HN       SER  70  21.507   5.597  -9.439
  537    HA   SER  70           HA       SER  70  22.728   2.995  -9.858
  538   1HB   SER  70           HB2      SER  70  24.714   3.498  -8.303
  539   2HB   SER  70           HB1      SER  70  24.801   4.384  -9.838
  540    HG   SER  70           HG       SER  70  23.233   5.768  -8.244
  541    H    GLY  71           HN       GLY  71  23.320   2.096  -7.494
  542   1HA   GLY  71           HA1      GLY  71  22.481   2.674  -5.076
  543   2HA   GLY  71           HA2      GLY  71  20.906   2.720  -5.856
  544    H    SER  72           HN       SER  72  21.123   1.039  -3.843
  545    HA   SER  72           HA       SER  72  21.822  -1.649  -4.881
  546   1HB   SER  72           HB2      SER  72  22.562  -1.167  -2.584
  547   2HB   SER  72           HB1      SER  72  20.932  -0.644  -2.123
  548    HG   SER  72           HG       SER  72  21.926  -3.203  -2.612
  549    H    GLY  73           HN       GLY  73  19.355  -1.620  -2.545
  550   1HA   GLY  73           HA1      GLY  73  17.324  -2.268  -4.649
  551   2HA   GLY  73           HA2      GLY  73  17.410  -3.109  -3.105
  552    H    THR  74           HN       THR  74  17.430  -1.388  -1.189
  553    HA   THR  74           HA       THR  74  14.925   0.145  -1.544
  554    HB   THR  74           HB       THR  74  15.164   0.426   1.007
  555    HG1  THR  74           HG1      THR  74  16.916  -0.543   1.901
  556   1HG2  THR  74          HG21      THR  74  14.998  -2.186  -0.454
  557   2HG2  THR  74          HG22      THR  74  15.419  -2.320   1.248
  558   3HG2  THR  74          HG23      THR  74  13.911  -1.546   0.773
  559    H    ASP  75           HN       ASP  75  17.700   0.943  -2.522
  560    HA   ASP  75           HA       ASP  75  17.442   3.767  -1.707
  561   1HB   ASP  75           HB2      ASP  75  19.341   2.022  -0.488
  562   2HB   ASP  75           HB1      ASP  75  20.261   3.012  -1.617
  563    H    PHE  76           HN       PHE  76  17.982   5.136  -3.314
  564    HA   PHE  76           HA       PHE  76  19.681   4.168  -5.550
  565   1HB   PHE  76           HB2      PHE  76  16.880   5.348  -5.884
  566   2HB   PHE  76           HB1      PHE  76  17.977   4.968  -7.209
  567    HD1  PHE  76           HD1      PHE  76  18.720   2.546  -7.511
  568    HD2  PHE  76           HD2      PHE  76  15.545   3.639  -4.888
  569    HE1  PHE  76           HE1      PHE  76  17.927   0.223  -7.500
  570    HE2  PHE  76           HE2      PHE  76  14.757   1.315  -4.881
  571    HZ   PHE  76           HZ       PHE  76  15.947  -0.395  -6.184
  572    H    THR  77           HN       THR  77  20.212   5.951  -7.090
  573    HA   THR  77           HA       THR  77  19.895   8.683  -6.035
  574    HB   THR  77           HB       THR  77  22.677   7.423  -6.357
  575    HG1  THR  77           HG1      THR  77  20.947   8.043  -4.200
  576   1HG2  THR  77          HG21      THR  77  21.684  10.126  -5.282
  577   2HG2  THR  77          HG22      THR  77  23.343   9.556  -5.134
  578   3HG2  THR  77          HG23      THR  77  22.673   9.912  -6.725
  579    H    LEU  78           HN       LEU  78  20.564  10.320  -7.482
  580    HA   LEU  78           HA       LEU  78  21.142   9.386 -10.266
  581   1HB   LEU  78           HB2      LEU  78  18.705  10.178  -9.732
  582   2HB   LEU  78           HB1      LEU  78  19.391  11.786  -9.583
  583    HG   LEU  78           HG       LEU  78  19.582  10.017 -12.057
  584   1HD1  LEU  78          HD13      LEU  78  17.590  11.911 -11.079
  585   2HD1  LEU  78          HD11      LEU  78  18.253  12.413 -12.631
  586   3HD1  LEU  78          HD12      LEU  78  17.509  10.827 -12.464
  587   1HD2  LEU  78          HD21      LEU  78  20.634  12.773 -11.384
  588   2HD2  LEU  78          HD22      LEU  78  21.525  11.399 -12.033
  589   3HD2  LEU  78          HD23      LEU  78  20.375  12.260 -13.046
  590    H    LYS  79           HN       LYS  79  23.293   9.972 -10.261
  591    HA   LYS  79           HA       LYS  79  24.017  12.667  -9.327
  592   1HB   LYS  79           HB2      LYS  79  26.366  11.909 -10.083
  593   2HB   LYS  79           HB1      LYS  79  25.653  11.070  -8.716
  594   1HG   LYS  79           HG1      LYS  79  24.730   9.581 -10.856
  595   2HG   LYS  79           HG2      LYS  79  26.336  10.053 -11.389
  596   1HD   LYS  79           HD1      LYS  79  27.055   8.317 -10.102
  597   2HD   LYS  79           HD2      LYS  79  26.794   9.428  -8.762
  598   1HE   LYS  79           HE1      LYS  79  24.265   8.478  -9.092
  599   2HE   LYS  79           HE2      LYS  79  25.198   7.070  -9.593
  600   1HZ   LYS  79           HZ1      LYS  79  25.104   8.409  -6.985
  601   2HZ   LYS  79           HZ2      LYS  79  25.075   6.750  -7.353
  602    H    ILE  80           HN       ILE  80  24.571  14.341 -10.571
  603    HA   ILE  80           HA       ILE  80  24.410  13.960 -13.531
  604    HB   ILE  80           HB       ILE  80  23.678  16.403 -11.837
  605   1HG1  ILE  80          HG11      ILE  80  21.796  14.625 -13.416
  606   2HG1  ILE  80          HG12      ILE  80  22.126  14.378 -11.705
  607   1HG2  ILE  80          HG22      ILE  80  24.386  16.228 -14.572
  608   2HG2  ILE  80          HG23      ILE  80  22.627  16.265 -14.586
  609   3HG2  ILE  80          HG21      ILE  80  23.529  17.566 -13.812
  610   1HD1  ILE  80          HD12      ILE  80  21.250  17.074 -12.763
  611   2HD1  ILE  80          HD13      ILE  80  20.080  15.842 -12.304
  612   3HD1  ILE  80          HD11      ILE  80  21.198  16.484 -11.105
  613    H    SER  81           HN       SER  81  26.092  14.506 -14.673
  614    HA   SER  81           HA       SER  81  28.516  15.196 -13.441
  615   1HB   SER  81           HB2      SER  81  27.549  15.394 -16.318
  616   2HB   SER  81           HB1      SER  81  29.202  15.859 -15.870
  617    HG   SER  81           HG       SER  81  29.013  13.610 -16.376
  618    NH1  ARG  82           NH2      ARG  82  27.376  23.088 -19.811
  619    NH2  ARG  82           NH1      ARG  82  28.473  23.863 -17.973
  620    H    ARG  82           HN       ARG  82  26.069  17.219 -14.911
  621    HA   ARG  82           HA       ARG  82  27.057  19.527 -13.461
  622   1HB   ARG  82           HB2      ARG  82  27.810  20.836 -15.283
  623   2HB   ARG  82           HB1      ARG  82  28.384  19.245 -15.757
  624   1HG   ARG  82           HG1      ARG  82  26.470  18.927 -17.229
  625   2HG   ARG  82           HG2      ARG  82  25.726  20.414 -16.651
  626   1HD   ARG  82           HD1      ARG  82  28.496  20.637 -17.735
  627   2HD   ARG  82           HD2      ARG  82  27.199  20.355 -18.897
  628    HE   ARG  82           HE       ARG  82  26.313  22.430 -17.194
  629   1HH1  ARG  82          HH21      ARG  82  26.723  22.443 -20.205
  630   2HH1  ARG  82          HH22      ARG  82  27.827  23.761 -20.393
  631   1HH2  ARG  82          HH11      ARG  82  28.642  23.799 -16.990
  632   2HH2  ARG  82          HH12      ARG  82  28.949  24.552 -18.519
  633    H    VAL  83           HN       VAL  83  25.434  20.838 -13.019
  634    HA   VAL  83           HA       VAL  83  22.770  20.136 -14.033
  635    HB   VAL  83           HB       VAL  83  23.643  22.277 -12.030
  636   1HG1  VAL  83          HG12      VAL  83  21.300  22.405 -13.134
  637   2HG1  VAL  83          HG13      VAL  83  20.939  20.928 -12.247
  638   3HG1  VAL  83          HG11      VAL  83  21.353  22.400 -11.375
  639   1HG2  VAL  83          HG22      VAL  83  23.388  19.349 -11.864
  640   2HG2  VAL  83          HG23      VAL  83  24.177  20.467 -10.753
  641   3HG2  VAL  83          HG21      VAL  83  22.441  20.193 -10.642
  642    H    GLU  84           HN       GLU  84  21.475  21.400 -15.270
  643    HA   GLU  84           HA       GLU  84  22.677  23.923 -16.352
  644   1HB   GLU  84           HB2      GLU  84  21.128  21.686 -17.725
  645   2HB   GLU  84           HB1      GLU  84  21.292  23.276 -18.460
  646   1HG   GLU  84           HG1      GLU  84  23.439  22.871 -19.078
  647   2HG   GLU  84           HG2      GLU  84  23.859  22.251 -17.485
  648    H    ALA  85           HN       ALA  85  20.984  25.382 -17.320
  649    HA   ALA  85           HA       ALA  85  19.103  26.174 -15.403
  650   1HB   ALA  85           HB3      ALA  85  19.093  26.512 -18.438
  651   2HB   ALA  85           HB1      ALA  85  17.968  27.357 -17.379
  652   3HB   ALA  85           HB2      ALA  85  19.697  27.659 -17.247
  653    H    GLU  86           HN       GLU  86  18.644  23.982 -18.142
  654    HA   GLU  86           HA       GLU  86  15.813  23.638 -17.823
  655   1HB   GLU  86           HB2      GLU  86  17.988  21.832 -18.975
  656   2HB   GLU  86           HB1      GLU  86  16.273  21.459 -19.092
  657   1HG   GLU  86           HG1      GLU  86  16.425  24.109 -19.955
  658   2HG   GLU  86           HG2      GLU  86  17.865  23.364 -20.643
  659    H    ASP  87           HN       ASP  87  18.596  21.969 -16.490
  660    HA   ASP  87           HA       ASP  87  17.310  19.767 -15.275
  661   1HB   ASP  87           HB2      ASP  87  19.863  20.526 -15.439
  662   2HB   ASP  87           HB1      ASP  87  19.542  21.235 -13.860
  663    H    LEU  88           HN       LEU  88  17.540  23.103 -14.259
  664    HA   LEU  88           HA       LEU  88  16.800  22.853 -11.551
  665   1HB   LEU  88           HB2      LEU  88  15.884  25.022 -13.499
  666   2HB   LEU  88           HB1      LEU  88  16.014  25.185 -11.753
  667    HG   LEU  88           HG       LEU  88  18.345  24.605 -13.617
  668   1HD1  LEU  88          HD11      LEU  88  17.424  26.898 -13.879
  669   2HD1  LEU  88          HD12      LEU  88  17.570  27.146 -12.142
  670   3HD1  LEU  88          HD13      LEU  88  19.014  26.926 -13.125
  671   1HD2  LEU  88          HD21      LEU  88  17.970  24.512 -10.710
  672   2HD2  LEU  88          HD22      LEU  88  19.304  23.902 -11.681
  673   3HD2  LEU  88          HD23      LEU  88  19.278  25.590 -11.183
  674    H    GLY  89           HN       GLY  89  14.814  22.929 -10.479
  675   1HA   GLY  89           HA1      GLY  89  12.268  23.217 -10.975
  676   2HA   GLY  89           HA2      GLY  89  12.537  21.894 -12.109
  677    H    ILE  90           HN       ILE  90  11.334  20.341 -11.142
  678    HA   ILE  90           HA       ILE  90  12.157  19.546  -8.375
  679    HB   ILE  90           HB       ILE  90   9.509  18.830  -9.688
  680   1HG1  ILE  90          HG11      ILE  90   9.658  21.285  -9.756
  681   2HG1  ILE  90          HG12      ILE  90   8.482  20.772  -8.556
  682   1HG2  ILE  90          HG22      ILE  90  10.274  17.657  -7.586
  683   2HG2  ILE  90          HG23      ILE  90  10.359  19.216  -6.773
  684   3HG2  ILE  90          HG21      ILE  90   8.806  18.591  -7.318
  685   1HD1  ILE  90          HD11      ILE  90  11.268  21.105  -7.561
  686   2HD1  ILE  90          HD12      ILE  90  10.437  22.583  -8.029
  687   3HD1  ILE  90          HD13      ILE  90   9.744  21.537  -6.795
  688    OH   TYR  91           OH       TYR  91  17.846  16.483 -13.428
  689    H    TYR  91           HN       TYR  91  12.788  17.467  -8.074
  690    HA   TYR  91           HA       TYR  91  12.888  15.784 -10.536
  691   1HB   TYR  91           HB2      TYR  91  14.672  16.214  -8.199
  692   2HB   TYR  91           HB1      TYR  91  14.508  14.524  -8.673
  693    HD1  TYR  91           HD1      TYR  91  15.388  17.903  -9.921
  694    HD2  TYR  91           HD2      TYR  91  15.501  13.725 -10.717
  695    HE1  TYR  91           HE1      TYR  91  16.868  18.307 -11.829
  696    HE2  TYR  91           HE2      TYR  91  16.992  14.128 -12.628
  697    HH   TYR  91           HH       TYR  91  18.428  17.217 -13.203
  698    H    PHE  92           HN       PHE  92  12.552  13.515 -10.360
  699    HA   PHE  92           HA       PHE  92  11.101  12.530  -7.981
  700   1HB   PHE  92           HB2      PHE  92   9.847  12.331 -10.754
  701   2HB   PHE  92           HB1      PHE  92   9.098  11.925  -9.220
  702    HD1  PHE  92           HD2      PHE  92  10.189  14.707 -11.393
  703    HD2  PHE  92           HD1      PHE  92   8.186  13.652  -7.786
  704    HE1  PHE  92           HE2      PHE  92   9.297  16.988 -11.216
  705    HE2  PHE  92           HE1      PHE  92   7.296  15.934  -7.613
  706    HZ   PHE  92           HZ       PHE  92   7.846  17.600  -9.330
  707    H    CYS  93           HN       CYS  93  10.525  10.196  -8.275
  708    HA   CYS  93           HA       CYS  93  12.186   8.770 -10.261
  709   1HB   CYS  93           HB2      CYS  93  13.029   7.283  -8.333
  710   2HB   CYS  93           HB1      CYS  93  13.775   8.848  -8.503
  711    H    SER  94           HN       SER  94  10.844   7.386 -11.153
  712    HA   SER  94           HA       SER  94   8.623   6.270  -9.511
  713   1HB   SER  94           HB2      SER  94   8.422   7.466 -11.915
  714   2HB   SER  94           HB1      SER  94   8.813   5.834 -12.493
  715    HG   SER  94           HG       SER  94   6.496   6.460 -11.881
  716    H    GLN  95           HN       GLN  95   7.944   4.027 -10.602
  717    HA   GLN  95           HA       GLN  95  10.186   2.279 -11.249
  718   1HB   GLN  95           HB2      GLN  95   9.703   0.817  -9.152
  719   2HB   GLN  95           HB1      GLN  95  10.601   2.303  -8.872
  720   1HG   GLN  95           HG1      GLN  95   8.993   3.021  -7.457
  721   2HG   GLN  95           HG2      GLN  95   7.803   2.928  -8.749
  722   1HE2  GLN  95          HE22      GLN  95   6.654  -0.342  -7.761
  723   2HE2  GLN  95          HE21      GLN  95   6.893   0.628  -9.131
  724    H    THR  96           HN       THR  96   9.471   0.529 -12.333
  725    HA   THR  96           HA       THR  96   6.522   0.078 -12.347
  726    HB   THR  96           HB       THR  96   7.636   0.763 -14.547
  727    HG1  THR  96           HG1      THR  96   6.542  -1.852 -14.261
  728   1HG2  THR  96          HG22      THR  96   8.766  -2.062 -14.259
  729   2HG2  THR  96          HG23      THR  96   8.945  -1.027 -15.671
  730   3HG2  THR  96          HG21      THR  96   9.742  -0.604 -14.159
  731    H    THR  97           HN       THR  97   8.881  -1.060 -10.695
  732    HA   THR  97           HA       THR  97   8.989  -3.874 -11.282
  733    HB   THR  97           HB       THR  97   9.578  -2.226  -8.762
  734    HG1  THR  97           HG1      THR  97  11.669  -3.355  -9.632
  735   1HG2  THR  97          HG22      THR  97   9.003  -4.699  -8.232
  736   2HG2  THR  97          HG23      THR  97  10.298  -5.152  -9.335
  737   3HG2  THR  97          HG21      THR  97  10.665  -4.252  -7.868
  738    H    HIS  98           HN       HIS  98   7.208  -2.085  -8.765
  739    HA   HIS  98           HA       HIS  98   5.500  -4.495  -8.378
  740   1HB   HIS  98           HB2      HIS  98   5.568  -1.955  -6.692
  741   2HB   HIS  98           HB1      HIS  98   4.936  -3.532  -6.225
  742    HD2  HIS  98           HD2      HIS  98   8.396  -1.751  -6.774
  743    HE1  HIS  98           HE1      HIS  98   9.068  -5.359  -4.871
  744    H    VAL  99           HN       VAL  99   3.192  -4.116  -7.959
  745    HA   VAL  99           HA       VAL  99   2.114  -1.832  -9.550
  746    HB   VAL  99           HB       VAL  99   1.731  -4.785  -9.841
  747   1HG1  VAL  99          HG11      VAL  99  -0.592  -2.837 -10.049
  748   2HG1  VAL  99          HG12      VAL  99  -0.595  -4.438 -10.776
  749   3HG1  VAL  99          HG13      VAL  99  -0.497  -4.267  -9.027
  750   1HG2  VAL  99          HG23      VAL  99   2.821  -3.379 -11.562
  751   2HG2  VAL  99          HG21      VAL  99   1.351  -4.117 -12.191
  752   3HG2  VAL  99          HG22      VAL  99   1.350  -2.422 -11.713
  753    HA   PRO 100           HA       PRO 100   0.205  -1.008 -10.033
  754   1HB   PRO 100           HB2      PRO 100  -0.647   1.450  -8.843
  755   2HB   PRO 100           HB1      PRO 100  -1.675   0.271  -9.658
  756   1HG   PRO 100           HG1      PRO 100  -1.514   0.859  -6.810
  757   2HG   PRO 100           HG2      PRO 100  -2.644  -0.209  -7.643
  758   1HD   PRO 100           HD1      PRO 100  -0.376  -0.954  -6.016
  759   2HD   PRO 100           HD2      PRO 100  -1.514  -2.028  -6.847
  760    HA   PRO 101           HA       PRO 101   3.914   1.305  -9.979
  761   1HB   PRO 101           HB2      PRO 101   2.949   3.552 -11.540
  762   2HB   PRO 101           HB1      PRO 101   3.882   2.170 -12.114
  763   1HG   PRO 101           HG1      PRO 101   1.090   2.732 -12.587
  764   2HG   PRO 101           HG2      PRO 101   2.022   1.349 -13.160
  765   1HD   PRO 101           HD1      PRO 101   0.012   1.395 -11.080
  766   2HD   PRO 101           HD2      PRO 101   0.933   0.001 -11.674
  767    H    THR 102           HN       THR 102   4.922   3.030  -8.903
  768    HA   THR 102           HA       THR 102   3.192   4.457  -7.003
  769    HB   THR 102           HB       THR 102   5.480   5.306  -6.131
  770    HG1  THR 102           HG1      THR 102   7.101   3.783  -7.268
  771   1HG2  THR 102          HG23      THR 102   5.244   2.288  -6.660
  772   2HG2  THR 102          HG21      THR 102   6.312   3.019  -5.465
  773   3HG2  THR 102          HG22      THR 102   4.566   3.113  -5.260
  774    H    PHE 103           HN       PHE 103   6.004   5.780  -8.702
  775    HA   PHE 103           HA       PHE 103   6.304   7.802  -9.827
  776   1HB   PHE 103           HB2      PHE 103   3.935   6.691 -10.835
  777   2HB   PHE 103           HB1      PHE 103   3.443   8.317 -10.374
  778    HD1  PHE 103           HD2      PHE 103   5.619  10.052 -10.925
  779    HD2  PHE 103           HD1      PHE 103   4.470   6.578 -13.108
  780    HE1  PHE 103           HE2      PHE 103   6.712  10.949 -12.932
  781    HE2  PHE 103           HE1      PHE 103   5.566   7.479 -15.112
  782    HZ   PHE 103           HZ       PHE 103   6.686   9.665 -15.028
  783    H    GLY 104           HN       GLY 104   6.874   9.354  -8.438
  784   1HA   GLY 104           HA1      GLY 104   5.177  11.432  -7.642
  785   2HA   GLY 104           HA2      GLY 104   5.151  10.288  -6.305
  786    H    GLY 105           HN       GLY 105   6.201  11.702  -4.894
  787   1HA   GLY 105           HA1      GLY 105   8.249  12.191  -3.750
  788   2HA   GLY 105           HA2      GLY 105   9.137  11.775  -5.213
  789    H    GLY 106           HN       GLY 106  10.219  13.909  -4.428
  790   1HA   GLY 106           HA1      GLY 106   9.688  15.950  -6.282
  791   2HA   GLY 106           HA2      GLY 106   8.762  16.370  -4.849
  792    H    THR 107           HN       THR 107  11.972  15.958  -6.171
  793    HA   THR 107           HA       THR 107  13.148  17.106  -3.683
  794    HB   THR 107           HB       THR 107  14.429  15.784  -6.154
  795    HG1  THR 107           HG1      THR 107  14.757  14.187  -4.645
  796   1HG2  THR 107          HG21      THR 107  15.565  17.423  -3.909
  797   2HG2  THR 107          HG22      THR 107  16.320  15.845  -4.110
  798   3HG2  THR 107          HG23      THR 107  16.315  16.997  -5.443
  799    H    LYS 108           HN       LYS 108  13.379  19.233  -3.620
  800    HA   LYS 108           HA       LYS 108  13.016  20.885  -5.960
  801   1HB   LYS 108           HB2      LYS 108  12.405  21.555  -3.608
  802   2HB   LYS 108           HB1      LYS 108  14.115  21.627  -3.209
  803   1HG   LYS 108           HG1      LYS 108  13.485  23.876  -3.731
  804   2HG   LYS 108           HG2      LYS 108  14.358  23.295  -5.144
  805   1HD   LYS 108           HD1      LYS 108  12.313  22.892  -6.349
  806   2HD   LYS 108           HD2      LYS 108  11.340  23.125  -4.902
  807   1HE   LYS 108           HE1      LYS 108  12.953  25.463  -5.244
  808   2HE   LYS 108           HE2      LYS 108  12.207  25.100  -6.796
  809   1HZ   LYS 108           HZ1      LYS 108  10.097  25.302  -5.934
  810   2HZ   LYS 108           HZ2      LYS 108  10.597  25.046  -4.330
  811    H    LEU 109           HN       LEU 109  14.413  21.557  -7.374
  812    HA   LEU 109           HA       LEU 109  17.300  21.757  -6.667
  813   1HB   LEU 109           HB2      LEU 109  16.499  19.590  -8.039
  814   2HB   LEU 109           HB1      LEU 109  16.474  20.716  -9.392
  815    HG   LEU 109           HG       LEU 109  18.900  20.846  -7.676
  816   1HD1  LEU 109          HD12      LEU 109  18.314  18.469  -9.480
  817   2HD1  LEU 109          HD13      LEU 109  19.888  18.837  -8.781
  818   3HD1  LEU 109          HD11      LEU 109  18.538  18.411  -7.735
  819   1HD2  LEU 109          HD21      LEU 109  18.588  22.163  -9.770
  820   2HD2  LEU 109          HD22      LEU 109  19.971  21.081  -9.884
  821   3HD2  LEU 109          HD23      LEU 109  18.458  20.662 -10.681
  822    H    GLU 110           HN       GLU 110  16.683  24.006  -6.548
  823    HA   GLU 110           HA       GLU 110  16.285  25.237  -9.244
  824   1HB   GLU 110           HB2      GLU 110  14.545  25.566  -7.328
  825   2HB   GLU 110           HB1      GLU 110  15.756  26.598  -6.577
  826   1HG   GLU 110           HG1      GLU 110  14.116  27.865  -8.016
  827   2HG   GLU 110           HG2      GLU 110  15.787  28.068  -8.530
  828    H    ILE 111           HN       ILE 111  18.781  24.694  -9.033
  829    HA   ILE 111           HA       ILE 111  20.924  25.594  -9.029
  830    HB   ILE 111           HB       ILE 111  19.127  27.617  -9.812
  831   1HG1  ILE 111          HG11      ILE 111  22.136  27.904  -9.873
  832   2HG1  ILE 111          HG12      ILE 111  21.294  26.718 -10.864
  833   1HG2  ILE 111          HG23      ILE 111  19.710  28.556  -7.418
  834   2HG2  ILE 111          HG21      ILE 111  21.291  28.907  -8.107
  835   3HG2  ILE 111          HG22      ILE 111  19.851  29.655  -8.784
  836   1HD1  ILE 111          HD12      ILE 111  19.904  28.533 -11.841
  837   2HD1  ILE 111          HD13      ILE 111  20.774  29.714 -10.868
  838   3HD1  ILE 111          HD11      ILE 111  21.619  28.817 -12.125
  839    H    LYS 112           HN       LYS 112  22.411  27.151  -7.754
  840    HA   LYS 112           HA       LYS 112  21.991  26.515  -4.908
  841   1HB   LYS 112           HB2      LYS 112  24.204  26.096  -5.917
  842   2HB   LYS 112           HB1      LYS 112  24.315  27.768  -6.446
  843   1HG   LYS 112           HG1      LYS 112  24.221  28.485  -4.043
  844   2HG   LYS 112           HG2      LYS 112  24.240  26.788  -3.572
  845   1HD   LYS 112           HD1      LYS 112  26.390  26.564  -4.934
  846   2HD   LYS 112           HD2      LYS 112  26.398  28.319  -5.056
  847   1HE   LYS 112           HE1      LYS 112  27.062  28.581  -2.894
  848   2HE   LYS 112           HE2      LYS 112  25.969  27.330  -2.312
  849   1HZ   LYS 112           HZ1      LYS 112  27.721  25.844  -3.623
  850   2HZ   LYS 112           HZ2      LYS 112  28.740  27.123  -3.161
  851    NH1  ARG 113           NH2      ARG 113  17.128  29.257  -6.133
  852    NH2  ARG 113           NH1      ARG 113  15.059  28.942  -5.252
  853    H    ARG 113           HN       ARG 113  21.872  28.006  -3.267
  854    HA   ARG 113           HA       ARG 113  21.394  30.838  -4.114
  855   1HB   ARG 113           HB2      ARG 113  19.918  28.959  -2.316
  856   2HB   ARG 113           HB1      ARG 113  20.082  30.601  -1.706
  857   1HG   ARG 113           HG1      ARG 113  18.778  31.504  -3.389
  858   2HG   ARG 113           HG2      ARG 113  19.273  30.295  -4.567
  859   1HD   ARG 113           HD1      ARG 113  17.872  28.600  -3.446
  860   2HD   ARG 113           HD2      ARG 113  17.403  29.781  -2.223
  861    HE   ARG 113           HE       ARG 113  16.137  30.980  -3.946
  862   1HH1  ARG 113          HH21      ARG 113  18.041  29.654  -6.051
  863   2HH1  ARG 113          HH22      ARG 113  16.889  28.715  -6.938
  864   1HH2  ARG 113          HH11      ARG 113  14.414  29.100  -4.507
  865   2HH2  ARG 113          HH12      ARG 113  14.783  28.404  -6.048
   
  Start of MODEL          11
 Raw file had  865 H/Q atoms
  Start of MODEL   11
    1   1H    ASP   1           HT1      ASP   1   0.052   0.544  -0.655
    2   2H    ASP   1           HT2      ASP   1   0.269  -0.950  -1.431
    3   3H    ASP   1           HT3      ASP   1   0.742  -0.760   0.187
    4    HA   ASP   1           HA       ASP   1   2.622   0.374  -0.320
    5   1HB   ASP   1           HB2      ASP   1   3.188  -1.673  -1.360
    6   2HB   ASP   1           HB1      ASP   1   1.915  -1.521  -2.565
    7    H    VAL   2           HN       VAL   2   3.058   2.360  -0.691
    8    HA   VAL   2           HA       VAL   2   2.191   3.485  -3.271
    9    HB   VAL   2           HB       VAL   2   1.855   4.872  -0.574
   10   1HG1  VAL   2          HG13      VAL   2   1.167   5.681  -3.410
   11   2HG1  VAL   2          HG11      VAL   2   0.461   6.457  -1.995
   12   3HG1  VAL   2          HG12      VAL   2   2.199   6.539  -2.269
   13   1HG2  VAL   2          HG23      VAL   2  -0.183   3.638  -2.458
   14   2HG2  VAL   2          HG21      VAL   2   0.244   3.039  -0.859
   15   3HG2  VAL   2          HG22      VAL   2  -0.581   4.585  -1.028
   16    H    VAL   3           HN       VAL   3   3.532   5.029  -4.155
   17    HA   VAL   3           HA       VAL   3   6.260   5.092  -3.087
   18    HB   VAL   3           HB       VAL   3   5.030   6.507  -5.508
   19   1HG1  VAL   3          HG11      VAL   3   7.872   6.053  -4.566
   20   2HG1  VAL   3          HG12      VAL   3   7.505   6.369  -6.259
   21   3HG1  VAL   3          HG13      VAL   3   7.109   7.570  -5.035
   22   1HG2  VAL   3          HG22      VAL   3   6.397   3.812  -5.196
   23   2HG2  VAL   3          HG23      VAL   3   4.765   4.118  -5.782
   24   3HG2  VAL   3          HG21      VAL   3   6.153   4.593  -6.755
   25    H    MET   4           HN       MET   4   7.444   7.041  -2.686
   26    HA   MET   4           HA       MET   4   5.770   9.427  -2.046
   27   1HB   MET   4           HB2      MET   4   7.445   7.732  -0.223
   28   2HB   MET   4           HB1      MET   4   7.564   9.471   0.013
   29   1HG   MET   4           HG1      MET   4   4.820   8.464  -0.353
   30   2HG   MET   4           HG2      MET   4   5.614   7.857   1.075
   31   1HE   MET   4           HE3      MET   4   3.628   8.610   2.265
   32   2HE   MET   4           HE1      MET   4   3.146  10.275   2.588
   33   3HE   MET   4           HE2      MET   4   2.839   9.558   1.005
   34    H    THR   5           HN       THR   5   6.583  10.865  -3.458
   35    HA   THR   5           HA       THR   5   9.447  10.944  -4.079
   36    HB   THR   5           HB       THR   5   7.284  12.999  -4.830
   37    HG1  THR   5           HG1      THR   5   8.032  10.994  -6.570
   38   1HG2  THR   5          HG23      THR   5   9.882  12.012  -6.142
   39   2HG2  THR   5          HG21      THR   5   8.742  13.106  -6.919
   40   3HG2  THR   5          HG22      THR   5   9.624  13.626  -5.486
   41    H    GLN   6           HN       GLN   6  10.541  11.507  -2.232
   42    HA   GLN   6           HA       GLN   6   9.681  13.756  -0.586
   43   1HB   GLN   6           HB2      GLN   6  11.666  11.614  -0.465
   44   2HB   GLN   6           HB1      GLN   6  12.385  13.148   0.011
   45   1HG   GLN   6           HG1      GLN   6   9.778  12.989   1.197
   46   2HG   GLN   6           HG2      GLN   6  10.615  11.481   1.533
   47   1HE2  GLN   6          HE22      GLN   6  11.525  14.539   3.806
   48   2HE2  GLN   6          HE21      GLN   6  10.047  14.272   3.014
   49    H    THR   7           HN       THR   7  10.301  15.779  -0.631
   50    HA   THR   7           HA       THR   7  12.752  16.693  -1.921
   51    HB   THR   7           HB       THR   7  10.835  18.305  -3.278
   52    HG1  THR   7           HG1      THR   7  10.177  15.534  -3.280
   53   1HG2  THR   7          HG21      THR   7  13.028  16.978  -4.106
   54   2HG2  THR   7          HG22      THR   7  11.861  15.731  -4.531
   55   3HG2  THR   7          HG23      THR   7  11.749  17.328  -5.263
   56    HA   PRO   8           HA       PRO   8  13.183  18.773  -2.865
   57   1HB   PRO   8           HB2      PRO   8  15.023  20.568  -1.647
   58   2HB   PRO   8           HB1      PRO   8  13.742  21.013  -2.774
   59   1HG   PRO   8           HG1      PRO   8  13.889  21.514   0.102
   60   2HG   PRO   8           HG2      PRO   8  12.722  22.142  -1.062
   61   1HD   PRO   8           HD1      PRO   8  12.309  20.056   0.898
   62   2HD   PRO   8           HD2      PRO   8  11.148  20.678  -0.291
   63    H    LEU   9           HN       LEU   9  15.702  18.565  -2.943
   64    HA   LEU   9           HA       LEU   9  16.397  16.287  -1.249
   65   1HB   LEU   9           HB2      LEU   9  18.682  17.391  -2.703
   66   2HB   LEU   9           HB1      LEU   9  17.879  15.848  -2.944
   67    HG   LEU   9           HG       LEU   9  16.859  18.479  -4.071
   68   1HD1  LEU   9          HD11      LEU   9  18.453  16.246  -5.371
   69   2HD1  LEU   9          HD12      LEU   9  17.710  17.585  -6.239
   70   3HD1  LEU   9          HD13      LEU   9  19.010  17.893  -5.093
   71   1HD2  LEU   9          HD23      LEU   9  15.376  16.295  -3.621
   72   2HD2  LEU   9          HD21      LEU   9  15.186  17.228  -5.102
   73   3HD2  LEU   9          HD22      LEU   9  16.148  15.754  -5.107
   74    H    SER  10           HN       SER  10  17.039  19.679  -1.312
   75    HA   SER  10           HA       SER  10  18.480  19.428   1.272
   76   1HB   SER  10           HB2      SER  10  19.480  21.194  -1.029
   77   2HB   SER  10           HB1      SER  10  20.304  20.889   0.512
   78    HG   SER  10           HG       SER  10  20.077  18.579  -0.132
   79    H    LEU  11           HN       LEU  11  18.280  21.272   2.602
   80    HA   LEU  11           HA       LEU  11  16.597  23.481   1.528
   81   1HB   LEU  11           HB2      LEU  11  15.288  21.572   2.766
   82   2HB   LEU  11           HB1      LEU  11  16.007  22.229   4.230
   83    HG   LEU  11           HG       LEU  11  15.117  24.529   3.369
   84   1HD1  LEU  11          HD12      LEU  11  14.534  23.440   1.098
   85   2HD1  LEU  11          HD13      LEU  11  13.160  22.720   1.931
   86   3HD1  LEU  11          HD11      LEU  11  13.305  24.471   1.821
   87   1HD2  LEU  11          HD23      LEU  11  14.237  23.134   5.313
   88   2HD2  LEU  11          HD21      LEU  11  13.042  24.177   4.549
   89   3HD2  LEU  11          HD22      LEU  11  13.062  22.453   4.192
   90    HA   PRO  12           HA       PRO  12  20.019  25.192   4.010
   91   1HB   PRO  12           HB2      PRO  12  19.974  27.519   2.319
   92   2HB   PRO  12           HB1      PRO  12  21.164  26.219   2.292
   93   1HG   PRO  12           HG1      PRO  12  19.086  26.784   0.345
   94   2HG   PRO  12           HG2      PRO  12  20.338  25.545   0.270
   95   1HD   PRO  12           HD1      PRO  12  17.521  25.187   0.810
   96   2HD   PRO  12           HD2      PRO  12  18.777  23.938   0.723
   97    H    VAL  13           HN       VAL  13  19.303  26.096   5.849
   98    HA   VAL  13           HA       VAL  13  17.567  28.515   5.688
   99    HB   VAL  13           HB       VAL  13  16.044  27.611   7.390
  100   1HG1  VAL  13          HG12      VAL  13  15.808  26.866   4.932
  101   2HG1  VAL  13          HG13      VAL  13  16.486  25.328   5.453
  102   3HG1  VAL  13          HG11      VAL  13  14.965  25.895   6.134
  103   1HG2  VAL  13          HG21      VAL  13  18.144  25.450   7.544
  104   2HG2  VAL  13          HG22      VAL  13  17.387  26.347   8.856
  105   3HG2  VAL  13          HG23      VAL  13  16.488  25.088   8.015
  106    H    SER  14           HN       SER  14  17.119  28.851   8.378
  107    HA   SER  14           HA       SER  14  19.893  29.162   9.468
  108   1HB   SER  14           HB2      SER  14  18.546  31.311   8.812
  109   2HB   SER  14           HB1      SER  14  17.519  30.932  10.210
  110    HG   SER  14           HG       SER  14  19.071  31.733  11.371
  111    H    LEU  15           HN       LEU  15  19.833  29.385  11.942
  112    HA   LEU  15           HA       LEU  15  18.285  27.103  12.942
  113   1HB   LEU  15           HB2      LEU  15  20.544  28.787  13.981
  114   2HB   LEU  15           HB1      LEU  15  19.551  27.903  15.132
  115    HG   LEU  15           HG       LEU  15  20.752  26.563  12.702
  116   1HD1  LEU  15          HD12      LEU  15  22.203  27.612  14.866
  117   2HD1  LEU  15          HD13      LEU  15  22.019  25.897  15.235
  118   3HD1  LEU  15          HD11      LEU  15  22.761  26.401  13.717
  119   1HD2  LEU  15          HD22      LEU  15  19.580  25.588  15.326
  120   2HD2  LEU  15          HD23      LEU  15  18.909  25.346  13.717
  121   3HD2  LEU  15          HD21      LEU  15  20.404  24.541  14.176
  122    H    GLY  16           HN       GLY  16  16.199  27.845  12.910
  123   1HA   GLY  16           HA1      GLY  16  14.823  28.597  15.053
  124   2HA   GLY  16           HA2      GLY  16  15.516  30.166  14.644
  125    H    ASP  17           HN       ASP  17  15.358  29.440  11.725
  126    HA   ASP  17           HA       ASP  17  12.798  30.636  11.192
  127   1HB   ASP  17           HB2      ASP  17  14.692  29.049   9.385
  128   2HB   ASP  17           HB1      ASP  17  13.338  30.004   8.798
  129    H    GLN  18           HN       GLN  18  11.798  29.080   9.063
  130    HA   GLN  18           HA       GLN  18  11.114  26.526  10.398
  131   1HB   GLN  18           HB2      GLN  18   8.725  26.870   9.943
  132   2HB   GLN  18           HB1      GLN  18   9.341  28.216  10.887
  133   1HG   GLN  18           HG1      GLN  18   8.857  28.210   7.896
  134   2HG   GLN  18           HG2      GLN  18   7.872  29.008   9.120
  135   1HE2  GLN  18          HE22      GLN  18  11.157  30.863   7.712
  136   2HE2  GLN  18          HE21      GLN  18  10.588  29.403   7.057
  137    H    ALA  19           HN       ALA  19  10.891  24.805   9.128
  138    HA   ALA  19           HA       ALA  19  11.430  25.242   6.227
  139   1HB   ALA  19           HB2      ALA  19  11.954  22.986   8.181
  140   2HB   ALA  19           HB3      ALA  19  11.946  22.659   6.451
  141   3HB   ALA  19           HB1      ALA  19  13.097  23.810   7.125
  142    H    SER  20           HN       SER  20  10.625  23.268   4.899
  143    HA   SER  20           HA       SER  20   7.973  22.275   5.675
  144   1HB   SER  20           HB2      SER  20   8.411  24.504   3.678
  145   2HB   SER  20           HB1      SER  20   7.159  23.301   3.312
  146    HG   SER  20           HG       SER  20   7.367  24.286   5.924
  147    H    ILE  21           HN       ILE  21   9.457  20.400   5.424
  148    HA   ILE  21           HA       ILE  21  10.540  19.642   2.872
  149    HB   ILE  21           HB       ILE  21   9.498  17.844   5.106
  150   1HG1  ILE  21          HG11      ILE  21  12.347  18.120   5.149
  151   2HG1  ILE  21          HG12      ILE  21  11.658  19.737   5.121
  152   1HG2  ILE  21          HG23      ILE  21  11.320  17.473   2.715
  153   2HG2  ILE  21          HG21      ILE  21  11.521  16.446   4.130
  154   3HG2  ILE  21          HG22      ILE  21   9.995  16.446   3.252
  155   1HD1  ILE  21          HD12      ILE  21  10.652  17.585   7.002
  156   2HD1  ILE  21          HD13      ILE  21  11.953  18.686   7.442
  157   3HD1  ILE  21          HD11      ILE  21  10.349  19.318   7.085
  158    H    SER  22           HN       SER  22   9.577  18.901   1.130
  159    HA   SER  22           HA       SER  22   6.659  18.422   1.190
  160   1HB   SER  22           HB2      SER  22   7.717  19.934  -0.565
  161   2HB   SER  22           HB1      SER  22   8.532  18.504  -1.232
  162    HG   SER  22           HG       SER  22   5.730  18.829  -0.819
  163    H    CYS  23           HN       CYS  23   5.697  16.659   0.183
  164    HA   CYS  23           HA       CYS  23   7.238  14.308  -0.613
  165   1HB   CYS  23           HB2      CYS  23   5.622  14.394   1.966
  166   2HB   CYS  23           HB1      CYS  23   6.082  12.901   1.190
  167    NH1  ARG  24           NH1      ARG  24   7.382  17.398  -3.726
  168    NH2  ARG  24           NH2      ARG  24   7.223  17.601  -5.985
  169    H    ARG  24           HN       ARG  24   6.075  13.875  -2.406
  170    HA   ARG  24           HA       ARG  24   3.098  14.001  -2.185
  171   1HB   ARG  24           HB2      ARG  24   4.965  14.128  -4.595
  172   2HB   ARG  24           HB1      ARG  24   3.209  14.110  -4.719
  173   1HG   ARG  24           HG1      ARG  24   3.001  16.207  -3.598
  174   2HG   ARG  24           HG2      ARG  24   4.659  16.151  -3.017
  175   1HD   ARG  24           HD1      ARG  24   4.990  15.962  -5.760
  176   2HD   ARG  24           HD2      ARG  24   3.620  17.062  -5.616
  177    HE   ARG  24           HE       ARG  24   5.040  18.592  -4.354
  178   1HH1  ARG  24          HH11      ARG  24   6.931  17.396  -2.833
  179   2HH1  ARG  24          HH12      ARG  24   8.370  17.262  -3.788
  180   1HH2  ARG  24          HH21      ARG  24   6.652  17.749  -6.793
  181   2HH2  ARG  24          HH22      ARG  24   8.209  17.475  -6.085
  182    H    SER  25           HN       SER  25   1.823  12.354  -3.023
  183    HA   SER  25           HA       SER  25   3.206   9.713  -3.175
  184   1HB   SER  25           HB2      SER  25   1.541   9.511  -1.495
  185   2HB   SER  25           HB1      SER  25   0.442  10.634  -2.317
  186    HG   SER  25           HG       SER  25  -0.069   8.317  -2.525
  187    H    SER  26           HN       SER  26   2.607   8.215  -4.793
  188    HA   SER  26           HA       SER  26   1.976   9.486  -7.355
  189   1HB   SER  26           HB2      SER  26   2.697   6.662  -6.463
  190   2HB   SER  26           HB1      SER  26   2.192   6.990  -8.133
  191    HG   SER  26           HG       SER  26   4.068   7.872  -8.451
  192    H    GLN  27           HN       GLN  27   0.275   7.709  -4.937
  193    HA   GLN  27           HA       GLN  27  -2.179   7.891  -6.598
  194   1HB   GLN  27           HB2      GLN  27  -0.824   5.496  -6.212
  195   2HB   GLN  27           HB1      GLN  27  -1.985   5.464  -4.890
  196   1HG   GLN  27           HG1      GLN  27  -3.830   5.832  -6.450
  197   2HG   GLN  27           HG2      GLN  27  -2.700   6.016  -7.787
  198   1HE2  GLN  27          HE22      GLN  27  -3.990   2.485  -7.718
  199   2HE2  GLN  27          HE21      GLN  27  -4.742   4.004  -7.791
  200    H    SER  28           HN       SER  28  -1.231   9.502  -4.399
  201    HA   SER  28           HA       SER  28  -2.056  10.450  -2.421
  202   1HB   SER  28           HB2      SER  28  -4.204  10.418  -3.788
  203   2HB   SER  28           HB1      SER  28  -4.574   8.831  -3.090
  204    HG   SER  28           HG       SER  28  -4.274  11.325  -1.791
  205    H    LEU  29           HN       LEU  29  -3.520   9.663  -0.372
  206    HA   LEU  29           HA       LEU  29  -2.638   6.926   0.406
  207   1HB   LEU  29           HB2      LEU  29  -2.285   9.386   2.177
  208   2HB   LEU  29           HB1      LEU  29  -1.731   7.758   2.526
  209    HG   LEU  29           HG       LEU  29  -0.764   9.178   0.046
  210   1HD1  LEU  29          HD11      LEU  29  -0.452  10.452   2.370
  211   2HD1  LEU  29          HD12      LEU  29   0.837   9.270   2.575
  212   3HD1  LEU  29          HD13      LEU  29   0.860  10.368   1.199
  213   1HD2  LEU  29          HD22      LEU  29   0.275   6.987   1.868
  214   2HD2  LEU  29          HD23      LEU  29  -0.243   6.819   0.195
  215   3HD2  LEU  29          HD21      LEU  29   1.234   7.699   0.575
  216    H    VAL  30           HN       VAL  30  -5.168   8.687  -0.118
  217    HA   VAL  30           HA       VAL  30  -6.582   8.603   2.421
  218    HB   VAL  30           HB       VAL  30  -7.529   8.941  -0.464
  219   1HG1  VAL  30          HG13      VAL  30  -9.015   8.930   2.163
  220   2HG1  VAL  30          HG11      VAL  30  -9.591   9.922   0.828
  221   3HG1  VAL  30          HG12      VAL  30  -9.470   8.177   0.638
  222   1HG2  VAL  30          HG23      VAL  30  -6.055  10.704   0.830
  223   2HG2  VAL  30          HG21      VAL  30  -7.475  11.254  -0.053
  224   3HG2  VAL  30          HG22      VAL  30  -7.551  11.045   1.694
  225    H    HIS  31           HN       HIS  31  -7.830   7.056   3.243
  226    HA   HIS  31           HA       HIS  31  -7.723   4.390   2.049
  227   1HB   HIS  31           HB2      HIS  31  -7.702   5.146   4.598
  228   2HB   HIS  31           HB1      HIS  31  -9.454   5.141   4.423
  229    HD2  HIS  31           HD2      HIS  31  -6.451   2.636   4.485
  230    HE1  HIS  31           HE1      HIS  31  -9.955   0.443   4.355
  231    H    SER  32           HN       SER  32  -9.985   3.149   2.425
  232    HA   SER  32           HA       SER  32 -11.659   3.872   0.277
  233   1HB   SER  32           HB2      SER  32 -13.315   2.271   1.354
  234   2HB   SER  32           HB1      SER  32 -11.670   1.603   1.350
  235    HG   SER  32           HG       SER  32 -11.393   2.400   3.449
  236    H    ASN  33           HN       ASN  33 -11.952   4.664   3.704
  237    HA   ASN  33           HA       ASN  33 -14.337   6.339   3.077
  238   1HB   ASN  33           HB2      ASN  33 -14.407   6.457   5.682
  239   2HB   ASN  33           HB1      ASN  33 -14.738   4.885   4.962
  240   1HD2  ASN  33          HD22      ASN  33 -12.051   3.379   6.629
  241   2HD2  ASN  33          HD21      ASN  33 -13.550   3.210   5.853
  242    H    GLY  34           HN       GLY  34 -14.262   8.232   4.992
  243   1HA   GLY  34           HA1      GLY  34 -12.257  10.071   3.962
  244   2HA   GLY  34           HA2      GLY  34 -13.439  10.435   5.215
  245    H    ASN  35           HN       ASN  35 -10.442   8.610   4.673
  246    HA   ASN  35           HA       ASN  35  -9.497   9.536   7.339
  247   1HB   ASN  35           HB2      ASN  35  -9.894   6.697   6.399
  248   2HB   ASN  35           HB1      ASN  35  -8.501   7.035   7.419
  249   1HD2  ASN  35          HD22      ASN  35 -12.266   7.485   8.997
  250   2HD2  ASN  35          HD21      ASN  35 -12.055   7.554   7.315
  251    H    THR  36           HN       THR  36  -7.561  10.408   7.134
  252    HA   THR  36           HA       THR  36  -5.799   9.466   4.902
  253    HB   THR  36           HB       THR  36  -5.663  12.232   6.226
  254    HG1  THR  36           HG1      THR  36  -6.967  11.666   3.796
  255   1HG2  THR  36          HG21      THR  36  -4.948  11.115   3.453
  256   2HG2  THR  36          HG22      THR  36  -4.798  12.808   3.912
  257   3HG2  THR  36          HG23      THR  36  -3.779  11.594   4.680
  258    OH   TYR  37           OH       TYR  37  -8.369   4.919   9.078
  259    H    TYR  37           HN       TYR  37  -4.505   8.025   5.941
  260    HA   TYR  37           HA       TYR  37  -3.356   8.703   8.571
  261   1HB   TYR  37           HB2      TYR  37  -2.848   6.288   6.772
  262   2HB   TYR  37           HB1      TYR  37  -2.446   6.413   8.482
  263    HD1  TYR  37           HD2      TYR  37  -4.557   7.185   9.993
  264    HD2  TYR  37           HD1      TYR  37  -4.844   5.177   6.254
  265    HE1  TYR  37           HE2      TYR  37  -6.809   6.416  10.577
  266    HE2  TYR  37           HE1      TYR  37  -7.093   4.401   6.844
  267    HH   TYR  37           HH       TYR  37  -8.893   5.687   9.319
  268    H    LEU  38           HN       LEU  38  -1.152   8.897   8.991
  269    HA   LEU  38           HA       LEU  38   0.857   8.844   6.900
  270   1HB   LEU  38           HB2      LEU  38  -0.719  11.213   7.144
  271   2HB   LEU  38           HB1      LEU  38   0.830  11.596   7.882
  272    HG   LEU  38           HG       LEU  38   0.644  10.248   5.178
  273   1HD1  LEU  38          HD12      LEU  38   0.443  13.167   5.929
  274   2HD1  LEU  38          HD13      LEU  38   1.146  12.685   4.385
  275   3HD1  LEU  38          HD11      LEU  38  -0.519  12.258   4.766
  276   1HD2  LEU  38          HD21      LEU  38   2.764  11.184   6.961
  277   2HD2  LEU  38          HD22      LEU  38   2.889  10.184   5.517
  278   3HD2  LEU  38          HD23      LEU  38   2.879  11.938   5.376
  279    H    ASN  39           HN       ASN  39   2.993   9.380   7.728
  280    HA   ASN  39           HA       ASN  39   3.257  10.094  10.537
  281   1HB   ASN  39           HB2      ASN  39   4.222   7.968  11.301
  282   2HB   ASN  39           HB1      ASN  39   2.644   7.636  10.599
  283   1HD2  ASN  39          HD22      ASN  39   5.946   5.975   8.992
  284   2HD2  ASN  39          HD21      ASN  39   6.001   6.922  10.402
  285    CH2  TRP  40           CH2      TRP  40   7.433  15.310   4.927
  286    H    TRP  40           HN       TRP  40   4.880  11.456  10.481
  287    HA   TRP  40           HA       TRP  40   7.063  11.128   8.510
  288   1HB   TRP  40           HB2      TRP  40   6.226  13.309  10.461
  289   2HB   TRP  40           HB1      TRP  40   7.762  13.397   9.609
  290    HD1  TRP  40           HD1      TRP  40   3.946  13.290   8.887
  291    HE1  TRP  40           HE1      TRP  40   3.661  14.341   6.604
  292    HE3  TRP  40           HE3      TRP  40   8.722  13.934   7.721
  293    HZ2  TRP  40           HZ2      TRP  40   5.350  15.464   4.479
  294    HZ3  TRP  40           HZ3      TRP  40   9.429  15.025   5.632
  295    HH2  TRP  40           HH2      TRP  40   7.743  15.792   4.011
  296    OH   TYR  41           OH       TYR  41  15.991   7.945  11.122
  297    H    TYR  41           HN       TYR  41   9.326  11.639   9.317
  298    HA   TYR  41           HA       TYR  41   9.911  10.884  12.096
  299   1HB   TYR  41           HB2      TYR  41   9.911   8.636  11.506
  300   2HB   TYR  41           HB1      TYR  41  10.097   8.984   9.792
  301    HD1  TYR  41           HD1      TYR  41  12.120   9.439  12.930
  302    HD2  TYR  41           HD2      TYR  41  12.092   8.258   8.847
  303    HE1  TYR  41           HE1      TYR  41  14.499   8.892  13.068
  304    HE2  TYR  41           HE2      TYR  41  14.480   7.718   8.985
  305    HH   TYR  41           HH       TYR  41  16.143   7.161  10.588
  306    H    LEU  42           HN       LEU  42  11.774  11.809  12.740
  307    HA   LEU  42           HA       LEU  42  13.503  13.038  10.634
  308   1HB   LEU  42           HB2      LEU  42  12.636  14.749  12.081
  309   2HB   LEU  42           HB1      LEU  42  12.848  13.760  13.517
  310    HG   LEU  42           HG       LEU  42  15.301  13.946  13.308
  311   1HD1  LEU  42          HD13      LEU  42  14.569  14.883  10.646
  312   2HD1  LEU  42          HD11      LEU  42  15.633  16.033  11.446
  313   3HD1  LEU  42          HD12      LEU  42  16.141  14.361  11.242
  314   1HD2  LEU  42          HD22      LEU  42  13.530  16.347  13.467
  315   2HD2  LEU  42          HD23      LEU  42  14.625  15.681  14.674
  316   3HD2  LEU  42          HD21      LEU  42  15.260  16.643  13.344
  317    H    GLN  43           HN       GLN  43  15.546  12.392  10.427
  318    HA   GLN  43           HA       GLN  43  16.552  10.330  12.305
  319   1HB   GLN  43           HB2      GLN  43  16.608   9.925   9.831
  320   2HB   GLN  43           HB1      GLN  43  17.668  11.317   9.641
  321   1HG   GLN  43           HG1      GLN  43  19.444  10.262  10.839
  322   2HG   GLN  43           HG2      GLN  43  18.375   9.021  11.487
  323   1HE2  GLN  43          HE22      GLN  43  18.945   6.878   8.776
  324   2HE2  GLN  43          HE21      GLN  43  18.446   7.074  10.385
  325    H    LYS  44           HN       LYS  44  17.974  10.770  13.802
  326    HA   LYS  44           HA       LYS  44  19.784  13.131  13.476
  327   1HB   LYS  44           HB2      LYS  44  17.770  13.302  15.165
  328   2HB   LYS  44           HB1      LYS  44  18.693  12.173  16.148
  329   1HG   LYS  44           HG1      LYS  44  19.912  13.900  16.939
  330   2HG   LYS  44           HG2      LYS  44  20.514  14.196  15.312
  331   1HD   LYS  44           HD1      LYS  44  17.800  15.211  16.162
  332   2HD   LYS  44           HD2      LYS  44  19.259  16.130  16.515
  333   1HE   LYS  44           HE1      LYS  44  19.023  16.989  14.429
  334   2HE   LYS  44           HE2      LYS  44  19.620  15.437  13.859
  335   1HZ   LYS  44           HZ1      LYS  44  16.761  16.053  14.339
  336   2HZ   LYS  44           HZ2      LYS  44  17.518  16.131  12.821
  337    H    ALA  45           HN       ALA  45  21.300  12.788  15.745
  338    HA   ALA  45           HA       ALA  45  22.951  10.515  14.972
  339   1HB   ALA  45           HB2      ALA  45  23.093  12.605  17.189
  340   2HB   ALA  45           HB3      ALA  45  24.285  11.316  17.053
  341   3HB   ALA  45           HB1      ALA  45  24.108  12.492  15.754
  342    H    GLY  46           HN       GLY  46  20.791  11.309  17.630
  343   1HA   GLY  46           HA1      GLY  46  20.727   8.430  18.376
  344   2HA   GLY  46           HA2      GLY  46  21.102   9.600  19.640
  345    H    GLN  47           HN       GLN  47  18.856   9.981  16.958
  346    HA   GLN  47           HA       GLN  47  16.579   9.963  18.899
  347   1HB   GLN  47           HB2      GLN  47  17.545  12.286  18.029
  348   2HB   GLN  47           HB1      GLN  47  16.674  11.878  16.558
  349   1HG   GLN  47           HG1      GLN  47  14.676  11.394  18.215
  350   2HG   GLN  47           HG2      GLN  47  15.581  12.444  19.303
  351   1HE2  GLN  47          HE22      GLN  47  14.861  15.390  17.484
  352   2HE2  GLN  47          HE21      GLN  47  15.739  14.699  18.762
  353    H    SER  48           HN       SER  48  17.888   8.735  16.120
  354    HA   SER  48           HA       SER  48  15.939   8.568  14.191
  355   1HB   SER  48           HB2      SER  48  17.738   7.265  13.517
  356   2HB   SER  48           HB1      SER  48  18.062   6.689  15.159
  357    HG   SER  48           HG       SER  48  15.975   5.883  13.403
  358    HA   PRO  49           HA       PRO  49  13.588   5.032  16.401
  359   1HB   PRO  49           HB2      PRO  49  14.254   4.892  19.191
  360   2HB   PRO  49           HB1      PRO  49  14.655   3.699  17.957
  361   1HG   PRO  49           HG1      PRO  49  16.427   5.601  19.290
  362   2HG   PRO  49           HG2      PRO  49  16.856   4.269  18.215
  363   1HD   PRO  49           HD1      PRO  49  16.901   7.068  17.605
  364   2HD   PRO  49           HD2      PRO  49  17.206   5.721  16.495
  365    H    LYS  50           HN       LYS  50  12.291   7.005  16.032
  366    HA   LYS  50           HA       LYS  50  10.828   7.732  18.445
  367   1HB   LYS  50           HB2      LYS  50  12.996   9.264  18.131
  368   2HB   LYS  50           HB1      LYS  50  12.007  10.069  16.921
  369   1HG   LYS  50           HG1      LYS  50  10.783  11.117  18.512
  370   2HG   LYS  50           HG2      LYS  50  10.491   9.608  19.369
  371   1HD   LYS  50           HD1      LYS  50  13.235  10.787  19.559
  372   2HD   LYS  50           HD2      LYS  50  11.950  11.592  20.447
  373   1HE   LYS  50           HE1      LYS  50  12.013   8.628  20.678
  374   2HE   LYS  50           HE2      LYS  50  13.351   9.482  21.437
  375   1HZ   LYS  50           HZ1      LYS  50  11.524  10.957  22.416
  376   2HZ   LYS  50           HZ2      LYS  50  10.470   9.687  22.010
  377    H    LEU  51           HN       LEU  51   9.767  10.161  17.349
  378    HA   LEU  51           HA       LEU  51   8.739   9.752  14.689
  379   1HB   LEU  51           HB2      LEU  51   7.473   7.934  15.754
  380   2HB   LEU  51           HB1      LEU  51   7.015   8.974  17.094
  381    HG   LEU  51           HG       LEU  51   5.838  10.453  15.341
  382   1HD1  LEU  51          HD13      LEU  51   7.028   8.471  13.624
  383   2HD1  LEU  51          HD11      LEU  51   5.277   8.331  13.508
  384   3HD1  LEU  51          HD12      LEU  51   6.060   9.868  13.169
  385   1HD2  LEU  51          HD21      LEU  51   5.001   8.270  16.838
  386   2HD2  LEU  51          HD22      LEU  51   3.939   9.393  15.998
  387   3HD2  LEU  51          HD23      LEU  51   4.412   7.884  15.225
  388    H    LEU  52           HN       LEU  52   7.780  11.584  13.964
  389    HA   LEU  52           HA       LEU  52   7.547  13.834  15.914
  390   1HB   LEU  52           HB2      LEU  52   8.548  13.520  13.200
  391   2HB   LEU  52           HB1      LEU  52   7.249  14.701  13.188
  392    HG   LEU  52           HG       LEU  52   8.387  16.169  14.627
  393   1HD1  LEU  52          HD12      LEU  52   9.678  13.665  15.619
  394   2HD1  LEU  52          HD13      LEU  52  10.641  15.135  15.702
  395   3HD1  LEU  52          HD11      LEU  52   9.085  15.057  16.524
  396   1HD2  LEU  52          HD22      LEU  52  10.526  14.691  13.052
  397   2HD2  LEU  52          HD23      LEU  52   9.543  16.027  12.463
  398   3HD2  LEU  52          HD21      LEU  52  10.720  16.298  13.744
  399    H    ILE  53           HN       ILE  53   5.918  12.884  12.903
  400    HA   ILE  53           HA       ILE  53   3.323  13.634  14.194
  401    HB   ILE  53           HB       ILE  53   4.099  13.817  11.249
  402   1HG1  ILE  53          HG11      ILE  53   5.394  15.414  12.556
  403   2HG1  ILE  53          HG12      ILE  53   4.187  16.253  11.592
  404   1HG2  ILE  53          HG21      ILE  53   1.560  13.834  12.520
  405   2HG2  ILE  53          HG22      ILE  53   1.894  15.525  12.157
  406   3HG2  ILE  53          HG23      ILE  53   1.898  14.329  10.867
  407   1HD1  ILE  53          HD12      ILE  53   2.873  15.616  13.979
  408   2HD1  ILE  53          HD13      ILE  53   4.473  16.142  14.483
  409   3HD1  ILE  53          HD11      ILE  53   3.463  17.204  13.509
  410    OH   TYR  54           OH       TYR  54  -1.772  11.970  18.308
  411    H    TYR  54           HN       TYR  54   1.642  12.194  13.977
  412    HA   TYR  54           HA       TYR  54   2.207   9.739  12.356
  413   1HB   TYR  54           HB2      TYR  54   0.945   8.450  14.109
  414   2HB   TYR  54           HB1      TYR  54   2.384   9.215  14.765
  415    HD1  TYR  54           HD2      TYR  54  -1.309   9.390  14.622
  416    HD2  TYR  54           HD1      TYR  54   2.205  11.030  16.369
  417    HE1  TYR  54           HE2      TYR  54  -2.671  10.466  16.353
  418    HE2  TYR  54           HE1      TYR  54   0.835  12.108  18.093
  419    HH   TYR  54           HH       TYR  54  -1.727  12.921  18.173
  420    H    LYS  55           HN       LYS  55   0.794  12.121  11.634
  421    HA   LYS  55           HA       LYS  55  -1.478  10.963  10.343
  422   1HB   LYS  55           HB2      LYS  55  -1.887  11.976  13.043
  423   2HB   LYS  55           HB1      LYS  55  -2.762  13.007  11.916
  424   1HG   LYS  55           HG1      LYS  55  -2.947   9.976  11.891
  425   2HG   LYS  55           HG2      LYS  55  -4.073  11.002  12.769
  426   1HD   LYS  55           HD1      LYS  55  -4.296  12.244  10.446
  427   2HD   LYS  55           HD2      LYS  55  -3.682  10.728   9.798
  428   1HE   LYS  55           HE1      LYS  55  -6.079  10.549   9.799
  429   2HE   LYS  55           HE2      LYS  55  -5.506   9.550  11.130
  430   1HZ   LYS  55           HZ1      LYS  55  -5.959  11.380  12.647
  431   2HZ   LYS  55           HZ2      LYS  55  -6.528  12.331  11.357
  432    H    VAL  56           HN       VAL  56  -2.982  13.267   9.846
  433    HA   VAL  56           HA       VAL  56  -1.010  14.762   8.262
  434    HB   VAL  56           HB       VAL  56  -3.293  16.108   7.759
  435   1HG1  VAL  56          HG13      VAL  56  -2.652  13.302   6.796
  436   2HG1  VAL  56          HG11      VAL  56  -3.750  14.415   5.983
  437   3HG1  VAL  56          HG12      VAL  56  -2.036  14.807   6.117
  438   1HG2  VAL  56          HG22      VAL  56  -4.443  14.816   9.638
  439   2HG2  VAL  56          HG23      VAL  56  -5.269  14.791   8.081
  440   3HG2  VAL  56          HG21      VAL  56  -4.338  13.391   8.602
  441    H    SER  57           HN       SER  57  -1.190  14.996  11.296
  442    HA   SER  57           HA       SER  57  -0.421  17.697  11.514
  443   1HB   SER  57           HB2      SER  57  -2.422  18.857  11.554
  444   2HB   SER  57           HB1      SER  57  -3.300  17.337  11.287
  445    HG   SER  57           HG       SER  57  -3.770  18.402  13.329
  446    H    ASN  58           HN       ASN  58  -2.256  15.214  13.242
  447    HA   ASN  58           HA       ASN  58  -1.701  15.852  15.878
  448   1HB   ASN  58           HB2      ASN  58  -2.368  13.454  14.372
  449   2HB   ASN  58           HB1      ASN  58  -1.267  13.051  15.684
  450   1HD2  ASN  58          HD22      ASN  58  -5.082  13.732  16.544
  451   2HD2  ASN  58          HD21      ASN  58  -4.494  13.396  14.987
  452    NH1  ARG  59           NH1      ARG  59  -0.467  20.030  15.716
  453    NH2  ARG  59           NH2      ARG  59  -0.005  21.281  17.561
  454    H    ARG  59           HN       ARG  59  -0.046  15.678  17.279
  455    HA   ARG  59           HA       ARG  59   2.612  14.992  16.104
  456   1HB   ARG  59           HB2      ARG  59   1.846  16.788  18.436
  457   2HB   ARG  59           HB1      ARG  59   3.500  16.473  17.921
  458   1HG   ARG  59           HG1      ARG  59   3.258  17.667  15.936
  459   2HG   ARG  59           HG2      ARG  59   1.517  17.405  15.871
  460   1HD   ARG  59           HD1      ARG  59   2.636  18.973  18.154
  461   2HD   ARG  59           HD2      ARG  59   2.501  19.762  16.584
  462    HE   ARG  59           HE       ARG  59   0.159  18.509  17.978
  463   1HH1  ARG  59          HH11      ARG  59  -0.394  19.156  15.237
  464   2HH1  ARG  59          HH12      ARG  59  -0.940  20.798  15.288
  465   1HH2  ARG  59          HH21      ARG  59   0.416  21.347  18.468
  466   2HH2  ARG  59          HH22      ARG  59  -0.465  22.075  17.167
  467    H    PHE  60           HN       PHE  60   3.801  13.413  16.999
  468    HA   PHE  60           HA       PHE  60   2.674  11.507  18.764
  469   1HB   PHE  60           HB2      PHE  60   4.615  11.060  17.255
  470   2HB   PHE  60           HB1      PHE  60   5.623  12.119  18.237
  471    HD1  PHE  60           HD2      PHE  60   3.319   9.187  18.685
  472    HD2  PHE  60           HD1      PHE  60   6.918  11.110  19.910
  473    HE1  PHE  60           HE2      PHE  60   3.791   7.331  20.221
  474    HE2  PHE  60           HE1      PHE  60   7.385   9.251  21.445
  475    HZ   PHE  60           HZ       PHE  60   5.823   7.360  21.601
  476    H    SER  61           HN       SER  61   3.456  10.878  20.899
  477    HA   SER  61           HA       SER  61   3.300  13.076  22.750
  478   1HB   SER  61           HB2      SER  61   4.272  10.231  23.328
  479   2HB   SER  61           HB1      SER  61   3.480  11.345  24.462
  480    HG   SER  61           HG       SER  61   1.892  10.022  23.616
  481    H    GLY  62           HN       GLY  62   5.004  14.482  22.349
  482   1HA   GLY  62           HA1      GLY  62   7.178  14.830  23.730
  483   2HA   GLY  62           HA2      GLY  62   7.752  13.412  22.860
  484    H    VAL  63           HN       VAL  63   5.720  15.876  21.434
  485    HA   VAL  63           HA       VAL  63   8.010  16.635  19.668
  486    HB   VAL  63           HB       VAL  63   5.007  16.773  19.112
  487   1HG1  VAL  63          HG12      VAL  63   6.884  18.245  17.870
  488   2HG1  VAL  63          HG13      VAL  63   7.088  16.749  16.961
  489   3HG1  VAL  63          HG11      VAL  63   5.520  17.558  16.996
  490   1HG2  VAL  63          HG23      VAL  63   6.043  14.437  19.372
  491   2HG2  VAL  63          HG21      VAL  63   5.252  14.759  17.834
  492   3HG2  VAL  63          HG22      VAL  63   7.007  14.813  17.949
  493    HA   PRO  64           HA       PRO  64   7.675  20.623  21.515
  494   1HB   PRO  64           HB2      PRO  64   9.027  21.856  19.276
  495   2HB   PRO  64           HB1      PRO  64   9.712  21.435  20.845
  496   1HG   PRO  64           HG1      PRO  64  10.155  20.125  18.309
  497   2HG   PRO  64           HG2      PRO  64  10.862  19.717  19.871
  498   1HD   PRO  64           HD1      PRO  64   8.819  18.277  18.424
  499   2HD   PRO  64           HD2      PRO  64   9.533  17.867  19.994
  500    H    ASP  65           HN       ASP  65   5.810  19.602  19.228
  501    HA   ASP  65           HA       ASP  65   3.871  20.428  18.238
  502   1HB   ASP  65           HB2      ASP  65   4.150  22.017  20.406
  503   2HB   ASP  65           HB1      ASP  65   4.385  23.236  19.156
  504    NH1  ARG  66           NH2      ARG  66   8.556  24.409  20.862
  505    NH2  ARG  66           NH1      ARG  66  10.290  25.873  21.027
  506    H    ARG  66           HN       ARG  66   6.640  22.626  17.939
  507    HA   ARG  66           HA       ARG  66   5.936  24.096  15.697
  508   1HB   ARG  66           HB2      ARG  66   8.592  22.815  16.461
  509   2HB   ARG  66           HB1      ARG  66   8.446  23.953  15.125
  510   1HG   ARG  66           HG1      ARG  66   8.190  25.746  16.519
  511   2HG   ARG  66           HG2      ARG  66   7.150  24.857  17.624
  512   1HD   ARG  66           HD1      ARG  66   9.212  23.644  18.457
  513   2HD   ARG  66           HD2      ARG  66  10.181  24.749  17.486
  514    HE   ARG  66           HE       ARG  66   8.955  26.591  18.876
  515   1HH1  ARG  66          HH21      ARG  66   7.833  23.996  20.306
  516   2HH1  ARG  66          HH22      ARG  66   8.677  24.130  21.814
  517   1HH2  ARG  66          HH11      ARG  66  10.871  26.561  20.596
  518   2HH2  ARG  66          HH12      ARG  66  10.443  25.615  21.980
  519    H    PHE  67           HN       PHE  67   6.673  20.687  15.796
  520    HA   PHE  67           HA       PHE  67   7.006  20.461  12.895
  521   1HB   PHE  67           HB2      PHE  67   6.681  18.438  15.155
  522   2HB   PHE  67           HB1      PHE  67   6.870  17.954  13.471
  523    HD1  PHE  67           HD2      PHE  67   8.982  18.337  12.293
  524    HD2  PHE  67           HD1      PHE  67   8.545  19.497  16.365
  525    HE1  PHE  67           HE2      PHE  67  11.407  18.643  12.470
  526    HE2  PHE  67           HE1      PHE  67  10.978  19.790  16.538
  527    HZ   PHE  67           HZ       PHE  67  12.410  19.365  14.590
  528    H    SER  68           HN       SER  68   5.400  20.372  11.470
  529    HA   SER  68           HA       SER  68   2.795  19.197  12.320
  530   1HB   SER  68           HB2      SER  68   3.109  21.811  10.750
  531   2HB   SER  68           HB1      SER  68   1.580  21.092  11.296
  532    HG   SER  68           HG       SER  68   2.823  21.076  13.440
  533    H    GLY  69           HN       GLY  69   2.886  17.406  11.062
  534   1HA   GLY  69           HA1      GLY  69   3.613  17.661   8.197
  535   2HA   GLY  69           HA2      GLY  69   3.351  16.147   9.060
  536    H    SER  70           HN       SER  70   2.062  18.084   6.751
  537    HA   SER  70           HA       SER  70  -0.585  16.784   7.024
  538   1HB   SER  70           HB2      SER  70  -1.718  19.072   6.690
  539   2HB   SER  70           HB1      SER  70  -0.893  18.922   8.253
  540    HG   SER  70           HG       SER  70   0.915  19.612   6.443
  541    H    GLY  71           HN       GLY  71  -1.837  16.836   5.101
  542   1HA   GLY  71           HA1      GLY  71  -0.850  18.131   2.689
  543   2HA   GLY  71           HA2      GLY  71  -0.506  16.407   2.704
  544    H    SER  72           HN       SER  72  -2.138  17.525   0.769
  545    HA   SER  72           HA       SER  72  -4.924  16.961   1.606
  546   1HB   SER  72           HB2      SER  72  -4.487  18.970   0.191
  547   2HB   SER  72           HB1      SER  72  -3.795  17.936  -1.071
  548    HG   SER  72           HG       SER  72  -6.200  18.483  -1.071
  549    H    GLY  73           HN       GLY  73  -4.622  16.333  -1.642
  550   1HA   GLY  73           HA1      GLY  73  -5.288  13.528  -1.293
  551   2HA   GLY  73           HA2      GLY  73  -5.094  14.355  -2.832
  552    H    THR  74           HN       THR  74  -2.851  14.730  -3.567
  553    HA   THR  74           HA       THR  74  -1.086  12.497  -2.642
  554    HB   THR  74           HB       THR  74  -0.091  12.650  -4.979
  555    HG1  THR  74           HG1      THR  74  -0.884  14.955  -4.960
  556   1HG2  THR  74          HG23      THR  74  -2.680  11.669  -4.306
  557   2HG2  THR  74          HG21      THR  74  -2.937  12.647  -5.745
  558   3HG2  THR  74          HG22      THR  74  -1.802  11.302  -5.786
  559    H    ASP  75           HN       ASP  75  -1.336  15.430  -1.812
  560    HA   ASP  75           HA       ASP  75   1.572  16.055  -2.107
  561   1HB   ASP  75           HB2      ASP  75   0.781  18.491  -1.847
  562   2HB   ASP  75           HB1      ASP  75   0.289  17.713  -3.348
  563    H    PHE  76           HN       PHE  76   2.675  16.303  -0.275
  564    HA   PHE  76           HA       PHE  76   1.228  16.970   2.229
  565   1HB   PHE  76           HB2      PHE  76   3.164  14.617   1.973
  566   2HB   PHE  76           HB1      PHE  76   2.271  15.076   3.421
  567    HD1  PHE  76           HD1      PHE  76   1.991  13.586   0.054
  568    HD2  PHE  76           HD2      PHE  76  -0.133  14.620   3.601
  569    HE1  PHE  76           HE1      PHE  76   0.075  12.246  -0.696
  570    HE2  PHE  76           HE2      PHE  76  -2.047  13.287   2.838
  571    HZ   PHE  76           HZ       PHE  76  -1.944  12.095   0.695
  572    H    THR  77           HN       THR  77   2.583  17.794   3.900
  573    HA   THR  77           HA       THR  77   5.415  18.293   3.237
  574    HB   THR  77           HB       THR  77   3.640  20.691   3.906
  575    HG1  THR  77           HG1      THR  77   4.134  19.327   1.486
  576   1HG2  THR  77          HG23      THR  77   6.243  20.797   3.894
  577   2HG2  THR  77          HG21      THR  77   6.153  20.440   2.172
  578   3HG2  THR  77          HG22      THR  77   5.446  21.924   2.802
  579    H    LEU  78           HN       LEU  78   6.681  18.780   4.984
  580    HA   LEU  78           HA       LEU  78   5.353  18.543   7.647
  581   1HB   LEU  78           HB2      LEU  78   7.265  16.942   6.800
  582   2HB   LEU  78           HB1      LEU  78   8.335  18.301   7.114
  583    HG   LEU  78           HG       LEU  78   7.185  18.385   9.445
  584   1HD1  LEU  78          HD11      LEU  78   5.749  16.253   8.258
  585   2HD1  LEU  78          HD12      LEU  78   6.767  15.541   9.505
  586   3HD1  LEU  78          HD13      LEU  78   5.639  16.825   9.917
  587   1HD2  LEU  78          HD22      LEU  78   9.005  16.096   8.629
  588   2HD2  LEU  78          HD23      LEU  78   9.515  17.699   9.150
  589   3HD2  LEU  78          HD21      LEU  78   8.739  16.607  10.293
  590    H    LYS  79           HN       LYS  79   4.787  20.658   7.972
  591    HA   LYS  79           HA       LYS  79   6.723  22.814   7.589
  592   1HB   LYS  79           HB2      LYS  79   4.079  22.948   9.091
  593   2HB   LYS  79           HB1      LYS  79   4.912  24.260   8.266
  594   1HG   LYS  79           HG1      LYS  79   4.640  22.515   6.197
  595   2HG   LYS  79           HG2      LYS  79   3.216  22.087   7.139
  596   1HD   LYS  79           HD1      LYS  79   2.369  23.828   5.836
  597   2HD   LYS  79           HD2      LYS  79   2.885  24.712   7.266
  598   1HE   LYS  79           HE1      LYS  79   5.042  25.231   6.169
  599   2HE   LYS  79           HE2      LYS  79   4.531  24.343   4.738
  600   1HZ   LYS  79           HZ1      LYS  79   3.952  26.447   4.157
  601   2HZ   LYS  79           HZ2      LYS  79   2.505  25.961   4.904
  602    H    ILE  80           HN       ILE  80   8.266  23.269   8.977
  603    HA   ILE  80           HA       ILE  80   7.803  22.726  11.880
  604    HB   ILE  80           HB       ILE  80  10.430  22.889  10.325
  605   1HG1  ILE  80          HG11      ILE  80   9.435  20.381  11.637
  606   2HG1  ILE  80          HG12      ILE  80   8.773  20.830  10.072
  607   1HG2  ILE  80          HG23      ILE  80   9.755  22.981  13.169
  608   2HG2  ILE  80          HG21      ILE  80  10.724  21.551  12.832
  609   3HG2  ILE  80          HG22      ILE  80  11.337  23.148  12.414
  610   1HD1  ILE  80          HD13      ILE  80  11.757  20.827  10.532
  611   2HD1  ILE  80          HD11      ILE  80  10.911  19.344  10.107
  612   3HD1  ILE  80          HD12      ILE  80  10.880  20.720   9.009
  613    H    SER  81           HN       SER  81   7.110  24.558  12.670
  614    HA   SER  81           HA       SER  81   8.075  27.059  11.664
  615   1HB   SER  81           HB2      SER  81   6.610  26.744  14.300
  616   2HB   SER  81           HB1      SER  81   6.494  28.067  13.115
  617    HG   SER  81           HG       SER  81   5.623  26.578  11.635
  618    NH1  ARG  82           NH1      ARG  82  10.827  30.885  18.115
  619    NH2  ARG  82           NH2      ARG  82  12.242  29.588  19.335
  620    H    ARG  82           HN       ARG  82  10.271  25.547  12.577
  621    HA   ARG  82           HA       ARG  82  11.823  27.431  13.931
  622   1HB   ARG  82           HB2      ARG  82  10.069  25.872  15.731
  623   2HB   ARG  82           HB1      ARG  82  11.767  25.771  16.175
  624   1HG   ARG  82           HG1      ARG  82  10.664  28.470  15.496
  625   2HG   ARG  82           HG2      ARG  82  10.238  27.771  17.054
  626   1HD   ARG  82           HD1      ARG  82  12.550  27.576  17.693
  627   2HD   ARG  82           HD2      ARG  82  13.097  27.921  16.052
  628    HE   ARG  82           HE       ARG  82  12.771  30.229  16.479
  629   1HH1  ARG  82          HH11      ARG  82  10.518  31.205  17.220
  630   2HH1  ARG  82          HH12      ARG  82  10.389  31.224  18.946
  631   1HH2  ARG  82          HH21      ARG  82  12.995  28.933  19.356
  632   2HH2  ARG  82          HH22      ARG  82  11.833  29.909  20.187
  633    H    VAL  83           HN       VAL  83  13.456  26.647  12.666
  634    HA   VAL  83           HA       VAL  83  14.174  23.787  12.889
  635    HB   VAL  83           HB       VAL  83  15.309  26.048  11.174
  636   1HG1  VAL  83          HG12      VAL  83  16.467  23.562  11.875
  637   2HG1  VAL  83          HG13      VAL  83  15.842  23.350  10.243
  638   3HG1  VAL  83          HG11      VAL  83  16.984  24.645  10.586
  639   1HG2  VAL  83          HG23      VAL  83  13.278  23.855  10.715
  640   2HG2  VAL  83          HG21      VAL  83  13.143  25.572  10.346
  641   3HG2  VAL  83          HG22      VAL  83  14.181  24.541   9.366
  642    H    GLU  84           HN       GLU  84  15.154  23.490  14.809
  643    HA   GLU  84           HA       GLU  84  17.395  25.314  15.547
  644   1HB   GLU  84           HB2      GLU  84  15.310  24.107  17.033
  645   2HB   GLU  84           HB1      GLU  84  16.745  23.189  17.472
  646   1HG   GLU  84           HG1      GLU  84  17.412  26.000  17.400
  647   2HG   GLU  84           HG2      GLU  84  15.989  25.768  18.410
  648    H    ALA  85           HN       ALA  85  19.093  23.878  16.940
  649    HA   ALA  85           HA       ALA  85  20.583  22.417  15.035
  650   1HB   ALA  85           HB3      ALA  85  20.574  22.293  18.088
  651   2HB   ALA  85           HB1      ALA  85  21.805  21.517  17.096
  652   3HB   ALA  85           HB2      ALA  85  21.635  23.272  17.074
  653    H    GLU  86           HN       GLU  86  17.992  21.450  17.113
  654    HA   GLU  86           HA       GLU  86  18.394  18.587  16.920
  655   1HB   GLU  86           HB2      GLU  86  16.037  20.387  17.613
  656   2HB   GLU  86           HB1      GLU  86  15.859  18.637  17.558
  657   1HG   GLU  86           HG1      GLU  86  18.227  19.509  19.060
  658   2HG   GLU  86           HG2      GLU  86  16.716  20.082  19.756
  659    H    ASP  87           HN       ASP  87  16.604  20.983  15.121
  660    HA   ASP  87           HA       ASP  87  15.099  19.223  13.449
  661   1HB   ASP  87           HB2      ASP  87  15.991  22.083  13.371
  662   2HB   ASP  87           HB1      ASP  87  15.493  21.388  11.835
  663    H    LEU  88           HN       LEU  88  18.281  20.702  13.026
  664    HA   LEU  88           HA       LEU  88  18.937  20.016  10.434
  665   1HB   LEU  88           HB2      LEU  88  20.692  19.660  12.910
  666   2HB   LEU  88           HB1      LEU  88  21.296  19.759  11.260
  667    HG   LEU  88           HG       LEU  88  19.716  21.931  12.685
  668   1HD1  LEU  88          HD13      LEU  88  22.065  21.615  13.497
  669   2HD1  LEU  88          HD11      LEU  88  22.636  21.824  11.844
  670   3HD1  LEU  88          HD12      LEU  88  21.841  23.156  12.677
  671   1HD2  LEU  88          HD23      LEU  88  20.460  21.440   9.874
  672   2HD2  LEU  88          HD21      LEU  88  19.249  22.532  10.535
  673   3HD2  LEU  88          HD22      LEU  88  20.937  23.028  10.462
  674    H    GLY  89           HN       GLY  89  19.781  18.239   9.361
  675   1HA   GLY  89           HA1      GLY  89  20.711  15.862   9.755
  676   2HA   GLY  89           HA2      GLY  89  19.253  15.619  10.712
  677    H    ILE  90           HN       ILE  90  18.657  13.901   9.324
  678    HA   ILE  90           HA       ILE  90  17.807  14.747   6.580
  679    HB   ILE  90           HB       ILE  90  18.037  11.900   7.649
  680   1HG1  ILE  90          HG11      ILE  90  20.235  12.969   7.899
  681   2HG1  ILE  90          HG12      ILE  90  20.268  11.800   6.587
  682   1HG2  ILE  90          HG21      ILE  90  17.910  13.207   4.895
  683   2HG2  ILE  90          HG22      ILE  90  18.416  11.534   5.107
  684   3HG2  ILE  90          HG23      ILE  90  16.792  12.029   5.575
  685   1HD1  ILE  90          HD13      ILE  90  19.900  14.798   6.244
  686   2HD1  ILE  90          HD11      ILE  90  21.388  13.914   5.935
  687   3HD1  ILE  90          HD12      ILE  90  19.968  13.618   4.941
  688    OH   TYR  91           OH       TYR  91  13.347  18.202  11.708
  689    H    TYR  91           HN       TYR  91  15.697  14.465   5.935
  690    HA   TYR  91           HA       TYR  91  13.820  13.630   8.116
  691   1HB   TYR  91           HB2      TYR  91  13.757  15.835   6.073
  692   2HB   TYR  91           HB1      TYR  91  12.215  15.113   6.531
  693    HD1  TYR  91           HD2      TYR  91  15.119  17.018   7.725
  694    HD2  TYR  91           HD1      TYR  91  11.385  15.314   8.836
  695    HE1  TYR  91           HE2      TYR  91  15.167  18.280   9.824
  696    HE2  TYR  91           HE1      TYR  91  11.440  16.571  10.942
  697    HH   TYR  91           HH       TYR  91  14.256  18.210  12.016
  698    H    PHE  92           HN       PHE  92  12.123  12.319   7.675
  699    HA   PHE  92           HA       PHE  92  11.914  11.208   4.908
  700   1HB   PHE  92           HB2      PHE  92  11.876   9.626   7.524
  701   2HB   PHE  92           HB1      PHE  92  11.679   8.938   5.917
  702    HD1  PHE  92           HD2      PHE  92  14.082  10.805   8.071
  703    HD2  PHE  92           HD1      PHE  92  13.587   8.363   4.616
  704    HE1  PHE  92           HE2      PHE  92  16.516  10.579   7.875
  705    HE2  PHE  92           HE1      PHE  92  16.025   8.133   4.434
  706    HZ   PHE  92           HZ       PHE  92  17.491   9.242   6.063
  707    H    CYS  93           HN       CYS  93   9.840  10.273   4.432
  708    HA   CYS  93           HA       CYS  93   7.695  10.947   6.392
  709   1HB   CYS  93           HB2      CYS  93   6.357  11.679   4.300
  710   2HB   CYS  93           HB1      CYS  93   7.550  12.781   4.929
  711    H    SER  94           HN       SER  94   7.057   8.927   6.870
  712    HA   SER  94           HA       SER  94   6.547   7.041   4.626
  713   1HB   SER  94           HB2      SER  94   5.976   5.643   6.968
  714   2HB   SER  94           HB1      SER  94   7.586   5.690   6.226
  715    HG   SER  94           HG       SER  94   6.566   7.611   8.055
  716    H    GLN  95           HN       GLN  95   4.534   5.850   4.622
  717    HA   GLN  95           HA       GLN  95   2.296   7.541   5.643
  718   1HB   GLN  95           HB2      GLN  95   1.003   6.280   3.777
  719   2HB   GLN  95           HB1      GLN  95   2.193   7.460   3.251
  720   1HG   GLN  95           HG1      GLN  95   3.469   5.867   2.252
  721   2HG   GLN  95           HG2      GLN  95   3.398   4.824   3.667
  722   1HE2  GLN  95          HE22      GLN  95   1.619   3.150   0.824
  723   2HE2  GLN  95          HE21      GLN  95   3.191   3.748   1.048
  724    H    THR  96           HN       THR  96   0.975   6.731   7.097
  725    HA   THR  96           HA       THR  96   1.304   3.949   7.979
  726    HB   THR  96           HB       THR  96  -0.425   6.300   8.951
  727    HG1  THR  96           HG1      THR  96   2.054   5.747   9.155
  728   1HG2  THR  96          HG22      THR  96  -0.076   3.442  10.007
  729   2HG2  THR  96          HG23      THR  96  -0.590   4.767  11.046
  730   3HG2  THR  96          HG21      THR  96  -1.600   4.265   9.695
  731    H    THR  97           HN       THR  97  -0.475   5.483   5.646
  732    HA   THR  97           HA       THR  97  -3.046   4.264   5.838
  733    HB   THR  97           HB       THR  97  -1.437   5.183   3.389
  734    HG1  THR  97           HG1      THR  97  -3.171   6.883   3.843
  735   1HG2  THR  97          HG22      THR  97  -3.573   3.667   2.996
  736   2HG2  THR  97          HG23      THR  97  -4.470   5.010   3.699
  737   3HG2  THR  97          HG21      THR  97  -3.557   5.244   2.213
  738    H    HIS  98           HN       HIS  98  -0.398   3.344   3.638
  739    HA   HIS  98           HA       HIS  98  -1.627   0.675   3.344
  740   1HB   HIS  98           HB2      HIS  98   0.743   2.089   2.055
  741   2HB   HIS  98           HB1      HIS  98   0.394   0.392   1.743
  742    HD2  HIS  98           HD2      HIS  98  -1.243   3.929   1.134
  743    HE1  HIS  98           HE1      HIS  98  -3.181   1.141  -1.229
  744    H    VAL  99           HN       VAL  99  -1.168  -0.826   4.799
  745    HA   VAL  99           HA       VAL  99   1.489  -0.755   6.145
  746    HB   VAL  99           HB       VAL  99  -1.017  -2.337   6.886
  747   1HG1  VAL  99          HG11      VAL  99   1.184  -3.152   7.799
  748   2HG1  VAL  99          HG12      VAL  99   1.412  -1.573   8.546
  749   3HG1  VAL  99          HG13      VAL  99   0.077  -2.602   9.052
  750   1HG2  VAL  99          HG22      VAL  99  -0.035   0.398   7.765
  751   2HG2  VAL  99          HG23      VAL  99  -1.587   0.004   7.033
  752   3HG2  VAL  99          HG21      VAL  99  -1.227  -0.526   8.673
  753    HA   PRO 100           HA       PRO 100   2.938  -1.858   7.058
  754   1HB   PRO 100           HB2      PRO 100   5.430  -2.491   5.788
  755   2HB   PRO 100           HB1      PRO 100   4.764  -3.252   7.232
  756   1HG   PRO 100           HG1      PRO 100   5.012  -4.377   4.568
  757   2HG   PRO 100           HG2      PRO 100   4.433  -5.171   6.033
  758   1HD   PRO 100           HD1      PRO 100   2.872  -4.238   3.778
  759   2HD   PRO 100           HD2      PRO 100   2.297  -5.079   5.229
  760    HA   PRO 101           HA       PRO 101   3.629   1.855   4.840
  761   1HB   PRO 101           HB2      PRO 101   6.005   2.614   6.317
  762   2HB   PRO 101           HB1      PRO 101   4.357   3.183   6.575
  763   1HG   PRO 101           HG1      PRO 101   5.884   1.353   8.220
  764   2HG   PRO 101           HG2      PRO 101   4.254   1.964   8.506
  765   1HD   PRO 101           HD1      PRO 101   5.017  -0.689   7.682
  766   2HD   PRO 101           HD2      PRO 101   3.376  -0.062   7.926
  767    H    THR 102           HN       THR 102   4.776   2.502   3.048
  768    HA   THR 102           HA       THR 102   6.811   0.695   2.039
  769    HB   THR 102           HB       THR 102   6.933   2.717   0.245
  770    HG1  THR 102           HG1      THR 102   5.208   4.048   0.477
  771   1HG2  THR 102          HG23      THR 102   4.351   1.138   0.757
  772   2HG2  THR 102          HG21      THR 102   4.805   1.884  -0.773
  773   3HG2  THR 102          HG22      THR 102   5.724   0.517  -0.155
  774    H    PHE 103           HN       PHE 103   6.846   4.042   3.209
  775    HA   PHE 103           HA       PHE 103   8.621   5.306   4.083
  776   1HB   PHE 103           HB2      PHE 103   9.136   2.832   5.012
  777   2HB   PHE 103           HB1      PHE 103  10.480   2.931   3.878
  778    HD1  PHE 103           HD1      PHE 103  12.235   4.657   4.172
  779    HD2  PHE 103           HD2      PHE 103   9.072   4.241   6.995
  780    HE1  PHE 103           HE1      PHE 103  13.495   6.010   5.786
  781    HE2  PHE 103           HE2      PHE 103  10.337   5.597   8.607
  782    HZ   PHE 103           HZ       PHE 103  12.555   6.469   8.007
  783    H    GLY 104           HN       GLY 104  10.722   6.215   3.431
  784   1HA   GLY 104           HA1      GLY 104  12.501   5.849   1.540
  785   2HA   GLY 104           HA2      GLY 104  11.093   5.897   0.484
  786    H    GLY 105           HN       GLY 105  13.563   7.692   1.243
  787   1HA   GLY 105           HA1      GLY 105  13.005  10.087   0.211
  788   2HA   GLY 105           HA2      GLY 105  12.136  10.240   1.736
  789    H    GLY 106           HN       GLY 106  14.042  12.043   1.379
  790   1HA   GLY 106           HA1      GLY 106  15.787  11.680   3.589
  791   2HA   GLY 106           HA2      GLY 106  16.697  11.310   2.128
  792    H    THR 107           HN       THR 107  14.487  13.811   3.389
  793    HA   THR 107           HA       THR 107  15.640  15.840   1.634
  794    HB   THR 107           HB       THR 107  13.768  16.054   4.069
  795    HG1  THR 107           HG1      THR 107  13.317  16.373   1.288
  796   1HG2  THR 107          HG21      THR 107  14.947  18.074   2.143
  797   2HG2  THR 107          HG22      THR 107  13.239  18.240   2.533
  798   3HG2  THR 107          HG23      THR 107  14.444  18.320   3.813
  799    H    LYS 108           HN       LYS 108  17.607  16.615   1.971
  800    HA   LYS 108           HA       LYS 108  18.931  16.435   4.542
  801   1HB   LYS 108           HB2      LYS 108  19.989  16.395   2.173
  802   2HB   LYS 108           HB1      LYS 108  19.789  18.142   2.174
  803   1HG   LYS 108           HG1      LYS 108  20.983  17.976   4.529
  804   2HG   LYS 108           HG2      LYS 108  21.563  16.437   3.902
  805   1HD   LYS 108           HD1      LYS 108  21.892  18.287   1.791
  806   2HD   LYS 108           HD2      LYS 108  22.438  19.127   3.237
  807   1HE   LYS 108           HE1      LYS 108  24.107  17.530   3.687
  808   2HE   LYS 108           HE2      LYS 108  23.318  16.290   2.722
  809   1HZ   LYS 108           HZ1      LYS 108  23.820  17.642   0.737
  810   2HZ   LYS 108           HZ2      LYS 108  24.708  18.709   1.718
  811    H    LEU 109           HN       LEU 109  18.249  17.678   6.152
  812    HA   LEU 109           HA       LEU 109  17.532  20.510   5.595
  813   1HB   LEU 109           HB2      LEU 109  16.302  18.570   7.164
  814   2HB   LEU 109           HB1      LEU 109  17.232  19.457   8.362
  815    HG   LEU 109           HG       LEU 109  16.188  21.527   6.911
  816   1HD1  LEU 109          HD12      LEU 109  14.266  19.190   6.770
  817   2HD1  LEU 109          HD13      LEU 109  13.705  20.857   6.706
  818   3HD1  LEU 109          HD11      LEU 109  14.790  20.247   5.462
  819   1HD2  LEU 109          HD22      LEU 109  16.117  20.869   9.457
  820   2HD2  LEU 109          HD23      LEU 109  14.885  21.953   8.818
  821   3HD2  LEU 109          HD21      LEU 109  14.514  20.251   9.067
  822    H    GLU 110           HN       GLU 110  19.525  21.459   5.442
  823    HA   GLU 110           HA       GLU 110  21.137  21.444   7.961
  824   1HB   GLU 110           HB2      GLU 110  21.916  20.964   5.126
  825   2HB   GLU 110           HB1      GLU 110  22.974  22.067   5.999
  826   1HG   GLU 110           HG1      GLU 110  23.685  20.434   7.478
  827   2HG   GLU 110           HG2      GLU 110  22.158  19.558   7.411
  828    H    ILE 111           HN       ILE 111  21.731  23.374   8.745
  829    HA   ILE 111           HA       ILE 111  20.466  25.744   7.696
  830    HB   ILE 111           HB       ILE 111  22.003  24.928  10.056
  831   1HG1  ILE 111          HG11      ILE 111  20.696  27.139  10.829
  832   2HG1  ILE 111          HG12      ILE 111  19.837  26.844   9.327
  833   1HG2  ILE 111          HG23      ILE 111  22.487  27.750   8.977
  834   2HG2  ILE 111          HG21      ILE 111  22.978  27.170  10.563
  835   3HG2  ILE 111          HG22      ILE 111  23.716  26.495   9.116
  836   1HD1  ILE 111          HD13      ILE 111  20.256  24.751  11.484
  837   2HD1  ILE 111          HD11      ILE 111  18.783  25.695  11.289
  838   3HD1  ILE 111          HD12      ILE 111  19.282  24.574  10.027
  839    H    LYS 112           HN       LYS 112  21.690  27.740   7.165
  840    HA   LYS 112           HA       LYS 112  23.521  27.199   4.999
  841   1HB   LYS 112           HB2      LYS 112  22.034  29.461   6.067
  842   2HB   LYS 112           HB1      LYS 112  23.691  29.954   5.737
  843   1HG   LYS 112           HG1      LYS 112  23.394  28.751   3.461
  844   2HG   LYS 112           HG2      LYS 112  21.672  28.768   3.820
  845   1HD   LYS 112           HD1      LYS 112  21.502  30.974   3.323
  846   2HD   LYS 112           HD2      LYS 112  22.897  31.375   4.317
  847   1HE   LYS 112           HE1      LYS 112  23.193  30.081   1.597
  848   2HE   LYS 112           HE2      LYS 112  23.113  31.828   1.792
  849   1HZ   LYS 112           HZ1      LYS 112  24.950  30.692   3.632
  850   2HZ   LYS 112           HZ2      LYS 112  25.342  30.237   2.042
  851    NH1  ARG 113           NH1      ARG 113  30.343  24.772   7.816
  852    NH2  ARG 113           NH2      ARG 113  29.932  26.035   9.662
  853    H    ARG 113           HN       ARG 113  25.686  27.948   4.793
  854    HA   ARG 113           HA       ARG 113  27.119  28.350   7.382
  855   1HB   ARG 113           HB2      ARG 113  28.019  26.554   5.076
  856   2HB   ARG 113           HB1      ARG 113  28.887  26.798   6.586
  857   1HG   ARG 113           HG1      ARG 113  26.052  25.726   6.503
  858   2HG   ARG 113           HG2      ARG 113  27.458  24.672   6.441
  859   1HD   ARG 113           HD1      ARG 113  27.468  26.726   8.600
  860   2HD   ARG 113           HD2      ARG 113  26.292  25.424   8.772
  861    HE   ARG 113           HE       ARG 113  28.094  23.881   9.039
  862   1HH1  ARG 113          HH11      ARG 113  30.006  24.136   7.125
  863   2HH1  ARG 113          HH12      ARG 113  31.293  25.078   7.794
  864   1HH2  ARG 113          HH21      ARG 113  29.285  26.347  10.356
  865   2HH2  ARG 113          HH22      ARG 113  30.875  26.365   9.672
   
  Start of MODEL          12
 Raw file had  865 H/Q atoms
  Start of MODEL   12
    1   1H    ASP   1           HT3      ASP   1   1.547  -0.527   0.111
    2   2H    ASP   1           HT1      ASP   1   0.128  -0.130  -0.734
    3   3H    ASP   1           HT2      ASP   1   0.558  -1.759  -0.513
    4    HA   ASP   1           HA       ASP   1   1.239  -1.459  -2.648
    5   1HB   ASP   1           HB2      ASP   1   2.639   0.824  -3.051
    6   2HB   ASP   1           HB1      ASP   1   0.884   0.795  -3.195
    7    H    VAL   2           HN       VAL   2   3.307  -1.625  -3.654
    8    HA   VAL   2           HA       VAL   2   5.156  -2.871  -1.890
    9    HB   VAL   2           HB       VAL   2   5.263  -2.020  -4.803
   10   1HG1  VAL   2          HG11      VAL   2   7.488  -3.029  -3.054
   11   2HG1  VAL   2          HG12      VAL   2   7.399  -3.606  -4.714
   12   3HG1  VAL   2          HG13      VAL   2   7.558  -1.884  -4.389
   13   1HG2  VAL   2          HG21      VAL   2   5.175  -4.671  -3.335
   14   2HG2  VAL   2          HG22      VAL   2   3.890  -3.959  -4.302
   15   3HG2  VAL   2          HG23      VAL   2   5.365  -4.526  -5.079
   16    H    VAL   3           HN       VAL   3   6.077  -1.653  -0.371
   17    HA   VAL   3           HA       VAL   3   6.917   1.082  -0.753
   18    HB   VAL   3           HB       VAL   3   7.890  -0.903   1.358
   19   1HG1  VAL   3          HG13      VAL   3   7.686   2.114   1.192
   20   2HG1  VAL   3          HG11      VAL   3   7.848   1.279   2.734
   21   3HG1  VAL   3          HG12      VAL   3   9.116   1.141   1.521
   22   1HG2  VAL   3          HG22      VAL   3   5.290   0.621   1.102
   23   2HG2  VAL   3          HG23      VAL   3   5.527  -1.079   1.494
   24   3HG2  VAL   3          HG21      VAL   3   5.917   0.160   2.681
   25    H    MET   4           HN       MET   4   9.195   1.807  -0.487
   26    HA   MET   4           HA       MET   4  11.111  -0.089  -1.709
   27   1HB   MET   4           HB2      MET   4  10.704   2.889  -2.296
   28   2HB   MET   4           HB1      MET   4  12.045   1.937  -2.923
   29   1HG   MET   4           HG1      MET   4   9.160   1.173  -3.364
   30   2HG   MET   4           HG2      MET   4  10.006   2.246  -4.446
   31   1HE   MET   4           HE3      MET   4  10.815   1.616  -6.487
   32   2HE   MET   4           HE1      MET   4  12.365   1.454  -5.665
   33   3HE   MET   4           HE2      MET   4  11.849   0.227  -6.822
   34    H    THR   5           HN       THR   5  13.331   0.927  -1.480
   35    HA   THR   5           HA       THR   5  13.751   2.449   1.008
   36    HB   THR   5           HB       THR   5  14.963  -0.356   0.628
   37    HG1  THR   5           HG1      THR   5  12.630   0.676   1.751
   38   1HG2  THR   5          HG22      THR   5  14.768   1.547   3.031
   39   2HG2  THR   5          HG23      THR   5  15.483  -0.061   3.070
   40   3HG2  THR   5          HG21      THR   5  16.254   1.222   2.143
   41    H    GLN   6           HN       GLN   6  14.754   4.015  -0.227
   42    HA   GLN   6           HA       GLN   6  16.948   3.312  -2.030
   43   1HB   GLN   6           HB2      GLN   6  15.364   5.242  -2.404
   44   2HB   GLN   6           HB1      GLN   6  16.064   6.038  -0.999
   45   1HG   GLN   6           HG1      GLN   6  17.505   6.955  -2.514
   46   2HG   GLN   6           HG2      GLN   6  18.319   5.399  -2.434
   47   1HE2  GLN   6          HE22      GLN   6  17.606   4.640  -5.771
   48   2HE2  GLN   6          HE21      GLN   6  18.536   4.332  -4.388
   49    H    THR   7           HN       THR   7  19.066   3.823  -1.807
   50    HA   THR   7           HA       THR   7  20.179   5.038   0.598
   51    HB   THR   7           HB       THR   7  21.610   2.715   0.826
   52    HG1  THR   7           HG1      THR   7  19.061   2.093  -0.271
   53   1HG2  THR   7          HG23      THR   7  19.698   3.853   2.420
   54   2HG2  THR   7          HG21      THR   7  18.780   2.465   1.847
   55   3HG2  THR   7          HG22      THR   7  20.287   2.222   2.723
   56    HA   PRO   8           HA       PRO   8  22.307   4.405   1.514
   57   1HB   PRO   8           HB2      PRO   8  24.461   6.254   1.607
   58   2HB   PRO   8           HB1      PRO   8  24.615   4.497   1.643
   59   1HG   PRO   8           HG1      PRO   8  25.291   6.340  -0.520
   60   2HG   PRO   8           HG2      PRO   8  25.646   4.618  -0.398
   61   1HD   PRO   8           HD1      PRO   8  23.628   5.895  -2.028
   62   2HD   PRO   8           HD2      PRO   8  23.977   4.161  -1.896
   63    H    LEU   9           HN       LEU   9  22.412   6.268   3.170
   64    HA   LEU   9           HA       LEU   9  20.378   8.192   2.478
   65   1HB   LEU   9           HB2      LEU   9  22.150   7.611   4.836
   66   2HB   LEU   9           HB1      LEU   9  21.463   9.229   4.754
   67    HG   LEU   9           HG       LEU   9  19.192   8.183   4.437
   68   1HD1  LEU   9          HD13      LEU   9  20.790   5.657   4.992
   69   2HD1  LEU   9          HD11      LEU   9  19.034   5.743   5.086
   70   3HD1  LEU   9          HD12      LEU   9  19.847   6.012   3.547
   71   1HD2  LEU   9          HD23      LEU   9  19.976   8.919   6.671
   72   2HD2  LEU   9          HD21      LEU   9  18.959   7.488   6.800
   73   3HD2  LEU   9          HD22      LEU   9  20.708   7.339   6.933
   74    H    SER  10           HN       SER  10  23.832   8.180   2.446
   75    HA   SER  10           HA       SER  10  23.823  10.857   1.156
   76   1HB   SER  10           HB2      SER  10  25.766  10.014   3.382
   77   2HB   SER  10           HB1      SER  10  25.721  11.594   2.576
   78    HG   SER  10           HG       SER  10  24.356  10.933   4.670
   79    H    LEU  11           HN       LEU  11  25.068  10.850  -0.636
   80    HA   LEU  11           HA       LEU  11  27.104   8.669  -0.898
   81   1HB   LEU  11           HB2      LEU  11  24.985   8.341  -2.276
   82   2HB   LEU  11           HB1      LEU  11  25.377   9.826  -3.131
   83    HG   LEU  11           HG       LEU  11  27.749   8.577  -3.404
   84   1HD1  LEU  11          HD13      LEU  11  26.944   6.584  -2.118
   85   2HD1  LEU  11          HD11      LEU  11  25.716   6.319  -3.352
   86   3HD1  LEU  11          HD12      LEU  11  27.422   6.179  -3.762
   87   1HD2  LEU  11          HD23      LEU  11  25.275   8.038  -5.084
   88   2HD2  LEU  11          HD21      LEU  11  26.349   9.424  -5.245
   89   3HD2  LEU  11          HD22      LEU  11  26.936   7.808  -5.624
   90    HA   PRO  12           HA       PRO  12  29.361  12.558  -1.555
   91   1HB   PRO  12           HB2      PRO  12  31.779  11.219  -0.791
   92   2HB   PRO  12           HB1      PRO  12  30.832  12.322   0.205
   93   1HG   PRO  12           HG1      PRO  12  31.089   9.434   0.465
   94   2HG   PRO  12           HG2      PRO  12  30.254  10.556   1.540
   95   1HD   PRO  12           HD1      PRO  12  29.079   8.695  -0.329
   96   2HD   PRO  12           HD2      PRO  12  28.237   9.833   0.740
   97    H    VAL  13           HN       VAL  13  29.916  12.951  -3.622
   98    HA   VAL  13           HA       VAL  13  31.609  10.943  -5.049
   99    HB   VAL  13           HB       VAL  13  30.239  11.320  -7.097
  100   1HG1  VAL  13          HG13      VAL  13  29.591   9.537  -5.444
  101   2HG1  VAL  13          HG11      VAL  13  28.457  10.676  -4.725
  102   3HG1  VAL  13          HG12      VAL  13  28.232  10.141  -6.387
  103   1HG2  VAL  13          HG22      VAL  13  28.792  13.240  -5.258
  104   2HG2  VAL  13          HG23      VAL  13  29.452  13.556  -6.860
  105   3HG2  VAL  13          HG21      VAL  13  28.004  12.569  -6.680
  106    H    SER  14           HN       SER  14  31.840  12.212  -7.448
  107    HA   SER  14           HA       SER  14  32.759  14.979  -6.916
  108   1HB   SER  14           HB2      SER  14  34.632  13.119  -6.535
  109   2HB   SER  14           HB1      SER  14  34.673  13.082  -8.310
  110    HG   SER  14           HG       SER  14  36.012  14.738  -7.703
  111    H    LEU  15           HN       LEU  15  33.327  16.117  -8.916
  112    HA   LEU  15           HA       LEU  15  31.459  15.436 -11.036
  113   1HB   LEU  15           HB2      LEU  15  33.609  17.580 -10.796
  114   2HB   LEU  15           HB1      LEU  15  32.483  17.467 -12.145
  115    HG   LEU  15           HG       LEU  15  31.445  17.484  -9.319
  116   1HD1  LEU  15          HD13      LEU  15  33.036  19.485  -9.863
  117   2HD1  LEU  15          HD11      LEU  15  31.736  20.016 -10.926
  118   3HD1  LEU  15          HD12      LEU  15  31.443  19.834  -9.199
  119   1HD2  LEU  15          HD22      LEU  15  29.952  16.922 -11.233
  120   2HD2  LEU  15          HD23      LEU  15  29.463  18.406 -10.427
  121   3HD2  LEU  15          HD21      LEU  15  30.325  18.482 -11.959
  122    H    GLY  16           HN       GLY  16  32.191  13.439 -11.700
  123   1HA   GLY  16           HA1      GLY  16  33.351  12.951 -14.014
  124   2HA   GLY  16           HA2      GLY  16  34.813  13.323 -13.105
  125    H    ASP  17           HN       ASP  17  33.448  12.164 -10.675
  126    HA   ASP  17           HA       ASP  17  34.477   9.461 -11.004
  127   1HB   ASP  17           HB2      ASP  17  34.582  10.827  -8.851
  128   2HB   ASP  17           HB1      ASP  17  32.839  10.640  -8.707
  129    H    GLN  18           HN       GLN  18  33.001   7.679  -9.958
  130    HA   GLN  18           HA       GLN  18  30.562   7.618 -11.642
  131   1HB   GLN  18           HB2      GLN  18  31.948   5.434 -10.006
  132   2HB   GLN  18           HB1      GLN  18  30.596   5.170 -11.103
  133   1HG   GLN  18           HG1      GLN  18  32.055   6.208 -12.940
  134   2HG   GLN  18           HG2      GLN  18  33.402   6.082 -11.812
  135   1HE2  GLN  18          HE22      GLN  18  33.911   2.686 -12.535
  136   2HE2  GLN  18          HE21      GLN  18  34.530   4.144 -11.925
  137    H    ALA  19           HN       ALA  19  28.875   5.991 -10.400
  138    HA   ALA  19           HA       ALA  19  28.502   6.824  -7.595
  139   1HB   ALA  19           HB1      ALA  19  27.504   8.587  -9.292
  140   2HB   ALA  19           HB2      ALA  19  26.250   7.379  -9.551
  141   3HB   ALA  19           HB3      ALA  19  26.498   8.062  -7.947
  142    H    SER  20           HN       SER  20  26.762   5.668  -6.549
  143    HA   SER  20           HA       SER  20  25.493   3.486  -8.075
  144   1HB   SER  20           HB2      SER  20  26.398   1.762  -6.402
  145   2HB   SER  20           HB1      SER  20  27.667   2.473  -7.418
  146    HG   SER  20           HG       SER  20  26.927   3.141  -4.766
  147    H    ILE  21           HN       ILE  21  23.670   4.781  -7.434
  148    HA   ILE  21           HA       ILE  21  22.993   4.965  -4.581
  149    HB   ILE  21           HB       ILE  21  21.073   5.348  -6.902
  150   1HG1  ILE  21          HG11      ILE  21  23.095   7.401  -5.932
  151   2HG1  ILE  21          HG12      ILE  21  23.214   6.527  -7.454
  152   1HG2  ILE  21          HG21      ILE  21  21.114   5.879  -4.050
  153   2HG2  ILE  21          HG22      ILE  21  20.968   7.407  -4.910
  154   3HG2  ILE  21          HG23      ILE  21  19.790   6.130  -5.181
  155   1HD1  ILE  21          HD12      ILE  21  20.806   7.430  -7.904
  156   2HD1  ILE  21          HD13      ILE  21  21.169   8.585  -6.626
  157   3HD1  ILE  21          HD11      ILE  21  22.159   8.544  -8.080
  158    H    SER  22           HN       SER  22  22.216   3.299  -3.518
  159    HA   SER  22           HA       SER  22  21.088   0.984  -4.938
  160   1HB   SER  22           HB2      SER  22  22.619   0.580  -3.035
  161   2HB   SER  22           HB1      SER  22  21.568   1.522  -1.961
  162    HG   SER  22           HG       SER  22  20.719  -0.430  -1.705
  163    H    CYS  23           HN       CYS  23  19.078   0.049  -4.436
  164    HA   CYS  23           HA       CYS  23  17.078   1.486  -2.882
  165   1HB   CYS  23           HB2      CYS  23  17.431   2.228  -5.596
  166   2HB   CYS  23           HB1      CYS  23  16.028   1.193  -5.598
  167    NH1  ARG  24           NH2      ARG  24  19.767  -5.692   0.241
  168    NH2  ARG  24           NH1      ARG  24  18.791  -7.158  -1.195
  169    H    ARG  24           HN       ARG  24  15.811  -0.051  -2.038
  170    HA   ARG  24           HA       ARG  24  15.516  -2.594  -3.598
  171   1HB   ARG  24           HB2      ARG  24  15.720  -2.055  -0.609
  172   2HB   ARG  24           HB1      ARG  24  15.112  -3.584  -1.229
  173   1HG   ARG  24           HG1      ARG  24  17.586  -2.777  -2.566
  174   2HG   ARG  24           HG2      ARG  24  17.804  -2.920  -0.827
  175   1HD   ARG  24           HD1      ARG  24  16.220  -5.115  -2.011
  176   2HD   ARG  24           HD2      ARG  24  17.883  -5.039  -2.589
  177    HE   ARG  24           HE       ARG  24  17.190  -5.171   0.325
  178   1HH1  ARG  24          HH21      ARG  24  19.707  -4.849   0.772
  179   2HH1  ARG  24          HH22      ARG  24  20.601  -6.239   0.265
  180   1HH2  ARG  24          HH11      ARG  24  17.996  -7.414  -1.747
  181   2HH2  ARG  24          HH12      ARG  24  19.606  -7.737  -1.191
  182    H    SER  25           HN       SER  25  13.539  -3.731  -3.386
  183    HA   SER  25           HA       SER  25  11.228  -1.932  -2.756
  184   1HB   SER  25           HB2      SER  25  11.065  -2.446  -5.091
  185   2HB   SER  25           HB1      SER  25  11.658  -4.099  -4.857
  186    HG   SER  25           HG       SER  25   9.449  -4.228  -5.017
  187    H    SER  26           HN       SER  26   9.361  -2.894  -1.792
  188    HA   SER  26           HA       SER  26  10.050  -4.885   0.210
  189   1HB   SER  26           HB2      SER  26   7.681  -4.580   0.940
  190   2HB   SER  26           HB1      SER  26   8.381  -2.991   0.576
  191    HG   SER  26           HG       SER  26   6.756  -4.624  -1.077
  192    H    GLN  27           HN       GLN  27   8.346  -4.897  -2.844
  193    HA   GLN  27           HA       GLN  27   8.226  -7.865  -2.669
  194   1HB   GLN  27           HB2      GLN  27   5.986  -6.268  -2.408
  195   2HB   GLN  27           HB1      GLN  27   6.009  -6.536  -4.148
  196   1HG   GLN  27           HG1      GLN  27   6.214  -8.992  -3.721
  197   2HG   GLN  27           HG2      GLN  27   6.066  -8.673  -1.996
  198   1HE2  GLN  27          HE22      GLN  27   2.683  -9.398  -3.591
  199   2HE2  GLN  27          HE21      GLN  27   4.171 -10.203  -3.702
  200    H    SER  28           HN       SER  28   8.361  -8.942  -4.658
  201    HA   SER  28           HA       SER  28  10.111  -7.893  -6.575
  202   1HB   SER  28           HB2      SER  28   8.977  -9.729  -8.104
  203   2HB   SER  28           HB1      SER  28   9.719 -10.283  -6.592
  204    HG   SER  28           HG       SER  28   7.017  -9.441  -6.842
  205    H    LEU  29           HN       LEU  29   9.928  -6.455  -8.180
  206    HA   LEU  29           HA       LEU  29   7.322  -5.224  -8.694
  207   1HB   LEU  29           HB2      LEU  29  10.022  -4.781 -10.039
  208   2HB   LEU  29           HB1      LEU  29   8.617  -3.745 -10.231
  209    HG   LEU  29           HG       LEU  29  10.042  -4.295  -7.609
  210   1HD1  LEU  29          HD12      LEU  29  11.277  -2.831  -9.252
  211   2HD1  LEU  29          HD13      LEU  29   9.890  -1.749  -9.269
  212   3HD1  LEU  29          HD11      LEU  29  10.809  -1.979  -7.785
  213   1HD2  LEU  29          HD23      LEU  29   7.553  -2.775  -8.365
  214   2HD2  LEU  29          HD21      LEU  29   7.815  -3.856  -7.001
  215   3HD2  LEU  29          HD22      LEU  29   8.519  -2.242  -6.993
  216    H    VAL  30           HN       VAL  30   7.765  -8.045  -9.479
  217    HA   VAL  30           HA       VAL  30   7.720  -7.943 -12.428
  218    HB   VAL  30           HB       VAL  30   7.321 -10.293 -10.512
  219   1HG1  VAL  30          HG13      VAL  30   7.964 -10.150 -13.481
  220   2HG1  VAL  30          HG11      VAL  30   7.966 -11.631 -12.529
  221   3HG1  VAL  30          HG12      VAL  30   6.466 -10.742 -12.770
  222   1HG2  VAL  30          HG21      VAL  30   9.808  -9.253 -11.919
  223   2HG2  VAL  30          HG22      VAL  30   9.530  -9.285 -10.181
  224   3HG2  VAL  30          HG23      VAL  30   9.717 -10.793 -11.070
  225    H    HIS  31           HN       HIS  31   5.929  -8.037 -13.645
  226    HA   HIS  31           HA       HIS  31   3.335  -7.789 -12.302
  227   1HB   HIS  31           HB2      HIS  31   4.280  -6.630 -14.519
  228   2HB   HIS  31           HB1      HIS  31   3.649  -8.080 -15.294
  229    HD2  HIS  31           HD2      HIS  31   2.271  -5.148 -13.004
  230    HE1  HIS  31           HE1      HIS  31  -0.860  -6.789 -15.149
  231    H    SER  32           HN       SER  32   1.556  -8.970 -13.929
  232    HA   SER  32           HA       SER  32   1.805 -11.785 -13.169
  233   1HB   SER  32           HB2      SER  32  -0.506 -11.822 -14.457
  234   2HB   SER  32           HB1      SER  32  -0.419 -10.840 -12.982
  235    HG   SER  32           HG       SER  32   0.465  -9.685 -15.368
  236    H    ASN  33           HN       ASN  33   3.469 -10.453 -15.380
  237    HA   ASN  33           HA       ASN  33   3.275 -12.742 -17.235
  238   1HB   ASN  33           HB2      ASN  33   3.585 -10.679 -19.055
  239   2HB   ASN  33           HB1      ASN  33   2.032 -11.420 -18.686
  240   1HD2  ASN  33          HD22      ASN  33   2.724  -7.591 -17.608
  241   2HD2  ASN  33          HD21      ASN  33   3.863  -8.496 -18.482
  242    H    GLY  34           HN       GLY  34   5.037 -12.046 -19.137
  243   1HA   GLY  34           HA1      GLY  34   7.561 -12.028 -17.657
  244   2HA   GLY  34           HA2      GLY  34   7.390 -12.190 -19.402
  245    H    ASN  35           HN       ASN  35   6.468  -9.671 -17.055
  246    HA   ASN  35           HA       ASN  35   8.253  -7.762 -18.462
  247   1HB   ASN  35           HB2      ASN  35   5.287  -7.240 -17.931
  248   2HB   ASN  35           HB1      ASN  35   6.410  -6.120 -18.697
  249   1HD2  ASN  35          HD22      ASN  35   6.576  -8.068 -21.748
  250   2HD2  ASN  35          HD21      ASN  35   7.565  -7.145 -20.724
  251    H    THR  36           HN       THR  36   8.962  -6.077 -17.194
  252    HA   THR  36           HA       THR  36   7.877  -5.863 -14.432
  253    HB   THR  36           HB       THR  36  10.846  -6.286 -15.138
  254    HG1  THR  36           HG1      THR  36   8.797  -7.894 -14.746
  255   1HG2  THR  36          HG23      THR  36   9.780  -4.901 -12.922
  256   2HG2  THR  36          HG21      THR  36   9.873  -6.559 -12.337
  257   3HG2  THR  36          HG22      THR  36  11.324  -5.747 -12.914
  258    OH   TYR  37           OH       TYR  37   3.841  -4.305 -17.920
  259    H    TYR  37           HN       TYR  37   7.871  -3.832 -13.651
  260    HA   TYR  37           HA       TYR  37   9.117  -1.738 -15.384
  261   1HB   TYR  37           HB2      TYR  37   6.808  -1.337 -13.437
  262   2HB   TYR  37           HB1      TYR  37   7.279  -0.294 -14.778
  263    HD1  TYR  37           HD2      TYR  37   6.943  -1.103 -17.139
  264    HD2  TYR  37           HD1      TYR  37   5.423  -3.269 -13.809
  265    HE1  TYR  37           HE2      TYR  37   5.503  -2.402 -18.641
  266    HE2  TYR  37           HE1      TYR  37   3.980  -4.563 -15.311
  267    HH   TYR  37           HH       TYR  37   3.564  -3.732 -18.639
  268    H    LEU  38           HN       LEU  38  10.529  -0.395 -14.555
  269    HA   LEU  38           HA       LEU  38  10.688   0.146 -11.670
  270   1HB   LEU  38           HB2      LEU  38  12.046  -2.029 -12.376
  271   2HB   LEU  38           HB1      LEU  38  13.168  -0.891 -13.093
  272    HG   LEU  38           HG       LEU  38  12.791  -1.610 -10.277
  273   1HD1  LEU  38          HD13      LEU  38  14.887  -0.242 -11.975
  274   2HD1  LEU  38          HD11      LEU  38  15.090  -0.457 -10.238
  275   3HD1  LEU  38          HD12      LEU  38  14.926  -1.863 -11.287
  276   1HD2  LEU  38          HD22      LEU  38  11.629   0.581 -10.170
  277   2HD2  LEU  38          HD23      LEU  38  13.175   0.628  -9.339
  278   3HD2  LEU  38          HD21      LEU  38  13.020   1.347 -10.937
  279    H    ASN  39           HN       ASN  39  11.196   2.286 -11.492
  280    HA   ASN  39           HA       ASN  39  12.919   3.427 -13.638
  281   1HB   ASN  39           HB2      ASN  39  11.452   5.332 -13.923
  282   2HB   ASN  39           HB1      ASN  39  10.418   3.910 -13.983
  283   1HD2  ASN  39          HD22      ASN  39   8.611   6.077 -11.704
  284   2HD2  ASN  39          HD21      ASN  39   8.875   5.868 -13.366
  285    CH2  TRP  40           CH2      TRP  40  18.567   3.999  -7.612
  286    H    TRP  40           HN       TRP  40  13.649   5.650 -13.105
  287    HA   TRP  40           HA       TRP  40  14.259   5.870 -10.195
  288   1HB   TRP  40           HB2      TRP  40  16.015   6.043 -12.650
  289   2HB   TRP  40           HB1      TRP  40  16.492   6.889 -11.186
  290    HD1  TRP  40           HD1      TRP  40  15.647   3.268 -12.391
  291    HE1  TRP  40           HE1      TRP  40  16.853   1.747 -10.771
  292    HE3  TRP  40           HE3      TRP  40  17.298   6.677  -9.206
  293    HZ2  TRP  40           HZ2      TRP  40  18.372   1.970  -8.262
  294    HZ3  TRP  40           HZ3      TRP  40  18.595   6.095  -7.203
  295    HH2  TRP  40           HH2      TRP  40  19.150   3.749  -6.743
  296    OH   TYR  41           OH       TYR  41   8.403  11.412 -13.280
  297    H    TYR  41           HN       TYR  41  14.512   7.975  -9.393
  298    HA   TYR  41           HA       TYR  41  13.712  10.188 -11.230
  299   1HB   TYR  41           HB2      TYR  41  12.147   8.987  -9.066
  300   2HB   TYR  41           HB1      TYR  41  12.448  10.688  -8.731
  301    HD1  TYR  41           HD1      TYR  41  11.540   8.561 -11.696
  302    HD2  TYR  41           HD2      TYR  41  10.855  12.163  -9.548
  303    HE1  TYR  41           HE1      TYR  41   9.825   9.206 -13.326
  304    HE2  TYR  41           HE2      TYR  41   9.145  12.814 -11.183
  305    HH   TYR  41           HH       TYR  41   7.721  11.901 -12.815
  306    H    LEU  42           HN       LEU  42  14.442  12.217 -10.663
  307    HA   LEU  42           HA       LEU  42  16.129  12.443  -8.211
  308   1HB   LEU  42           HB2      LEU  42  17.863  12.157  -9.792
  309   2HB   LEU  42           HB1      LEU  42  16.918  12.842 -11.104
  310    HG   LEU  42           HG       LEU  42  17.147  15.104 -10.008
  311   1HD1  LEU  42          HD11      LEU  42  17.745  13.853  -7.737
  312   2HD1  LEU  42          HD12      LEU  42  19.385  13.957  -8.364
  313   3HD1  LEU  42          HD13      LEU  42  18.452  15.425  -8.093
  314   1HD2  LEU  42          HD22      LEU  42  19.599  13.538 -10.840
  315   2HD2  LEU  42          HD23      LEU  42  18.643  14.652 -11.813
  316   3HD2  LEU  42          HD21      LEU  42  19.661  15.267 -10.514
  317    H    GLN  43           HN       GLN  43  15.589  14.219  -7.090
  318    HA   GLN  43           HA       GLN  43  14.156  16.384  -8.581
  319   1HB   GLN  43           HB2      GLN  43  13.024  14.893  -6.669
  320   2HB   GLN  43           HB1      GLN  43  13.862  16.015  -5.603
  321   1HG   GLN  43           HG1      GLN  43  12.733  17.911  -6.570
  322   2HG   GLN  43           HG2      GLN  43  12.099  16.938  -7.894
  323   1HE2  GLN  43          HE22      GLN  43   9.300  17.202  -5.541
  324   2HE2  GLN  43          HE21      GLN  43  10.128  18.195  -6.641
  325    H    LYS  44           HN       LYS  44  14.477  18.517  -7.968
  326    HA   LYS  44           HA       LYS  44  17.161  19.013  -6.790
  327   1HB   LYS  44           HB2      LYS  44  15.864  20.009  -9.057
  328   2HB   LYS  44           HB1      LYS  44  15.626  21.303  -7.891
  329   1HG   LYS  44           HG1      LYS  44  17.701  21.911  -8.731
  330   2HG   LYS  44           HG2      LYS  44  18.212  20.879  -7.401
  331   1HD   LYS  44           HD1      LYS  44  17.653  19.264  -9.748
  332   2HD   LYS  44           HD2      LYS  44  18.794  20.538 -10.157
  333   1HE   LYS  44           HE1      LYS  44  20.435  19.688  -8.798
  334   2HE   LYS  44           HE2      LYS  44  19.289  19.142  -7.581
  335   1HZ   LYS  44           HZ1      LYS  44  19.895  17.830 -10.167
  336   2HZ   LYS  44           HZ2      LYS  44  20.280  17.260  -8.615
  337    H    ALA  45           HN       ALA  45  16.816  21.648  -5.996
  338    HA   ALA  45           HA       ALA  45  15.669  21.288  -3.380
  339   1HB   ALA  45           HB3      ALA  45  17.530  22.896  -3.903
  340   2HB   ALA  45           HB1      ALA  45  16.406  23.869  -4.845
  341   3HB   ALA  45           HB2      ALA  45  16.186  23.707  -3.106
  342    H    GLY  46           HN       GLY  46  13.512  20.591  -3.927
  343   1HA   GLY  46           HA1      GLY  46  11.198  21.004  -4.036
  344   2HA   GLY  46           HA2      GLY  46  11.570  22.700  -3.743
  345    H    GLN  47           HN       GLN  47  12.596  20.632  -6.421
  346    HA   GLN  47           HA       GLN  47  11.068  22.424  -8.272
  347   1HB   GLN  47           HB2      GLN  47  13.620  22.716  -8.240
  348   2HB   GLN  47           HB1      GLN  47  13.739  21.071  -8.854
  349   1HG   GLN  47           HG1      GLN  47  12.767  21.632 -10.921
  350   2HG   GLN  47           HG2      GLN  47  11.976  23.066 -10.269
  351   1HE2  GLN  47          HE22      GLN  47  15.995  23.295 -11.127
  352   2HE2  GLN  47          HE21      GLN  47  15.328  21.797 -10.691
  353    H    SER  48           HN       SER  48  10.692  21.420 -10.430
  354    HA   SER  48           HA       SER  48   9.287  18.971 -10.174
  355   1HB   SER  48           HB2      SER  48   9.409  19.018 -12.770
  356   2HB   SER  48           HB1      SER  48   8.781  20.502 -12.029
  357    HG   SER  48           HG       SER  48  11.531  20.035 -12.556
  358    HA   PRO  49           HA       PRO  49  12.809  16.254 -10.080
  359   1HB   PRO  49           HB2      PRO  49  11.025  13.995 -10.308
  360   2HB   PRO  49           HB1      PRO  49  11.831  14.580  -8.854
  361   1HG   PRO  49           HG1      PRO  49   9.027  14.792  -9.539
  362   2HG   PRO  49           HG2      PRO  49   9.825  15.344  -8.066
  363   1HD   PRO  49           HD1      PRO  49   8.820  16.953 -10.243
  364   2HD   PRO  49           HD2      PRO  49   9.630  17.510  -8.767
  365    H    LYS  50           HN       LYS  50  13.896  14.972 -11.552
  366    HA   LYS  50           HA       LYS  50  12.750  14.940 -14.304
  367   1HB   LYS  50           HB2      LYS  50  15.495  15.153 -13.105
  368   2HB   LYS  50           HB1      LYS  50  15.378  14.291 -14.634
  369   1HG   LYS  50           HG1      LYS  50  13.954  16.349 -15.404
  370   2HG   LYS  50           HG2      LYS  50  14.696  17.166 -14.032
  371   1HD   LYS  50           HD1      LYS  50  16.912  16.786 -14.896
  372   2HD   LYS  50           HD2      LYS  50  16.314  15.668 -16.117
  373   1HE   LYS  50           HE1      LYS  50  14.920  17.649 -17.004
  374   2HE   LYS  50           HE2      LYS  50  15.938  18.667 -15.991
  375   1HZ   LYS  50           HZ1      LYS  50  17.725  17.095 -17.280
  376   2HZ   LYS  50           HZ2      LYS  50  16.547  17.369 -18.474
  377    H    LEU  51           HN       LEU  51  13.046  13.068 -15.625
  378    HA   LEU  51           HA       LEU  51  13.103  10.549 -14.026
  379   1HB   LEU  51           HB2      LEU  51  11.060  10.819 -15.334
  380   2HB   LEU  51           HB1      LEU  51  11.970  11.266 -16.770
  381    HG   LEU  51           HG       LEU  51  13.018   8.949 -16.717
  382   1HD1  LEU  51          HD11      LEU  51  12.099   8.776 -14.184
  383   2HD1  LEU  51          HD12      LEU  51  10.737   8.034 -15.017
  384   3HD1  LEU  51          HD13      LEU  51  12.351   7.352 -15.187
  385   1HD2  LEU  51          HD21      LEU  51  11.019   9.644 -18.133
  386   2HD2  LEU  51          HD22      LEU  51  11.128   7.919 -17.798
  387   3HD2  LEU  51          HD23      LEU  51   9.991   8.920 -16.900
  388    H    LEU  52           HN       LEU  52  14.641   9.033 -14.375
  389    HA   LEU  52           HA       LEU  52  16.631   9.618 -16.536
  390   1HB   LEU  52           HB2      LEU  52  16.967   8.177 -13.864
  391   2HB   LEU  52           HB1      LEU  52  18.249   8.376 -15.053
  392    HG   LEU  52           HG       LEU  52  16.761  10.811 -14.098
  393   1HD1  LEU  52          HD13      LEU  52  18.966   9.347 -12.608
  394   2HD1  LEU  52          HD11      LEU  52  18.499  11.013 -12.277
  395   3HD1  LEU  52          HD12      LEU  52  17.349   9.705 -12.012
  396   1HD2  LEU  52          HD22      LEU  52  19.582  10.192 -15.039
  397   2HD2  LEU  52          HD23      LEU  52  18.354  11.114 -15.901
  398   3HD2  LEU  52          HD21      LEU  52  19.082  11.770 -14.438
  399    H    ILE  53           HN       ILE  53  15.900   6.753 -14.582
  400    HA   ILE  53           HA       ILE  53  15.866   5.161 -17.113
  401    HB   ILE  53           HB       ILE  53  16.305   4.219 -14.244
  402   1HG1  ILE  53          HG11      ILE  53  18.030   5.836 -14.905
  403   2HG1  ILE  53          HG12      ILE  53  18.696   4.218 -14.741
  404   1HG2  ILE  53          HG23      ILE  53  16.057   2.874 -16.836
  405   2HG2  ILE  53          HG21      ILE  53  17.641   2.550 -16.136
  406   3HG2  ILE  53          HG22      ILE  53  16.177   2.148 -15.240
  407   1HD1  ILE  53          HD11      ILE  53  17.903   4.231 -17.365
  408   2HD1  ILE  53          HD12      ILE  53  18.407   5.899 -17.140
  409   3HD1  ILE  53          HD13      ILE  53  19.538   4.588 -16.824
  410    OH   TYR  54           OH       TYR  54  12.280   4.028 -22.780
  411    H    TYR  54           HN       TYR  54  14.205   3.580 -17.387
  412    HA   TYR  54           HA       TYR  54  12.051   3.511 -15.365
  413   1HB   TYR  54           HB2      TYR  54  10.308   4.203 -16.978
  414   2HB   TYR  54           HB1      TYR  54  11.529   5.466 -16.865
  415    HD1  TYR  54           HD1      TYR  54  13.227   5.714 -18.689
  416    HD2  TYR  54           HD2      TYR  54  10.005   2.954 -19.022
  417    HE1  TYR  54           HE1      TYR  54  13.630   5.524 -21.099
  418    HE2  TYR  54           HE2      TYR  54  10.405   2.780 -21.435
  419    HH   TYR  54           HH       TYR  54  13.184   3.721 -22.896
  420    H    LYS  55           HN       LYS  55  13.964   1.643 -16.649
  421    HA   LYS  55           HA       LYS  55  12.226  -0.623 -16.832
  422   1HB   LYS  55           HB2      LYS  55  12.249   0.871 -19.188
  423   2HB   LYS  55           HB1      LYS  55  13.489  -0.331 -19.511
  424   1HG   LYS  55           HG1      LYS  55  11.749  -1.676 -20.100
  425   2HG   LYS  55           HG2      LYS  55  11.504  -1.866 -18.368
  426   1HD   LYS  55           HD1      LYS  55   9.790  -0.237 -18.308
  427   2HD   LYS  55           HD2      LYS  55  10.287   0.476 -19.838
  428   1HE   LYS  55           HE1      LYS  55   9.489  -2.393 -19.913
  429   2HE   LYS  55           HE2      LYS  55   8.200  -1.228 -19.635
  430   1HZ   LYS  55           HZ1      LYS  55   9.246   0.000 -21.615
  431   2HZ   LYS  55           HZ2      LYS  55   9.983  -1.491 -21.962
  432    H    VAL  56           HN       VAL  56  14.186  -0.523 -15.270
  433    HA   VAL  56           HA       VAL  56  16.413  -1.083 -14.741
  434    HB   VAL  56           HB       VAL  56  16.693  -3.507 -14.904
  435   1HG1  VAL  56          HG12      VAL  56  13.828  -2.613 -14.504
  436   2HG1  VAL  56          HG13      VAL  56  14.417  -4.215 -14.070
  437   3HG1  VAL  56          HG11      VAL  56  15.079  -2.788 -13.274
  438   1HG2  VAL  56          HG23      VAL  56  14.662  -3.253 -17.116
  439   2HG2  VAL  56          HG21      VAL  56  16.220  -4.078 -17.133
  440   3HG2  VAL  56          HG22      VAL  56  14.862  -4.768 -16.245
  441    H    SER  57           HN       SER  57  17.897   0.069 -15.810
  442    HA   SER  57           HA       SER  57  19.756   0.351 -17.185
  443   1HB   SER  57           HB2      SER  57  19.194  -2.504 -17.278
  444   2HB   SER  57           HB1      SER  57  19.678  -1.964 -18.900
  445    HG   SER  57           HG       SER  57  21.217  -2.245 -16.760
  446    H    ASN  58           HN       ASN  58  17.458   1.561 -17.884
  447    HA   ASN  58           HA       ASN  58  17.792   1.774 -20.803
  448   1HB   ASN  58           HB2      ASN  58  15.881   0.554 -21.195
  449   2HB   ASN  58           HB1      ASN  58  15.504   0.488 -19.482
  450   1HD2  ASN  58          HD22      ASN  58  13.128   3.073 -19.619
  451   2HD2  ASN  58          HD21      ASN  58  14.025   2.032 -18.628
  452    NH1  ARG  59           NH2      ARG  59  21.419   6.487 -23.186
  453    NH2  ARG  59           NH1      ARG  59  22.895   4.774 -22.961
  454    H    ARG  59           HN       ARG  59  18.346   3.833 -20.912
  455    HA   ARG  59           HA       ARG  59  17.364   5.818 -19.019
  456   1HB   ARG  59           HB2      ARG  59  19.077   5.982 -21.517
  457   2HB   ARG  59           HB1      ARG  59  18.742   7.363 -20.480
  458   1HG   ARG  59           HG1      ARG  59  19.947   6.471 -18.678
  459   2HG   ARG  59           HG2      ARG  59  19.789   4.818 -19.263
  460   1HD   ARG  59           HD1      ARG  59  21.418   6.993 -20.599
  461   2HD   ARG  59           HD2      ARG  59  22.082   5.689 -19.620
  462    HE   ARG  59           HE       ARG  59  20.803   4.208 -21.429
  463   1HH1  ARG  59          HH21      ARG  59  20.626   6.985 -22.836
  464   2HH1  ARG  59          HH22      ARG  59  21.877   6.796 -24.020
  465   1HH2  ARG  59          HH11      ARG  59  23.215   3.984 -22.441
  466   2HH2  ARG  59          HH12      ARG  59  23.373   5.051 -23.796
  467    H    PHE  60           HN       PHE  60  16.214   7.687 -19.496
  468    HA   PHE  60           HA       PHE  60  14.185   7.318 -21.616
  469   1HB   PHE  60           HB2      PHE  60  13.603   7.978 -19.213
  470   2HB   PHE  60           HB1      PHE  60  14.398   9.521 -19.509
  471    HD1  PHE  60           HD2      PHE  60  11.708   7.302 -20.863
  472    HD2  PHE  60           HD1      PHE  60  13.191  11.282 -20.530
  473    HE1  PHE  60           HE2      PHE  60   9.667   8.155 -21.927
  474    HE2  PHE  60           HE1      PHE  60  11.145  12.130 -21.591
  475    HZ   PHE  60           HZ       PHE  60   9.382  10.568 -22.292
  476    H    SER  61           HN       SER  61  13.476   9.413 -22.732
  477    HA   SER  61           HA       SER  61  15.589  10.327 -24.401
  478   1HB   SER  61           HB2      SER  61  13.070  10.400 -24.906
  479   2HB   SER  61           HB1      SER  61  12.977  11.826 -23.852
  480    HG   SER  61           HG       SER  61  14.111  12.956 -25.253
  481    H    GLY  62           HN       GLY  62  17.158  11.737 -24.026
  482   1HA   GLY  62           HA1      GLY  62  17.990  13.921 -23.387
  483   2HA   GLY  62           HA2      GLY  62  16.645  14.075 -22.262
  484    H    VAL  63           HN       VAL  63  17.543  11.070 -21.672
  485    HA   VAL  63           HA       VAL  63  19.130  11.854 -19.331
  486    HB   VAL  63           HB       VAL  63  18.111   9.155 -20.326
  487   1HG1  VAL  63          HG11      VAL  63  19.398   9.941 -17.685
  488   2HG1  VAL  63          HG12      VAL  63  18.603   8.399 -17.983
  489   3HG1  VAL  63          HG13      VAL  63  20.063   8.823 -18.873
  490   1HG2  VAL  63          HG23      VAL  63  16.366  10.811 -19.675
  491   2HG2  VAL  63          HG21      VAL  63  16.415   9.446 -18.568
  492   3HG2  VAL  63          HG22      VAL  63  17.136  10.982 -18.102
  493    HA   PRO  64           HA       PRO  64  22.992  11.320 -21.423
  494   1HB   PRO  64           HB2      PRO  64  24.249  10.986 -18.805
  495   2HB   PRO  64           HB1      PRO  64  24.364  12.360 -19.901
  496   1HG   PRO  64           HG1      PRO  64  22.892  12.221 -17.441
  497   2HG   PRO  64           HG2      PRO  64  22.921  13.559 -18.590
  498   1HD   PRO  64           HD1      PRO  64  20.761  11.705 -18.076
  499   2HD   PRO  64           HD2      PRO  64  20.778  13.072 -19.207
  500    H    ASP  65           HN       ASP  65  24.141   9.582 -22.080
  501    HA   ASP  65           HA       ASP  65  23.281   6.959 -21.534
  502   1HB   ASP  65           HB2      ASP  65  25.997   7.916 -22.540
  503   2HB   ASP  65           HB1      ASP  65  25.389   6.271 -22.702
  504    NH1  ARG  66           NH2      ARG  66  26.876  13.648 -19.337
  505    NH2  ARG  66           NH1      ARG  66  25.321  14.281 -17.806
  506    H    ARG  66           HN       ARG  66  25.397   8.915 -19.652
  507    HA   ARG  66           HA       ARG  66  26.768   6.658 -18.412
  508   1HB   ARG  66           HB2      ARG  66  27.658   8.378 -16.841
  509   2HB   ARG  66           HB1      ARG  66  27.823   8.908 -18.508
  510   1HG   ARG  66           HG1      ARG  66  25.260   9.778 -17.657
  511   2HG   ARG  66           HG2      ARG  66  26.365  10.162 -16.344
  512   1HD   ARG  66           HD1      ARG  66  27.921  11.037 -18.284
  513   2HD   ARG  66           HD2      ARG  66  26.418  11.116 -19.198
  514    HE   ARG  66           HE       ARG  66  26.478  12.443 -16.536
  515   1HH1  ARG  66          HH21      ARG  66  27.563  12.988 -19.634
  516   2HH1  ARG  66          HH22      ARG  66  26.689  14.458 -19.890
  517   1HH2  ARG  66          HH11      ARG  66  24.838  14.099 -16.950
  518   2HH2  ARG  66          HH12      ARG  66  25.109  15.103 -18.334
  519    H    PHE  67           HN       PHE  67  23.786   6.719 -18.357
  520    HA   PHE  67           HA       PHE  67  23.506   6.426 -15.392
  521   1HB   PHE  67           HB2      PHE  67  21.826   7.894 -17.381
  522   2HB   PHE  67           HB1      PHE  67  20.939   6.947 -16.195
  523    HD1  PHE  67           HD2      PHE  67  23.250   9.772 -16.672
  524    HD2  PHE  67           HD1      PHE  67  21.046   7.503 -13.823
  525    HE1  PHE  67           HE2      PHE  67  23.661  11.500 -14.973
  526    HE2  PHE  67           HE1      PHE  67  21.453   9.231 -12.132
  527    HZ   PHE  67           HZ       PHE  67  22.757  11.233 -12.705
  528    H    SER  68           HN       SER  68  22.845   4.495 -14.746
  529    HA   SER  68           HA       SER  68  21.139   2.844 -16.513
  530   1HB   SER  68           HB2      SER  68  24.024   2.354 -15.957
  531   2HB   SER  68           HB1      SER  68  22.983   0.944 -15.678
  532    HG   SER  68           HG       SER  68  22.974   2.615 -17.979
  533    H    GLY  69           HN       GLY  69  19.482   2.646 -15.125
  534   1HA   GLY  69           HA1      GLY  69  20.093   1.753 -12.335
  535   2HA   GLY  69           HA2      GLY  69  18.636   2.627 -12.793
  536    H    SER  70           HN       SER  70  19.993  -0.407 -12.267
  537    HA   SER  70           HA       SER  70  17.482  -1.703 -13.216
  538   1HB   SER  70           HB2      SER  70  18.739  -3.471 -14.396
  539   2HB   SER  70           HB1      SER  70  19.354  -1.919 -14.994
  540    HG   SER  70           HG       SER  70  20.670  -2.374 -12.795
  541    H    GLY  71           HN       GLY  71  17.241  -3.913 -12.352
  542   1HA   GLY  71           HA1      GLY  71  18.965  -4.815 -10.210
  543   2HA   GLY  71           HA2      GLY  71  17.531  -4.017  -9.581
  544    H    SER  72           HN       SER  72  17.844  -6.535  -8.874
  545    HA   SER  72           HA       SER  72  16.494  -8.349 -10.741
  546   1HB   SER  72           HB2      SER  72  18.292  -8.783  -8.728
  547   2HB   SER  72           HB1      SER  72  16.786  -9.082  -7.841
  548    HG   SER  72           HG       SER  72  17.951 -10.671  -9.594
  549    H    GLY  73           HN       GLY  73  15.030  -9.735  -8.619
  550   1HA   GLY  73           HA1      GLY  73  12.440  -8.808  -8.990
  551   2HA   GLY  73           HA2      GLY  73  12.928  -9.690  -7.548
  552    H    THR  74           HN       THR  74  14.569  -7.936  -6.274
  553    HA   THR  74           HA       THR  74  13.133  -5.351  -6.050
  554    HB   THR  74           HB       THR  74  13.000  -5.717  -3.498
  555    HG1  THR  74           HG1      THR  74  12.943  -8.291  -3.455
  556   1HG2  THR  74          HG22      THR  74  11.081  -6.324  -5.265
  557   2HG2  THR  74          HG23      THR  74  11.538  -7.984  -4.896
  558   3HG2  THR  74          HG21      THR  74  10.940  -6.929  -3.618
  559    H    ASP  75           HN       ASP  75  15.783  -6.051  -6.937
  560    HA   ASP  75           HA       ASP  75  17.323  -4.481  -4.915
  561   1HB   ASP  75           HB2      ASP  75  18.676  -6.690  -6.480
  562   2HB   ASP  75           HB1      ASP  75  19.104  -6.037  -4.903
  563    H    PHE  76           HN       PHE  76  17.145  -2.627  -6.233
  564    HA   PHE  76           HA       PHE  76  18.673  -2.805  -8.802
  565   1HB   PHE  76           HB2      PHE  76  16.877  -0.467  -8.425
  566   2HB   PHE  76           HB1      PHE  76  17.082  -1.490  -9.840
  567    HD1  PHE  76           HD1      PHE  76  15.371  -1.197  -6.571
  568    HD2  PHE  76           HD2      PHE  76  15.633  -3.391 -10.212
  569    HE1  PHE  76           HE1      PHE  76  13.271  -2.346  -6.033
  570    HE2  PHE  76           HE2      PHE  76  13.528  -4.523  -9.678
  571    HZ   PHE  76           HZ       PHE  76  12.344  -4.009  -7.587
  572    H    THR  77           HN       THR  77  19.932  -1.022  -9.418
  573    HA   THR  77           HA       THR  77  20.513   1.014  -7.349
  574    HB   THR  77           HB       THR  77  22.615  -0.913  -8.511
  575    HG1  THR  77           HG1      THR  77  21.002  -0.843  -6.356
  576   1HG2  THR  77          HG21      THR  77  23.353   1.567  -8.018
  577   2HG2  THR  77          HG22      THR  77  22.955   1.217  -6.340
  578   3HG2  THR  77          HG23      THR  77  24.227   0.310  -7.149
  579    H    LEU  78           HN       LEU  78  21.234   2.913  -8.181
  580    HA   LEU  78           HA       LEU  78  21.208   3.150 -11.134
  581   1HB   LEU  78           HB2      LEU  78  19.867   4.682  -9.595
  582   2HB   LEU  78           HB1      LEU  78  21.386   5.320  -8.990
  583    HG   LEU  78           HG       LEU  78  21.194   5.302 -11.943
  584   1HD1  LEU  78          HD11      LEU  78  19.296   6.933 -10.227
  585   2HD1  LEU  78          HD12      LEU  78  19.672   7.328 -11.902
  586   3HD1  LEU  78          HD13      LEU  78  18.866   5.811 -11.513
  587   1HD2  LEU  78          HD22      LEU  78  22.798   6.491 -10.132
  588   2HD2  LEU  78          HD23      LEU  78  22.465   7.219 -11.698
  589   3HD2  LEU  78          HD21      LEU  78  21.580   7.753 -10.274
  590    H    LYS  79           HN       LYS  79  23.131   2.819 -12.060
  591    HA   LYS  79           HA       LYS  79  25.577   3.709 -10.620
  592   1HB   LYS  79           HB2      LYS  79  24.892   1.473 -12.347
  593   2HB   LYS  79           HB1      LYS  79  26.223   2.369 -13.068
  594   1HG   LYS  79           HG1      LYS  79  27.273   0.798 -11.618
  595   2HG   LYS  79           HG2      LYS  79  27.310   2.316 -10.730
  596   1HD   LYS  79           HD1      LYS  79  26.319   1.150  -9.044
  597   2HD   LYS  79           HD2      LYS  79  24.850   1.278 -10.002
  598   1HE   LYS  79           HE1      LYS  79  24.923  -1.019  -9.783
  599   2HE   LYS  79           HE2      LYS  79  25.924  -0.862 -11.221
  600   1HZ   LYS  79           HZ1      LYS  79  26.661  -1.609  -8.525
  601   2HZ   LYS  79           HZ2      LYS  79  27.392  -2.011 -10.006
  602    H    ILE  80           HN       ILE  80  26.738   5.396 -11.307
  603    HA   ILE  80           HA       ILE  80  26.067   6.537 -13.985
  604    HB   ILE  80           HB       ILE  80  27.048   8.054 -11.527
  605   1HG1  ILE  80          HG11      ILE  80  24.237   7.960 -12.674
  606   2HG1  ILE  80          HG12      ILE  80  24.747   7.093 -11.230
  607   1HG2  ILE  80          HG23      ILE  80  26.867   8.711 -14.319
  608   2HG2  ILE  80          HG21      ILE  80  25.588   9.605 -13.508
  609   3HG2  ILE  80          HG22      ILE  80  27.260   9.804 -12.997
  610   1HD1  ILE  80          HD13      ILE  80  25.538   9.376 -10.331
  611   2HD1  ILE  80          HD11      ILE  80  24.619  10.089 -11.651
  612   3HD1  ILE  80          HD12      ILE  80  23.798   9.132 -10.423
  613    H    SER  81           HN       SER  81  27.611   6.816 -15.380
  614    HA   SER  81           HA       SER  81  30.295   6.022 -14.527
  615   1HB   SER  81           HB2      SER  81  29.110   6.603 -17.283
  616   2HB   SER  81           HB1      SER  81  30.777   6.054 -17.023
  617    HG   SER  81           HG       SER  81  29.887   4.286 -15.830
  618    NH1  ARG  82           NH2      ARG  82  32.863  15.516 -15.073
  619    NH2  ARG  82           NH1      ARG  82  34.537  14.495 -16.229
  620    H    ARG  82           HN       ARG  82  28.686   8.848 -14.595
  621    HA   ARG  82           HA       ARG  82  31.084  10.435 -14.336
  622   1HB   ARG  82           HB2      ARG  82  31.203  10.429 -16.734
  623   2HB   ARG  82           HB1      ARG  82  29.459  10.533 -16.908
  624   1HG   ARG  82           HG1      ARG  82  30.513  12.691 -17.458
  625   2HG   ARG  82           HG2      ARG  82  29.515  12.856 -16.024
  626   1HD   ARG  82           HD1      ARG  82  31.303  13.385 -14.732
  627   2HD   ARG  82           HD2      ARG  82  32.250  12.040 -15.371
  628    HE   ARG  82           HE       ARG  82  32.268  13.866 -17.446
  629   1HH1  ARG  82          HH21      ARG  82  31.889  15.583 -14.863
  630   2HH1  ARG  82          HH22      ARG  82  33.515  16.130 -14.629
  631   1HH2  ARG  82          HH11      ARG  82  34.818  13.796 -16.885
  632   2HH2  ARG  82          HH12      ARG  82  35.220  15.093 -15.812
  633    H    VAL  83           HN       VAL  83  30.206  11.199 -12.461
  634    HA   VAL  83           HA       VAL  83  27.478  12.194 -12.320
  635    HB   VAL  83           HB       VAL  83  29.865  12.521 -10.437
  636   1HG1  VAL  83          HG12      VAL  83  26.956  13.316 -10.214
  637   2HG1  VAL  83          HG13      VAL  83  27.901  12.948  -8.776
  638   3HG1  VAL  83          HG11      VAL  83  28.386  14.270  -9.831
  639   1HG2  VAL  83          HG21      VAL  83  27.721  10.471 -10.817
  640   2HG2  VAL  83          HG22      VAL  83  29.386  10.262 -10.285
  641   3HG2  VAL  83          HG23      VAL  83  28.173  10.862  -9.161
  642    H    GLU  84           HN       GLU  84  26.729  14.216 -12.520
  643    HA   GLU  84           HA       GLU  84  28.713  16.322 -13.278
  644   1HB   GLU  84           HB2      GLU  84  26.345  15.350 -14.566
  645   2HB   GLU  84           HB1      GLU  84  25.973  16.975 -14.002
  646   1HG   GLU  84           HG1      GLU  84  27.587  17.962 -15.354
  647   2HG   GLU  84           HG2      GLU  84  28.618  16.535 -15.347
  648    H    ALA  85           HN       ALA  85  28.063  18.559 -12.735
  649    HA   ALA  85           HA       ALA  85  27.477  18.808  -9.943
  650   1HB   ALA  85           HB2      ALA  85  27.588  20.799 -12.244
  651   2HB   ALA  85           HB3      ALA  85  27.279  21.311 -10.588
  652   3HB   ALA  85           HB1      ALA  85  28.803  20.530 -10.998
  653    H    GLU  86           HN       GLU  86  25.413  18.840 -12.745
  654    HA   GLU  86           HA       GLU  86  23.184  20.166 -11.450
  655   1HB   GLU  86           HB2      GLU  86  23.280  18.273 -13.848
  656   2HB   GLU  86           HB1      GLU  86  21.880  19.240 -13.396
  657   1HG   GLU  86           HG1      GLU  86  24.545  20.585 -13.791
  658   2HG   GLU  86           HG2      GLU  86  23.565  20.173 -15.195
  659    H    ASP  87           HN       ASP  87  24.362  16.911 -11.580
  660    HA   ASP  87           HA       ASP  87  21.977  15.551 -10.790
  661   1HB   ASP  87           HB2      ASP  87  24.878  14.978 -10.933
  662   2HB   ASP  87           HB1      ASP  87  24.071  14.103  -9.637
  663    H    LEU  88           HN       LEU  88  24.377  17.317  -8.944
  664    HA   LEU  88           HA       LEU  88  24.026  16.404  -6.361
  665   1HB   LEU  88           HB2      LEU  88  23.948  19.338  -7.195
  666   2HB   LEU  88           HB1      LEU  88  24.383  18.745  -5.601
  667    HG   LEU  88           HG       LEU  88  25.881  18.096  -8.166
  668   1HD1  LEU  88          HD12      LEU  88  26.002  20.494  -7.225
  669   2HD1  LEU  88          HD13      LEU  88  26.819  19.785  -5.835
  670   3HD1  LEU  88          HD11      LEU  88  27.534  19.656  -7.439
  671   1HD2  LEU  88          HD22      LEU  88  25.849  16.890  -5.534
  672   2HD2  LEU  88          HD23      LEU  88  26.784  16.416  -6.947
  673   3HD2  LEU  88          HD21      LEU  88  27.422  17.618  -5.830
  674    H    GLY  89           HN       GLY  89  22.471  16.346  -4.881
  675   1HA   GLY  89           HA1      GLY  89  20.389  17.835  -4.157
  676   2HA   GLY  89           HA2      GLY  89  19.764  17.255  -5.703
  677    H    ILE  90           HN       ILE  90  18.067  16.182  -4.584
  678    HA   ILE  90           HA       ILE  90  18.918  13.839  -2.943
  679    HB   ILE  90           HB       ILE  90  16.071  14.823  -3.376
  680   1HG1  ILE  90          HG11      ILE  90  17.365  16.765  -2.614
  681   2HG1  ILE  90          HG12      ILE  90  16.328  16.186  -1.318
  682   1HG2  ILE  90          HG22      ILE  90  17.542  13.264  -1.195
  683   2HG2  ILE  90          HG23      ILE  90  15.886  13.833  -1.014
  684   3HG2  ILE  90          HG21      ILE  90  16.281  12.654  -2.260
  685   1HD1  ILE  90          HD12      ILE  90  19.264  15.457  -1.618
  686   2HD1  ILE  90          HD13      ILE  90  18.650  16.699  -0.534
  687   3HD1  ILE  90          HD11      ILE  90  18.211  15.014  -0.278
  688    OH   TYR  91           OH       TYR  91  20.807  11.064 -11.072
  689    H    TYR  91           HN       TYR  91  18.700  11.825  -3.712
  690    HA   TYR  91           HA       TYR  91  17.462  11.534  -6.401
  691   1HB   TYR  91           HB2      TYR  91  19.795  10.402  -5.062
  692   2HB   TYR  91           HB1      TYR  91  18.742   9.111  -5.639
  693    HD1  TYR  91           HD2      TYR  91  18.252   8.885  -8.046
  694    HD2  TYR  91           HD1      TYR  91  20.830  11.961  -6.639
  695    HE1  TYR  91           HE2      TYR  91  19.025   9.289 -10.334
  696    HE2  TYR  91           HE1      TYR  91  21.598  12.364  -8.932
  697    HH   TYR  91           HH       TYR  91  21.569  11.649 -11.029
  698    H    PHE  92           HN       PHE  92  16.124   9.750  -6.865
  699    HA   PHE  92           HA       PHE  92  14.947   8.297  -4.566
  700   1HB   PHE  92           HB2      PHE  92  13.239   9.848  -6.571
  701   2HB   PHE  92           HB1      PHE  92  12.672   9.012  -5.134
  702    HD1  PHE  92           HD1      PHE  92  13.067   9.977  -2.890
  703    HD2  PHE  92           HD2      PHE  92  14.366  12.009  -6.401
  704    HE1  PHE  92           HE1      PHE  92  13.340  12.042  -1.596
  705    HE2  PHE  92           HE2      PHE  92  14.644  14.070  -5.099
  706    HZ   PHE  92           HZ       PHE  92  14.123  14.091  -2.698
  707    H    CYS  93           HN       CYS  93  13.110   6.854  -5.468
  708    HA   CYS  93           HA       CYS  93  13.375   5.968  -8.230
  709   1HB   CYS  93           HB2      CYS  93  14.576   4.019  -7.926
  710   2HB   CYS  93           HB1      CYS  93  15.313   4.977  -6.672
  711    H    SER  94           HN       SER  94  11.445   5.198  -8.849
  712    HA   SER  94           HA       SER  94   9.600   4.240  -6.687
  713   1HB   SER  94           HB2      SER  94   7.811   5.426  -7.694
  714   2HB   SER  94           HB1      SER  94   9.162   6.509  -8.077
  715    HG   SER  94           HG       SER  94   9.302   5.643 -10.076
  716    H    GLN  95           HN       GLN  95   7.567   3.240  -8.128
  717    HA   GLN  95           HA       GLN  95   8.556   1.462 -10.227
  718   1HB   GLN  95           HB2      GLN  95   7.770  -0.595  -8.816
  719   2HB   GLN  95           HB1      GLN  95   9.332   0.107  -8.423
  720   1HG   GLN  95           HG1      GLN  95   8.536   0.202  -6.289
  721   2HG   GLN  95           HG2      GLN  95   7.641   1.611  -6.842
  722   1HE2  GLN  95          HE22      GLN  95   4.980  -0.371  -5.435
  723   2HE2  GLN  95          HE21      GLN  95   6.183   0.739  -4.989
  724    H    THR  96           HN       THR  96   6.983   1.109 -11.613
  725    HA   THR  96           HA       THR  96   4.170   1.554 -10.709
  726    HB   THR  96           HB       THR  96   5.165   1.515 -13.611
  727    HG1  THR  96           HG1      THR  96   5.285   3.439 -11.546
  728   1HG2  THR  96          HG23      THR  96   2.879   2.884 -12.082
  729   2HG2  THR  96          HG21      THR  96   3.278   3.252 -13.757
  730   3HG2  THR  96          HG22      THR  96   2.691   1.649 -13.323
  731    H    THR  97           HN       THR  97   4.875  -0.801  -9.939
  732    HA   THR  97           HA       THR  97   4.083  -2.726 -12.085
  733    HB   THR  97           HB       THR  97   5.566  -3.145  -9.422
  734    HG1  THR  97           HG1      THR  97   6.293  -2.303 -11.768
  735   1HG2  THR  97          HG22      THR  97   4.042  -5.093 -10.598
  736   2HG2  THR  97          HG23      THR  97   5.448  -5.178 -11.654
  737   3HG2  THR  97          HG21      THR  97   5.627  -5.457  -9.926
  738    H    HIS  98           HN       HIS  98   3.605  -2.088  -8.613
  739    HA   HIS  98           HA       HIS  98   1.190  -3.783  -8.626
  740   1HB   HIS  98           HB2      HIS  98   2.736  -2.236  -6.518
  741   2HB   HIS  98           HB1      HIS  98   1.149  -2.909  -6.151
  742    HD2  HIS  98           HD2      HIS  98   4.525  -4.345  -7.708
  743    HE1  HIS  98           HE1      HIS  98   2.725  -7.257  -5.387
  744    H    VAL  99           HN       VAL  99   2.020  -0.375  -8.292
  745    HA   VAL  99           HA       VAL  99   0.745   1.544  -8.522
  746    HB   VAL  99           HB       VAL  99  -0.365  -0.441 -10.265
  747   1HG1  VAL  99          HG12      VAL  99  -2.467   1.358  -8.998
  748   2HG1  VAL  99          HG13      VAL  99  -2.714   0.370 -10.434
  749   3HG1  VAL  99          HG11      VAL  99  -2.408  -0.399  -8.881
  750   1HG2  VAL  99          HG21      VAL  99   0.699   1.894 -10.677
  751   2HG2  VAL  99          HG22      VAL  99  -0.610   1.389 -11.739
  752   3HG2  VAL  99          HG23      VAL  99  -0.928   2.520 -10.428
  753    HA   PRO 100           HA       PRO 100  -0.671   3.220  -8.455
  754   1HB   PRO 100           HB2      PRO 100  -0.414   4.965  -6.174
  755   2HB   PRO 100           HB1      PRO 100  -1.741   4.922  -7.334
  756   1HG   PRO 100           HG1      PRO 100  -1.755   4.022  -4.581
  757   2HG   PRO 100           HG2      PRO 100  -3.098   4.030  -5.725
  758   1HD   PRO 100           HD1      PRO 100  -1.578   1.753  -4.786
  759   2HD   PRO 100           HD2      PRO 100  -2.948   1.759  -5.912
  760    HA   PRO 101           HA       PRO 101   3.670   3.203  -7.915
  761   1HB   PRO 101           HB2      PRO 101   4.087   5.954  -8.674
  762   2HB   PRO 101           HB1      PRO 101   4.227   4.532  -9.706
  763   1HG   PRO 101           HG1      PRO 101   2.139   6.546  -9.719
  764   2HG   PRO 101           HG2      PRO 101   2.321   5.164 -10.800
  765   1HD   PRO 101           HD1      PRO 101   0.407   5.493  -8.666
  766   2HD   PRO 101           HD2      PRO 101   0.603   4.097  -9.742
  767    H    THR 102           HN       THR 102   4.494   3.198  -5.921
  768    HA   THR 102           HA       THR 102   3.807   4.872  -3.770
  769    HB   THR 102           HB       THR 102   6.159   4.141  -2.875
  770    HG1  THR 102           HG1      THR 102   7.380   3.086  -4.308
  771   1HG2  THR 102          HG21      THR 102   3.859   2.647  -3.086
  772   2HG2  THR 102          HG22      THR 102   4.903   1.719  -4.156
  773   3HG2  THR 102          HG23      THR 102   5.358   1.959  -2.472
  774    H    PHE 103           HN       PHE 103   6.707   5.105  -5.800
  775    HA   PHE 103           HA       PHE 103   8.074   6.908  -6.351
  776   1HB   PHE 103           HB2      PHE 103   5.338   8.008  -6.084
  777   2HB   PHE 103           HB1      PHE 103   6.578   9.215  -5.768
  778    HD1  PHE 103           HD1      PHE 103   8.695   8.900  -7.534
  779    HD2  PHE 103           HD2      PHE 103   4.614   7.942  -8.297
  780    HE1  PHE 103           HE1      PHE 103   9.090   9.119  -9.946
  781    HE2  PHE 103           HE2      PHE 103   5.016   8.161 -10.710
  782    HZ   PHE 103           HZ       PHE 103   7.254   8.753 -11.537
  783    H    GLY 104           HN       GLY 104   9.755   7.355  -5.103
  784   1HA   GLY 104           HA1      GLY 104  10.353   9.168  -3.324
  785   2HA   GLY 104           HA2      GLY 104   9.238   8.270  -2.305
  786    H    GLY 105           HN       GLY 105  12.409   8.455  -3.549
  787   1HA   GLY 105           HA1      GLY 105  13.140   5.785  -2.450
  788   2HA   GLY 105           HA2      GLY 105  14.153   6.753  -3.522
  789    H    GLY 106           HN       GLY 106  15.334   8.510  -2.649
  790   1HA   GLY 106           HA1      GLY 106  15.638  10.001  -0.638
  791   2HA   GLY 106           HA2      GLY 106  15.403   8.566   0.344
  792    H    THR 107           HN       THR 107  17.613  10.366  -1.611
  793    HA   THR 107           HA       THR 107  19.889   9.045  -0.325
  794    HB   THR 107           HB       THR 107  19.302   8.699  -3.315
  795    HG1  THR 107           HG1      THR 107  20.376   7.001  -1.305
  796   1HG2  THR 107          HG23      THR 107  21.928   8.993  -1.870
  797   2HG2  THR 107          HG21      THR 107  21.787   7.560  -2.880
  798   3HG2  THR 107          HG22      THR 107  21.599   9.159  -3.591
  799    H    LYS 108           HN       LYS 108  20.906  10.835   0.342
  800    HA   LYS 108           HA       LYS 108  20.767  13.320  -1.152
  801   1HB   LYS 108           HB2      LYS 108  21.297  12.672   1.472
  802   2HB   LYS 108           HB1      LYS 108  22.922  12.999   0.886
  803   1HG   LYS 108           HG1      LYS 108  22.485  15.210   1.085
  804   2HG   LYS 108           HG2      LYS 108  21.300  15.045  -0.205
  805   1HD   LYS 108           HD1      LYS 108  20.064  15.946   1.615
  806   2HD   LYS 108           HD2      LYS 108  19.673  14.230   1.631
  807   1HE   LYS 108           HE1      LYS 108  21.361  13.835   3.372
  808   2HE   LYS 108           HE2      LYS 108  21.841  15.527   3.320
  809   1HZ   LYS 108           HZ1      LYS 108  19.321  15.901   3.800
  810   2HZ   LYS 108           HZ2      LYS 108  19.405  14.318   4.415
  811    H    LEU 109           HN       LEU 109  21.751  13.399  -3.057
  812    HA   LEU 109           HA       LEU 109  24.434  12.180  -3.366
  813   1HB   LEU 109           HB2      LEU 109  22.324  12.110  -5.047
  814   2HB   LEU 109           HB1      LEU 109  23.014  13.632  -5.598
  815    HG   LEU 109           HG       LEU 109  25.250  12.003  -5.402
  816   1HD1  LEU 109          HD13      LEU 109  23.780  10.033  -5.010
  817   2HD1  LEU 109          HD11      LEU 109  22.937  10.373  -6.518
  818   3HD1  LEU 109          HD12      LEU 109  24.633   9.900  -6.546
  819   1HD2  LEU 109          HD21      LEU 109  24.595  13.576  -7.243
  820   2HD2  LEU 109          HD22      LEU 109  25.195  12.035  -7.848
  821   3HD2  LEU 109          HD23      LEU 109  23.465  12.363  -7.834
  822    H    GLU 110           HN       GLU 110  25.731  13.584  -2.288
  823    HA   GLU 110           HA       GLU 110  25.949  16.310  -3.495
  824   1HB   GLU 110           HB2      GLU 110  25.698  15.443  -0.683
  825   2HB   GLU 110           HB1      GLU 110  27.101  16.474  -0.940
  826   1HG   GLU 110           HG1      GLU 110  24.402  17.225  -2.079
  827   2HG   GLU 110           HG2      GLU 110  24.825  17.630  -0.418
  828    H    ILE 111           HN       ILE 111  27.952  17.070  -3.919
  829    HA   ILE 111           HA       ILE 111  30.038  15.070  -4.279
  830    HB   ILE 111           HB       ILE 111  29.633  17.988  -4.924
  831   1HG1  ILE 111          HG11      ILE 111  30.801  15.872  -6.717
  832   2HG1  ILE 111          HG12      ILE 111  29.079  15.854  -6.355
  833   1HG2  ILE 111          HG23      ILE 111  32.318  16.519  -4.953
  834   2HG2  ILE 111          HG21      ILE 111  32.026  18.030  -5.807
  835   3HG2  ILE 111          HG22      ILE 111  31.937  17.983  -4.050
  836   1HD1  ILE 111          HD13      ILE 111  28.975  18.270  -7.068
  837   2HD1  ILE 111          HD11      ILE 111  30.650  18.140  -7.586
  838   3HD1  ILE 111          HD12      ILE 111  29.407  17.169  -8.370
  839    H    LYS 112           HN       LYS 112  32.194  15.248  -3.451
  840    HA   LYS 112           HA       LYS 112  32.228  15.807  -0.606
  841   1HB   LYS 112           HB2      LYS 112  34.342  14.982  -2.637
  842   2HB   LYS 112           HB1      LYS 112  34.741  15.250  -0.943
  843   1HG   LYS 112           HG1      LYS 112  32.858  13.612  -0.377
  844   2HG   LYS 112           HG2      LYS 112  32.818  13.208  -2.091
  845   1HD   LYS 112           HD1      LYS 112  35.505  13.043  -1.593
  846   2HD   LYS 112           HD2      LYS 112  34.860  12.544  -0.036
  847   1HE   LYS 112           HE1      LYS 112  33.404  11.295  -2.238
  848   2HE   LYS 112           HE2      LYS 112  35.124  10.940  -2.323
  849   1HZ   LYS 112           HZ1      LYS 112  34.330  10.703   0.346
  850   2HZ   LYS 112           HZ2      LYS 112  33.213   9.841  -0.605
  851    NH1  ARG 113           NH2      ARG 113  30.050  21.252  -4.483
  852    NH2  ARG 113           NH1      ARG 113  29.922  23.461  -3.967
  853    H    ARG 113           HN       ARG 113  32.414  17.756   0.219
  854    HA   ARG 113           HA       ARG 113  34.562  19.548  -0.627
  855   1HB   ARG 113           HB2      ARG 113  32.756  21.458  -0.904
  856   2HB   ARG 113           HB1      ARG 113  33.041  20.374  -2.260
  857   1HG   ARG 113           HG1      ARG 113  31.038  19.220  -1.934
  858   2HG   ARG 113           HG2      ARG 113  30.971  19.610  -0.220
  859   1HD   ARG 113           HD1      ARG 113  29.332  20.840  -1.854
  860   2HD   ARG 113           HD2      ARG 113  30.162  21.790  -0.621
  861    HE   ARG 113           HE       ARG 113  31.824  22.401  -2.440
  862   1HH1  ARG 113          HH21      ARG 113  30.354  20.333  -4.235
  863   2HH1  ARG 113          HH22      ARG 113  29.559  21.404  -5.339
  864   1HH2  ARG 113          HH11      ARG 113  30.127  24.203  -3.331
  865   2HH2  ARG 113          HH12      ARG 113  29.434  23.651  -4.817
   
  Start of MODEL          13
 Raw file had  865 H/Q atoms
  Start of MODEL   13
    1   1H    ASP   1           HT2      ASP   1   0.592  -1.839   0.038
    2   2H    ASP   1           HT3      ASP   1   1.938  -1.110   0.775
    3   3H    ASP   1           HT1      ASP   1   0.373  -0.545   1.118
    4    HA   ASP   1           HA       ASP   1   0.514   0.900  -0.519
    5   1HB   ASP   1           HB2      ASP   1   2.642   0.962  -1.915
    6   2HB   ASP   1           HB1      ASP   1   2.958   0.933  -0.183
    7    H    VAL   2           HN       VAL   2  -0.002   1.229  -2.648
    8    HA   VAL   2           HA       VAL   2  -0.744  -1.299  -3.989
    9    HB   VAL   2           HB       VAL   2  -1.830   1.526  -4.354
   10   1HG1  VAL   2          HG11      VAL   2  -2.416  -1.106  -5.703
   11   2HG1  VAL   2          HG12      VAL   2  -3.687   0.103  -5.548
   12   3HG1  VAL   2          HG13      VAL   2  -2.211   0.485  -6.430
   13   1HG2  VAL   2          HG21      VAL   2  -2.838  -0.920  -2.877
   14   2HG2  VAL   2          HG22      VAL   2  -2.590   0.703  -2.240
   15   3HG2  VAL   2          HG23      VAL   2  -3.915   0.388  -3.355
   16    H    VAL   3           HN       VAL   3   0.664  -1.870  -5.538
   17    HA   VAL   3           HA       VAL   3   2.473  -0.017  -6.788
   18    HB   VAL   3           HB       VAL   3   1.569  -2.819  -7.620
   19   1HG1  VAL   3          HG11      VAL   3   3.760  -0.997  -8.648
   20   2HG1  VAL   3          HG12      VAL   3   3.849  -2.745  -8.838
   21   3HG1  VAL   3          HG13      VAL   3   2.528  -1.847  -9.577
   22   1HG2  VAL   3          HG21      VAL   3   3.997  -1.810  -6.094
   23   2HG2  VAL   3          HG22      VAL   3   2.667  -2.748  -5.421
   24   3HG2  VAL   3          HG23      VAL   3   3.752  -3.479  -6.599
   25    H    MET   4           HN       MET   4   2.116   1.352  -8.386
   26    HA   MET   4           HA       MET   4  -0.247   0.888 -10.159
   27   1HB   MET   4           HB2      MET   4   0.940   3.469  -9.045
   28   2HB   MET   4           HB1      MET   4  -0.254   3.450 -10.338
   29   1HG   MET   4           HG1      MET   4  -0.692   2.057  -7.700
   30   2HG   MET   4           HG2      MET   4  -1.118   3.729  -7.939
   31   1HE   MET   4           HE2      MET   4  -2.731   4.662  -9.262
   32   2HE   MET   4           HE3      MET   4  -2.609   3.869 -10.833
   33   3HE   MET   4           HE1      MET   4  -4.147   3.885  -9.971
   34    H    THR   5           HN       THR   5   0.681   0.068 -11.945
   35    HA   THR   5           HA       THR   5   3.120   1.370 -13.034
   36    HB   THR   5           HB       THR   5   1.620  -1.104 -14.079
   37    HG1  THR   5           HG1      THR   5   3.226  -0.574 -11.909
   38   1HG2  THR   5          HG22      THR   5   4.421   0.089 -14.426
   39   2HG2  THR   5          HG23      THR   5   4.103  -1.613 -14.742
   40   3HG2  THR   5          HG21      THR   5   3.302  -0.376 -15.704
   41    H    GLN   6           HN       GLN   6   3.191   2.022 -15.277
   42    HA   GLN   6           HA       GLN   6   0.496   2.658 -16.404
   43   1HB   GLN   6           HB2      GLN   6   1.280   4.730 -15.452
   44   2HB   GLN   6           HB1      GLN   6   2.914   4.459 -16.037
   45   1HG   GLN   6           HG1      GLN   6   2.355   4.967 -18.257
   46   2HG   GLN   6           HG2      GLN   6   0.640   4.678 -17.996
   47   1HE2  GLN   6          HE22      GLN   6   2.033   8.132 -16.284
   48   2HE2  GLN   6          HE21      GLN   6   2.882   6.688 -16.042
   49    H    THR   7           HN       THR   7   0.354   2.848 -18.621
   50    HA   THR   7           HA       THR   7   2.666   2.356 -20.356
   51    HB   THR   7           HB       THR   7   0.816   0.342 -21.213
   52    HG1  THR   7           HG1      THR   7   1.313   0.325 -18.412
   53   1HG2  THR   7          HG23      THR   7   3.412   0.213 -21.045
   54   2HG2  THR   7          HG21      THR   7   3.195  -0.095 -19.326
   55   3HG2  THR   7          HG22      THR   7   2.569  -1.237 -20.511
   56    HA   PRO   8           HA       PRO   8   2.681   1.470 -22.478
   57   1HB   PRO   8           HB2      PRO   8   3.309   3.043 -24.756
   58   2HB   PRO   8           HB1      PRO   8   2.382   1.543 -24.769
   59   1HG   PRO   8           HG1      PRO   8   1.429   4.272 -25.203
   60   2HG   PRO   8           HG2      PRO   8   0.553   2.756 -25.421
   61   1HD   PRO   8           HD1      PRO   8   0.294   4.660 -23.253
   62   2HD   PRO   8           HD2      PRO   8  -0.601   3.145 -23.486
   63    H    LEU   9           HN       LEU   9   4.998   2.198 -23.116
   64    HA   LEU   9           HA       LEU   9   5.827   4.201 -21.176
   65   1HB   LEU   9           HB2      LEU   9   7.140   2.286 -23.073
   66   2HB   LEU   9           HB1      LEU   9   8.084   3.709 -22.651
   67    HG   LEU   9           HG       LEU   9   7.504   3.172 -20.199
   68   1HD1  LEU   9          HD12      LEU   9   6.765   0.539 -21.529
   69   2HD1  LEU   9          HD13      LEU   9   6.951   0.772 -19.793
   70   3HD1  LEU   9          HD11      LEU   9   5.663   1.604 -20.659
   71   1HD2  LEU   9          HD23      LEU   9   9.208   1.276 -21.851
   72   2HD2  LEU   9          HD21      LEU   9   9.739   2.778 -21.101
   73   3HD2  LEU   9          HD22      LEU   9   9.286   1.404 -20.097
   74    H    SER  10           HN       SER  10   4.960   4.212 -24.470
   75    HA   SER  10           HA       SER  10   5.443   7.103 -24.651
   76   1HB   SER  10           HB2      SER  10   6.694   6.740 -26.904
   77   2HB   SER  10           HB1      SER  10   7.621   6.288 -25.461
   78    HG   SER  10           HG       SER  10   5.881   4.459 -26.729
   79    H    LEU  11           HN       LEU  11   4.032   8.083 -26.051
   80    HA   LEU  11           HA       LEU  11   2.363   6.283 -27.764
   81   1HB   LEU  11           HB2      LEU  11   1.317   7.082 -25.508
   82   2HB   LEU  11           HB1      LEU  11   1.245   8.672 -26.252
   83    HG   LEU  11           HG       LEU  11   0.051   7.477 -28.229
   84   1HD1  LEU  11          HD13      LEU  11   0.617   5.172 -27.441
   85   2HD1  LEU  11          HD11      LEU  11  -0.381   5.438 -26.015
   86   3HD1  LEU  11          HD12      LEU  11  -1.119   5.405 -27.613
   87   1HD2  LEU  11          HD23      LEU  11  -1.056   9.006 -26.594
   88   2HD2  LEU  11          HD21      LEU  11  -2.121   7.698 -27.096
   89   3HD2  LEU  11          HD22      LEU  11  -1.330   7.634 -25.524
   90    HA   PRO  12           HA       PRO  12   3.859   9.689 -30.389
   91   1HB   PRO  12           HB2      PRO  12   3.690   7.949 -32.658
   92   2HB   PRO  12           HB1      PRO  12   5.158   8.423 -31.803
   93   1HG   PRO  12           HG1      PRO  12   3.823   5.838 -31.787
   94   2HG   PRO  12           HG2      PRO  12   5.356   6.276 -31.033
   95   1HD   PRO  12           HD1      PRO  12   2.813   5.823 -29.738
   96   2HD   PRO  12           HD2      PRO  12   4.355   6.262 -28.979
   97    H    VAL  13           HN       VAL  13   2.091  10.978 -30.557
   98    HA   VAL  13           HA       VAL  13  -0.179   9.995 -32.250
   99    HB   VAL  13           HB       VAL  13  -1.649  11.453 -30.939
  100   1HG1  VAL  13          HG12      VAL  13  -0.801   9.213 -29.954
  101   2HG1  VAL  13          HG13      VAL  13   0.191  10.205 -28.891
  102   3HG1  VAL  13          HG11      VAL  13  -1.563  10.345 -28.842
  103   1HG2  VAL  13          HG23      VAL  13   0.959  12.634 -30.118
  104   2HG2  VAL  13          HG21      VAL  13  -0.595  13.420 -30.375
  105   3HG2  VAL  13          HG22      VAL  13  -0.279  12.562 -28.870
  106    H    SER  14           HN       SER  14  -1.388  12.609 -32.365
  107    HA   SER  14           HA       SER  14   0.600  14.114 -34.011
  108   1HB   SER  14           HB2      SER  14  -1.648  12.648 -34.996
  109   2HB   SER  14           HB1      SER  14  -2.096  14.362 -35.098
  110    HG   SER  14           HG       SER  14  -0.510  13.133 -36.717
  111    H    LEU  15           HN       LEU  15   0.016  16.375 -34.344
  112    HA   LEU  15           HA       LEU  15  -1.037  17.547 -31.901
  113   1HB   LEU  15           HB2      LEU  15   0.045  18.636 -34.509
  114   2HB   LEU  15           HB1      LEU  15  -0.734  19.703 -33.348
  115    HG   LEU  15           HG       LEU  15   1.433  17.810 -32.454
  116   1HD1  LEU  15          HD11      LEU  15   1.779  19.938 -34.327
  117   2HD1  LEU  15          HD12      LEU  15   2.455  20.464 -32.787
  118   3HD1  LEU  15          HD13      LEU  15   3.023  18.974 -33.538
  119   1HD2  LEU  15          HD23      LEU  15   0.444  20.511 -31.471
  120   2HD2  LEU  15          HD21      LEU  15   0.042  18.954 -30.755
  121   3HD2  LEU  15          HD22      LEU  15   1.699  19.543 -30.704
  122    H    GLY  16           HN       GLY  16  -3.146  16.867 -31.820
  123   1HA   GLY  16           HA1      GLY  16  -5.306  18.240 -32.159
  124   2HA   GLY  16           HA2      GLY  16  -4.987  18.024 -33.879
  125    H    ASP  17           HN       ASP  17  -3.897  15.303 -32.475
  126    HA   ASP  17           HA       ASP  17  -6.386  13.839 -33.155
  127   1HB   ASP  17           HB2      ASP  17  -3.467  13.270 -33.109
  128   2HB   ASP  17           HB1      ASP  17  -4.464  11.935 -32.537
  129    H    GLN  18           HN       GLN  18  -6.457  11.675 -31.735
  130    HA   GLN  18           HA       GLN  18  -6.845  12.657 -28.959
  131   1HB   GLN  18           HB2      GLN  18  -7.746  10.092 -30.358
  132   2HB   GLN  18           HB1      GLN  18  -8.196  10.549 -28.719
  133   1HG   GLN  18           HG1      GLN  18  -9.948  11.683 -29.600
  134   2HG   GLN  18           HG2      GLN  18  -8.792  12.808 -30.304
  135   1HE2  GLN  18          HE22      GLN  18 -10.097   9.722 -32.694
  136   2HE2  GLN  18          HE21      GLN  18  -9.921   9.455 -31.028
  137    H    ALA  19           HN       ALA  19  -6.599  10.720 -27.318
  138    HA   ALA  19           HA       ALA  19  -4.234   9.045 -27.832
  139   1HB   ALA  19           HB3      ALA  19  -4.106  11.613 -26.407
  140   2HB   ALA  19           HB1      ALA  19  -3.584  10.284 -25.376
  141   3HB   ALA  19           HB2      ALA  19  -2.784  10.570 -26.918
  142    H    SER  20           HN       SER  20  -3.767   7.619 -25.941
  143    HA   SER  20           HA       SER  20  -5.887   7.420 -23.907
  144   1HB   SER  20           HB2      SER  20  -5.579   5.443 -26.203
  145   2HB   SER  20           HB1      SER  20  -6.269   4.931 -24.649
  146    HG   SER  20           HG       SER  20  -7.093   7.241 -26.087
  147    H    ILE  21           HN       ILE  21  -4.325   7.552 -22.348
  148    HA   ILE  21           HA       ILE  21  -2.030   5.704 -22.390
  149    HB   ILE  21           HB       ILE  21  -2.964   7.490 -20.094
  150   1HG1  ILE  21          HG11      ILE  21  -1.060   8.293 -22.317
  151   2HG1  ILE  21          HG12      ILE  21  -2.762   8.740 -22.304
  152   1HG2  ILE  21          HG21      ILE  21  -0.453   6.021 -20.895
  153   2HG2  ILE  21          HG22      ILE  21  -0.259   7.546 -20.040
  154   3HG2  ILE  21          HG23      ILE  21  -1.151   6.225 -19.293
  155   1HD1  ILE  21          HD13      ILE  21  -2.201   9.572 -19.847
  156   2HD1  ILE  21          HD11      ILE  21  -0.558   9.637 -20.475
  157   3HD1  ILE  21          HD12      ILE  21  -1.827  10.589 -21.235
  158    H    SER  22           HN       SER  22  -1.630   4.356 -20.402
  159    HA   SER  22           HA       SER  22  -4.196   3.300 -19.290
  160   1HB   SER  22           HB2      SER  22  -1.818   1.566 -20.156
  161   2HB   SER  22           HB1      SER  22  -3.433   1.007 -19.677
  162    HG   SER  22           HG       SER  22  -3.005   2.857 -21.780
  163    H    CYS  23           HN       CYS  23  -4.046   2.246 -17.277
  164    HA   CYS  23           HA       CYS  23  -1.519   2.195 -15.798
  165   1HB   CYS  23           HB2      CYS  23  -3.582   4.336 -15.447
  166   2HB   CYS  23           HB1      CYS  23  -2.935   3.653 -13.980
  167    NH1  ARG  24           NH1      ARG  24  -3.644  -3.099 -19.039
  168    NH2  ARG  24           NH2      ARG  24  -5.643  -3.730 -18.157
  169    H    ARG  24           HN       ARG  24  -1.613   0.483 -14.471
  170    HA   ARG  24           HA       ARG  24  -4.327  -0.432 -13.590
  171   1HB   ARG  24           HB2      ARG  24  -1.839  -1.996 -14.394
  172   2HB   ARG  24           HB1      ARG  24  -3.180  -2.746 -13.538
  173   1HG   ARG  24           HG1      ARG  24  -4.512  -1.453 -15.558
  174   2HG   ARG  24           HG2      ARG  24  -3.000  -1.861 -16.362
  175   1HD   ARG  24           HD1      ARG  24  -3.656  -4.178 -14.922
  176   2HD   ARG  24           HD2      ARG  24  -5.195  -3.618 -15.566
  177    HE   ARG  24           HE       ARG  24  -3.034  -4.754 -17.120
  178   1HH1  ARG  24          HH11      ARG  24  -2.652  -3.041 -18.948
  179   2HH1  ARG  24          HH12      ARG  24  -4.094  -2.742 -19.856
  180   1HH2  ARG  24          HH21      ARG  24  -6.153  -4.145 -17.405
  181   2HH2  ARG  24          HH22      ARG  24  -6.128  -3.378 -18.955
  182    H    SER  25           HN       SER  25  -4.586  -1.172 -11.520
  183    HA   SER  25           HA       SER  25  -2.331  -0.542  -9.661
  184   1HB   SER  25           HB2      SER  25  -4.085  -0.183  -7.944
  185   2HB   SER  25           HB1      SER  25  -4.569   0.714  -9.394
  186    HG   SER  25           HG       SER  25  -5.388  -1.733  -9.771
  187    H    SER  26           HN       SER  26  -1.371  -2.200  -8.682
  188    HA   SER  26           HA       SER  26  -2.305  -4.915  -9.099
  189   1HB   SER  26           HB2      SER  26   0.150  -4.091  -8.831
  190   2HB   SER  26           HB1      SER  26  -0.176  -4.074  -7.086
  191    HG   SER  26           HG       SER  26  -0.868  -6.235  -7.262
  192    H    GLN  27           HN       GLN  27  -4.165  -3.239  -7.567
  193    HA   GLN  27           HA       GLN  27  -4.680  -5.162  -5.442
  194   1HB   GLN  27           HB2      GLN  27  -3.072  -3.654  -4.322
  195   2HB   GLN  27           HB1      GLN  27  -4.011  -2.249  -4.811
  196   1HG   GLN  27           HG1      GLN  27  -5.171  -2.466  -2.879
  197   2HG   GLN  27           HG2      GLN  27  -5.862  -3.940  -3.547
  198   1HE2  GLN  27          HE22      GLN  27  -2.847  -4.196  -0.789
  199   2HE2  GLN  27          HE21      GLN  27  -3.157  -2.719  -1.565
  200    H    SER  28           HN       SER  28  -5.661  -1.787  -5.392
  201    HA   SER  28           HA       SER  28  -7.999  -1.873  -6.931
  202   1HB   SER  28           HB2      SER  28  -9.006  -3.621  -5.641
  203   2HB   SER  28           HB1      SER  28  -8.312  -3.020  -4.125
  204    HG   SER  28           HG       SER  28 -10.661  -2.430  -5.126
  205    H    LEU  29           HN       LEU  29  -9.183   0.009  -6.791
  206    HA   LEU  29           HA       LEU  29  -8.102   2.000  -4.850
  207   1HB   LEU  29           HB2      LEU  29  -9.440   2.422  -7.558
  208   2HB   LEU  29           HB1      LEU  29  -8.828   3.707  -6.523
  209    HG   LEU  29           HG       LEU  29  -7.211   1.489  -7.804
  210   1HD1  LEU  29          HD12      LEU  29  -7.991   3.750  -8.997
  211   2HD1  LEU  29          HD13      LEU  29  -6.652   4.424  -8.075
  212   3HD1  LEU  29          HD11      LEU  29  -6.361   3.128  -9.229
  213   1HD2  LEU  29          HD21      LEU  29  -6.512   3.534  -5.699
  214   2HD2  LEU  29          HD22      LEU  29  -6.205   1.800  -5.681
  215   3HD2  LEU  29          HD23      LEU  29  -5.282   2.844  -6.753
  216    H    VAL  30           HN       VAL  30 -10.259   0.089  -4.363
  217    HA   VAL  30           HA       VAL  30 -12.585   1.944  -4.090
  218    HB   VAL  30           HB       VAL  30 -12.430  -1.097  -3.813
  219   1HG1  VAL  30          HG12      VAL  30 -14.686   0.913  -3.691
  220   2HG1  VAL  30          HG13      VAL  30 -14.994  -0.758  -4.156
  221   3HG1  VAL  30          HG11      VAL  30 -14.322  -0.396  -2.569
  222   1HG2  VAL  30          HG22      VAL  30 -12.317   0.452  -6.154
  223   2HG2  VAL  30          HG23      VAL  30 -12.715  -1.260  -6.056
  224   3HG2  VAL  30          HG21      VAL  30 -13.999  -0.057  -6.044
  225    H    HIS  31           HN       HIS  31 -13.576   2.214  -2.093
  226    HA   HIS  31           HA       HIS  31 -11.861   1.457   0.231
  227   1HB   HIS  31           HB2      HIS  31 -12.785   3.923  -0.493
  228   2HB   HIS  31           HB1      HIS  31 -14.118   3.408   0.536
  229    HD2  HIS  31           HD2      HIS  31 -10.560   4.783   0.828
  230    HE1  HIS  31           HE1      HIS  31 -11.604   3.417   4.590
  231    H    SER  32           HN       SER  32 -13.069   1.045   2.299
  232    HA   SER  32           HA       SER  32 -14.691  -1.220   2.143
  233   1HB   SER  32           HB2      SER  32 -13.724   0.410   4.218
  234   2HB   SER  32           HB1      SER  32 -15.486   0.520   4.400
  235    HG   SER  32           HG       SER  32 -13.925  -1.843   4.128
  236    H    ASN  33           HN       ASN  33 -15.633   2.123   1.894
  237    HA   ASN  33           HA       ASN  33 -18.292   1.276   0.916
  238   1HB   ASN  33           HB2      ASN  33 -19.444   2.870   2.463
  239   2HB   ASN  33           HB1      ASN  33 -18.563   1.656   3.386
  240   1HD2  ASN  33          HD22      ASN  33 -17.385   5.559   3.515
  241   2HD2  ASN  33          HD21      ASN  33 -18.579   5.057   2.418
  242    H    GLY  34           HN       GLY  34 -15.886   2.487  -0.221
  243   1HA   GLY  34           HA1      GLY  34 -16.833   5.235  -0.884
  244   2HA   GLY  34           HA2      GLY  34 -15.211   4.623  -1.185
  245    H    ASN  35           HN       ASN  35 -14.838   4.433  -3.276
  246    HA   ASN  35           HA       ASN  35 -16.678   2.921  -4.990
  247   1HB   ASN  35           HB2      ASN  35 -16.290   5.916  -5.156
  248   2HB   ASN  35           HB1      ASN  35 -16.497   5.021  -6.663
  249   1HD2  ASN  35          HD22      ASN  35 -19.744   5.919  -4.583
  250   2HD2  ASN  35          HD21      ASN  35 -18.248   6.705  -4.430
  251    H    THR  36           HN       THR  36 -14.660   5.309  -6.437
  252    HA   THR  36           HA       THR  36 -12.355   3.478  -6.668
  253    HB   THR  36           HB       THR  36 -14.013   4.432  -9.083
  254    HG1  THR  36           HG1      THR  36 -13.829   2.222  -7.527
  255   1HG2  THR  36          HG23      THR  36 -11.426   4.403  -9.418
  256   2HG2  THR  36          HG21      THR  36 -11.492   2.688  -9.025
  257   3HG2  THR  36          HG22      THR  36 -12.319   3.296 -10.455
  258    OH   TYR  37           OH       TYR  37 -14.408   8.549  -1.721
  259    H    TYR  37           HN       TYR  37 -11.089   5.007  -5.678
  260    HA   TYR  37           HA       TYR  37 -11.073   7.769  -6.685
  261   1HB   TYR  37           HB2      TYR  37  -9.459   6.285  -4.569
  262   2HB   TYR  37           HB1      TYR  37  -9.205   7.985  -4.940
  263    HD1  TYR  37           HD2      TYR  37 -10.948   9.644  -4.423
  264    HD2  TYR  37           HD1      TYR  37 -11.503   5.540  -3.462
  265    HE1  TYR  37           HE2      TYR  37 -12.901  10.230  -3.060
  266    HE2  TYR  37           HE1      TYR  37 -13.485   6.123  -2.131
  267    HH   TYR  37           HH       TYR  37 -14.120   8.598  -0.806
  268    H    LEU  38           HN       LEU  38  -9.445   8.739  -7.831
  269    HA   LEU  38           HA       LEU  38  -6.970   7.363  -8.488
  270   1HB   LEU  38           HB2      LEU  38  -8.585   6.156  -9.958
  271   2HB   LEU  38           HB1      LEU  38  -9.142   7.689 -10.613
  272    HG   LEU  38           HG       LEU  38  -6.577   8.031 -11.187
  273   1HD1  LEU  38          HD12      LEU  38  -6.058   5.834  -9.934
  274   2HD1  LEU  38          HD13      LEU  38  -6.781   5.014 -11.312
  275   3HD1  LEU  38          HD11      LEU  38  -5.350   6.014 -11.535
  276   1HD2  LEU  38          HD22      LEU  38  -8.713   6.458 -12.584
  277   2HD2  LEU  38          HD23      LEU  38  -7.998   8.003 -13.029
  278   3HD2  LEU  38          HD21      LEU  38  -7.108   6.509 -13.304
  279    H    ASN  39           HN       ASN  39  -5.477   8.723  -9.464
  280    HA   ASN  39           HA       ASN  39  -6.436  11.445 -10.201
  281   1HB   ASN  39           HB2      ASN  39  -4.509  10.636  -8.049
  282   2HB   ASN  39           HB1      ASN  39  -4.065  12.051  -8.997
  283   1HD2  ASN  39          HD22      ASN  39  -6.187  14.065  -7.073
  284   2HD2  ASN  39          HD21      ASN  39  -4.707  13.881  -7.886
  285    CH2  TRP  40           CH2      TRP  40  -3.202   7.420 -16.845
  286    H    TRP  40           HN       TRP  40  -4.979  12.648 -11.540
  287    HA   TRP  40           HA       TRP  40  -2.841  11.041 -12.861
  288   1HB   TRP  40           HB2      TRP  40  -5.239  12.415 -14.115
  289   2HB   TRP  40           HB1      TRP  40  -3.778  12.162 -15.055
  290    HD1  TRP  40           HD1      TRP  40  -6.573  10.189 -13.251
  291    HE1  TRP  40           HE1      TRP  40  -6.532   7.880 -14.269
  292    HE3  TRP  40           HE3      TRP  40  -2.458  10.601 -16.008
  293    HZ2  TRP  40           HZ2      TRP  40  -4.879   6.317 -16.119
  294    HZ3  TRP  40           HZ3      TRP  40  -1.621   8.748 -17.396
  295    HH2  TRP  40           HH2      TRP  40  -2.842   6.611 -17.465
  296    OH   TYR  41           OH       TYR  41  -2.597  13.394  -7.589
  297    H    TYR  41           HN       TYR  41  -1.226  12.281 -13.899
  298    HA   TYR  41           HA       TYR  41  -1.307  15.228 -13.507
  299   1HB   TYR  41           HB2      TYR  41   1.017  13.482 -12.552
  300   2HB   TYR  41           HB1      TYR  41   0.849  15.220 -12.325
  301    HD1  TYR  41           HD2      TYR  41  -0.587  11.928 -11.369
  302    HD2  TYR  41           HD1      TYR  41  -0.471  16.095 -10.526
  303    HE1  TYR  41           HE2      TYR  41  -1.849  11.548  -9.302
  304    HE2  TYR  41           HE1      TYR  41  -1.744  15.715  -8.468
  305    HH   TYR  41           HH       TYR  41  -2.004  13.525  -6.845
  306    H    LEU  42           HN       LEU  42   0.246  16.364 -14.773
  307    HA   LEU  42           HA       LEU  42   1.555  14.711 -16.895
  308   1HB   LEU  42           HB2      LEU  42  -0.351  15.711 -17.973
  309   2HB   LEU  42           HB1      LEU  42  -0.133  17.235 -17.132
  310    HG   LEU  42           HG       LEU  42   1.879  17.724 -18.419
  311   1HD1  LEU  42          HD11      LEU  42   1.586  14.836 -19.173
  312   2HD1  LEU  42          HD12      LEU  42   2.285  15.930 -20.362
  313   3HD1  LEU  42          HD13      LEU  42   3.044  15.742 -18.785
  314   1HD2  LEU  42          HD22      LEU  42  -0.317  18.213 -19.486
  315   2HD2  LEU  42          HD23      LEU  42   0.913  17.825 -20.684
  316   3HD2  LEU  42          HD21      LEU  42  -0.293  16.622 -20.238
  317    H    GLN  43           HN       GLN  43   3.642  14.876 -16.405
  318    HA   GLN  43           HA       GLN  43   4.839  17.172 -15.140
  319   1HB   GLN  43           HB2      GLN  43   5.725  14.560 -16.273
  320   2HB   GLN  43           HB1      GLN  43   6.954  15.817 -16.258
  321   1HG   GLN  43           HG1      GLN  43   7.079  14.600 -14.153
  322   2HG   GLN  43           HG2      GLN  43   6.442  16.207 -13.823
  323   1HE2  GLN  43          HE22      GLN  43   4.013  14.328 -11.993
  324   2HE2  GLN  43          HE21      GLN  43   5.472  15.181 -11.847
  325    H    LYS  44           HN       LYS  44   4.846  19.071 -16.181
  326    HA   LYS  44           HA       LYS  44   5.857  19.118 -18.994
  327   1HB   LYS  44           HB2      LYS  44   3.470  20.089 -18.095
  328   2HB   LYS  44           HB1      LYS  44   4.476  21.493 -17.766
  329   1HG   LYS  44           HG1      LYS  44   3.612  21.770 -19.996
  330   2HG   LYS  44           HG2      LYS  44   5.305  21.332 -20.168
  331   1HD   LYS  44           HD1      LYS  44   4.196  18.852 -20.152
  332   2HD   LYS  44           HD2      LYS  44   2.865  19.768 -20.847
  333   1HE   LYS  44           HE1      LYS  44   5.464  20.515 -21.990
  334   2HE   LYS  44           HE2      LYS  44   5.074  18.819 -22.243
  335   1HZ   LYS  44           HZ1      LYS  44   2.968  19.451 -23.188
  336   2HZ   LYS  44           HZ2      LYS  44   3.286  21.095 -22.895
  337    H    ALA  45           HN       ALA  45   6.462  21.852 -19.088
  338    HA   ALA  45           HA       ALA  45   9.025  21.828 -17.682
  339   1HB   ALA  45           HB3      ALA  45   7.672  23.969 -19.403
  340   2HB   ALA  45           HB1      ALA  45   9.358  24.006 -18.891
  341   3HB   ALA  45           HB2      ALA  45   8.798  22.752 -19.993
  342    H    GLY  46           HN       GLY  46   8.179  24.997 -17.762
  343   1HA   GLY  46           HA1      GLY  46   7.861  25.080 -14.839
  344   2HA   GLY  46           HA2      GLY  46   8.040  26.477 -15.899
  345    H    GLN  47           HN       GLN  47   5.723  23.783 -15.821
  346    HA   GLN  47           HA       GLN  47   3.520  25.710 -16.215
  347   1HB   GLN  47           HB2      GLN  47   3.813  23.372 -17.375
  348   2HB   GLN  47           HB1      GLN  47   3.217  22.709 -15.864
  349   1HG   GLN  47           HG1      GLN  47   1.083  23.431 -16.253
  350   2HG   GLN  47           HG2      GLN  47   1.624  24.979 -16.896
  351   1HE2  GLN  47          HE22      GLN  47   1.453  23.940 -20.257
  352   2HE2  GLN  47          HE21      GLN  47   1.833  25.187 -19.171
  353    H    SER  48           HN       SER  48   1.762  25.887 -14.866
  354    HA   SER  48           HA       SER  48   2.371  25.332 -12.027
  355   1HB   SER  48           HB2      SER  48   0.835  27.352 -13.501
  356   2HB   SER  48           HB1      SER  48  -0.127  26.662 -12.177
  357    HG   SER  48           HG       SER  48   1.547  27.079 -10.768
  358    HA   PRO  49           HA       PRO  49  -1.978  23.275 -12.424
  359   1HB   PRO  49           HB2      PRO  49  -2.406  22.644 -15.228
  360   2HB   PRO  49           HB1      PRO  49  -3.394  23.673 -14.192
  361   1HG   PRO  49           HG1      PRO  49  -1.619  24.492 -16.314
  362   2HG   PRO  49           HG2      PRO  49  -2.608  25.522 -15.278
  363   1HD   PRO  49           HD1      PRO  49   0.253  25.183 -15.215
  364   2HD   PRO  49           HD2      PRO  49  -0.740  26.211 -14.170
  365    H    LYS  50           HN       LYS  50  -2.159  21.056 -12.242
  366    HA   LYS  50           HA       LYS  50  -0.672  19.233 -13.946
  367   1HB   LYS  50           HB2      LYS  50   1.031  20.281 -12.272
  368   2HB   LYS  50           HB1      LYS  50   0.185  19.371 -11.026
  369   1HG   LYS  50           HG1      LYS  50   1.577  17.658 -11.579
  370   2HG   LYS  50           HG2      LYS  50   0.544  17.464 -12.991
  371   1HD   LYS  50           HD1      LYS  50   2.796  17.636 -13.818
  372   2HD   LYS  50           HD2      LYS  50   2.020  19.173 -14.172
  373   1HE   LYS  50           HE1      LYS  50   3.397  20.316 -12.769
  374   2HE   LYS  50           HE2      LYS  50   3.273  19.093 -11.509
  375   1HZ   LYS  50           HZ1      LYS  50   4.768  17.712 -13.009
  376   2HZ   LYS  50           HZ2      LYS  50   5.098  19.165 -13.826
  377    H    LEU  51           HN       LEU  51  -3.247  19.076 -13.637
  378    HA   LEU  51           HA       LEU  51  -3.637  16.533 -12.299
  379   1HB   LEU  51           HB2      LEU  51  -3.787  18.160 -10.380
  380   2HB   LEU  51           HB1      LEU  51  -5.091  18.991 -11.216
  381    HG   LEU  51           HG       LEU  51  -6.507  16.992 -11.099
  382   1HD1  LEU  51          HD12      LEU  51  -3.932  15.741 -10.156
  383   2HD1  LEU  51          HD13      LEU  51  -5.464  15.073  -9.603
  384   3HD1  LEU  51          HD11      LEU  51  -5.099  15.129 -11.323
  385   1HD2  LEU  51          HD21      LEU  51  -5.130  17.599  -8.456
  386   2HD2  LEU  51          HD22      LEU  51  -6.511  18.461  -9.127
  387   3HD2  LEU  51          HD23      LEU  51  -6.682  16.785  -8.617
  388    H    LEU  52           HN       LEU  52  -4.466  15.775 -14.202
  389    HA   LEU  52           HA       LEU  52  -6.621  17.227 -15.569
  390   1HB   LEU  52           HB2      LEU  52  -5.448  14.435 -16.013
  391   2HB   LEU  52           HB1      LEU  52  -6.593  15.218 -17.092
  392    HG   LEU  52           HG       LEU  52  -4.536  15.708 -18.111
  393   1HD1  LEU  52          HD12      LEU  52  -5.912  17.785 -17.507
  394   2HD1  LEU  52          HD13      LEU  52  -4.759  18.051 -16.202
  395   3HD1  LEU  52          HD11      LEU  52  -4.213  18.068 -17.876
  396   1HD2  LEU  52          HD22      LEU  52  -3.352  14.881 -15.871
  397   2HD2  LEU  52          HD23      LEU  52  -2.487  15.888 -17.028
  398   3HD2  LEU  52          HD21      LEU  52  -3.192  16.611 -15.586
  399    H    ILE  53           HN       ILE  53  -6.443  13.867 -14.447
  400    HA   ILE  53           HA       ILE  53  -9.314  14.124 -13.643
  401    HB   ILE  53           HB       ILE  53  -7.689  11.594 -14.116
  402   1HG1  ILE  53          HG11      ILE  53  -7.812  13.049 -16.161
  403   2HG1  ILE  53          HG12      ILE  53  -8.562  11.469 -16.348
  404   1HG2  ILE  53          HG22      ILE  53 -10.607  12.256 -13.685
  405   2HG2  ILE  53          HG23      ILE  53 -10.182  10.816 -14.606
  406   3HG2  ILE  53          HG21      ILE  53  -9.648  10.984 -12.933
  407   1HD1  ILE  53          HD13      ILE  53 -10.266  13.703 -15.342
  408   2HD1  ILE  53          HD11      ILE  53  -9.845  13.707 -17.050
  409   3HD1  ILE  53          HD12      ILE  53 -10.705  12.337 -16.355
  410    OH   TYR  54           OH       TYR  54 -12.892  17.386  -7.231
  411    H    TYR  54           HN       TYR  54  -9.733  14.032 -11.522
  412    HA   TYR  54           HA       TYR  54  -7.753  12.713  -9.725
  413   1HB   TYR  54           HB2      TYR  54  -7.543  14.607  -8.348
  414   2HB   TYR  54           HB1      TYR  54  -7.753  15.388  -9.909
  415    HD1  TYR  54           HD2      TYR  54 -10.431  15.556 -10.555
  416    HD2  TYR  54           HD1      TYR  54  -8.811  15.527  -6.627
  417    HE1  TYR  54           HE2      TYR  54 -12.432  16.700  -9.721
  418    HE2  TYR  54           HE1      TYR  54 -10.816  16.664  -5.791
  419    HH   TYR  54           HH       TYR  54 -13.212  16.894  -6.471
  420    H    LYS  55           HN       LYS  55 -10.405  12.007 -10.798
  421    HA   LYS  55           HA       LYS  55 -11.509  10.865  -8.399
  422   1HB   LYS  55           HB2      LYS  55 -12.368  13.536  -9.142
  423   2HB   LYS  55           HB1      LYS  55 -13.724  12.434  -9.371
  424   1HG   LYS  55           HG1      LYS  55 -13.463  11.598  -7.071
  425   2HG   LYS  55           HG2      LYS  55 -12.062  12.637  -6.835
  426   1HD   LYS  55           HD1      LYS  55 -13.919  14.455  -7.715
  427   2HD   LYS  55           HD2      LYS  55 -14.946  13.326  -6.840
  428   1HE   LYS  55           HE1      LYS  55 -13.658  13.595  -4.819
  429   2HE   LYS  55           HE2      LYS  55 -12.403  14.491  -5.668
  430   1HZ   LYS  55           HZ1      LYS  55 -15.069  15.594  -5.896
  431   2HZ   LYS  55           HZ2      LYS  55 -14.412  15.628  -4.329
  432    H    VAL  56           HN       VAL  56 -10.688  10.264 -11.152
  433    HA   VAL  56           HA       VAL  56 -11.279   8.819 -12.867
  434    HB   VAL  56           HB       VAL  56 -13.618   8.233 -10.993
  435   1HG1  VAL  56          HG11      VAL  56 -12.742   7.059 -13.626
  436   2HG1  VAL  56          HG12      VAL  56 -13.475   6.010 -12.416
  437   3HG1  VAL  56          HG13      VAL  56 -14.372   7.387 -13.046
  438   1HG2  VAL  56          HG21      VAL  56 -10.968   6.829 -11.496
  439   2HG2  VAL  56          HG22      VAL  56 -11.413   7.704 -10.033
  440   3HG2  VAL  56          HG23      VAL  56 -12.250   6.215 -10.458
  441    H    SER  57           HN       SER  57 -11.894   9.496 -14.724
  442    HA   SER  57           HA       SER  57 -12.963  10.840 -16.326
  443   1HB   SER  57           HB2      SER  57 -15.267   9.861 -16.772
  444   2HB   SER  57           HB1      SER  57 -14.056   8.602 -16.462
  445    HG   SER  57           HG       SER  57 -15.752   8.195 -15.092
  446    H    ASN  58           HN       ASN  58 -12.949  12.190 -13.758
  447    HA   ASN  58           HA       ASN  58 -15.585  13.601 -13.858
  448   1HB   ASN  58           HB2      ASN  58 -15.071  14.349 -11.589
  449   2HB   ASN  58           HB1      ASN  58 -14.717  12.623 -11.653
  450   1HD2  ASN  58          HD22      ASN  58 -11.170  13.102 -11.510
  451   2HD2  ASN  58          HD21      ASN  58 -12.370  12.049 -12.080
  452    NH1  ARG  59           NH2      ARG  59 -14.740  13.312 -17.962
  453    NH2  ARG  59           NH1      ARG  59 -15.757  14.542 -16.341
  454    H    ARG  59           HN       ARG  59 -12.125  14.052 -14.072
  455    HA   ARG  59           HA       ARG  59 -10.840  15.780 -14.936
  456   1HB   ARG  59           HB2      ARG  59 -13.549  16.865 -15.840
  457   2HB   ARG  59           HB1      ARG  59 -11.987  17.435 -16.407
  458   1HG   ARG  59           HG1      ARG  59 -11.480  15.284 -17.389
  459   2HG   ARG  59           HG2      ARG  59 -12.906  14.556 -16.662
  460   1HD   ARG  59           HD1      ARG  59 -13.241  16.963 -18.422
  461   2HD   ARG  59           HD2      ARG  59 -12.974  15.399 -19.180
  462    HE   ARG  59           HE       ARG  59 -15.471  16.154 -18.393
  463   1HH1  ARG  59          HH21      ARG  59 -14.228  13.284 -18.822
  464   2HH1  ARG  59          HH22      ARG  59 -14.984  12.462 -17.496
  465   1HH2  ARG  59          HH11      ARG  59 -16.008  15.441 -15.981
  466   2HH2  ARG  59          HH12      ARG  59 -16.019  13.714 -15.849
  467    H    PHE  60           HN       PHE  60  -9.913  17.004 -13.469
  468    HA   PHE  60           HA       PHE  60 -11.262  18.340 -11.346
  469   1HB   PHE  60           HB2      PHE  60  -8.832  17.724 -11.324
  470   2HB   PHE  60           HB1      PHE  60  -8.521  18.918 -12.581
  471    HD1  PHE  60           HD2      PHE  60 -10.319  18.802  -9.280
  472    HD2  PHE  60           HD1      PHE  60  -7.652  20.943 -11.819
  473    HE1  PHE  60           HE2      PHE  60 -10.096  20.552  -7.573
  474    HE2  PHE  60           HE1      PHE  60  -7.436  22.695 -10.111
  475    HZ   PHE  60           HZ       PHE  60  -8.656  22.500  -7.987
  476    H    SER  61           HN       SER  61 -11.127  20.747 -10.984
  477    HA   SER  61           HA       SER  61 -12.673  22.140 -12.882
  478   1HB   SER  61           HB2      SER  61 -12.217  22.789 -10.426
  479   2HB   SER  61           HB1      SER  61 -10.684  23.483 -10.987
  480    HG   SER  61           HG       SER  61 -12.252  24.394 -12.714
  481    H    GLY  62           HN       GLY  62  -9.154  22.099 -12.499
  482   1HA   GLY  62           HA1      GLY  62  -8.825  23.948 -14.780
  483   2HA   GLY  62           HA2      GLY  62  -7.525  23.282 -13.798
  484    H    VAL  63           HN       VAL  63 -10.070  22.101 -16.001
  485    HA   VAL  63           HA       VAL  63  -7.973  20.541 -17.422
  486    HB   VAL  63           HB       VAL  63 -10.654  19.432 -16.443
  487   1HG1  VAL  63          HG12      VAL  63  -8.389  18.097 -17.974
  488   2HG1  VAL  63          HG13      VAL  63  -9.822  17.283 -17.358
  489   3HG1  VAL  63          HG11      VAL  63  -9.974  18.484 -18.633
  490   1HG2  VAL  63          HG22      VAL  63  -8.910  19.687 -14.682
  491   2HG2  VAL  63          HG23      VAL  63  -9.259  18.000 -15.022
  492   3HG2  VAL  63          HG21      VAL  63  -7.800  18.741 -15.667
  493    HA   PRO  64           HA       PRO  64 -10.054  22.315 -20.873
  494   1HB   PRO  64           HB2      PRO  64  -8.792  20.515 -22.718
  495   2HB   PRO  64           HB1      PRO  64  -8.265  22.146 -22.305
  496   1HG   PRO  64           HG1      PRO  64  -7.068  19.609 -21.519
  497   2HG   PRO  64           HG2      PRO  64  -6.448  21.236 -21.250
  498   1HD   PRO  64           HD1      PRO  64  -7.621  19.468 -19.313
  499   2HD   PRO  64           HD2      PRO  64  -7.072  21.134 -19.058
  500    H    ASP  65           HN       ASP  65 -10.927  19.682 -19.477
  501    HA   ASP  65           HA       ASP  65 -12.690  18.189 -19.699
  502   1HB   ASP  65           HB2      ASP  65 -13.420  19.630 -22.270
  503   2HB   ASP  65           HB1      ASP  65 -14.500  18.853 -21.117
  504    NH1  ARG  66           NH1      ARG  66  -7.686  21.144 -25.267
  505    NH2  ARG  66           NH2      ARG  66  -5.648  20.304 -25.803
  506    H    ARG  66           HN       ARG  66 -10.580  18.595 -22.441
  507    HA   ARG  66           HA       ARG  66 -11.498  16.371 -23.993
  508   1HB   ARG  66           HB2      ARG  66  -9.300  16.552 -25.101
  509   2HB   ARG  66           HB1      ARG  66  -9.925  18.167 -24.794
  510   1HG   ARG  66           HG1      ARG  66  -8.529  18.374 -22.802
  511   2HG   ARG  66           HG2      ARG  66  -7.991  16.707 -22.963
  512   1HD   ARG  66           HD1      ARG  66  -6.326  17.396 -24.321
  513   2HD   ARG  66           HD2      ARG  66  -7.528  17.982 -25.468
  514    HE   ARG  66           HE       ARG  66  -6.642  19.701 -23.192
  515   1HH1  ARG  66          HH11      ARG  66  -8.496  21.108 -24.686
  516   2HH1  ARG  66          HH12      ARG  66  -7.621  21.825 -25.996
  517   1HH2  ARG  66          HH21      ARG  66  -4.925  19.636 -25.627
  518   2HH2  ARG  66          HH22      ARG  66  -5.547  20.968 -26.541
  519    H    PHE  67           HN       PHE  67  -9.944  16.420 -20.990
  520    HA   PHE  67           HA       PHE  67  -8.692  13.759 -21.393
  521   1HB   PHE  67           HB2      PHE  67  -8.696  15.773 -19.104
  522   2HB   PHE  67           HB1      PHE  67  -7.965  14.177 -18.951
  523    HD1  PHE  67           HD1      PHE  67  -6.063  13.544 -20.454
  524    HD2  PHE  67           HD2      PHE  67  -7.610  17.507 -20.382
  525    HE1  PHE  67           HE1      PHE  67  -4.037  14.359 -21.580
  526    HE2  PHE  67           HE2      PHE  67  -5.582  18.316 -21.509
  527    HZ   PHE  67           HZ       PHE  67  -3.801  16.743 -22.116
  528    H    SER  68           HN       SER  68  -9.550  11.910 -20.669
  529    HA   SER  68           HA       SER  68 -11.630  11.986 -18.564
  530   1HB   SER  68           HB2      SER  68 -12.076  11.212 -21.459
  531   2HB   SER  68           HB1      SER  68 -12.983  10.351 -20.198
  532    HG   SER  68           HG       SER  68 -12.905  13.115 -20.781
  533    H    GLY  69           HN       GLY  69 -10.027  10.903 -17.353
  534   1HA   GLY  69           HA1      GLY  69  -9.082   8.278 -18.273
  535   2HA   GLY  69           HA2      GLY  69  -8.657   9.048 -16.752
  536    H    SER  70           HN       SER  70 -10.588   6.684 -18.230
  537    HA   SER  70           HA       SER  70 -12.687   6.640 -16.197
  538   1HB   SER  70           HB2      SER  70 -13.067   5.682 -18.489
  539   2HB   SER  70           HB1      SER  70 -11.811   4.467 -18.181
  540    HG   SER  70           HG       SER  70 -13.341   3.396 -17.208
  541    H    GLY  71           HN       GLY  71 -13.009   4.736 -14.763
  542   1HA   GLY  71           HA1      GLY  71 -10.466   3.407 -14.003
  543   2HA   GLY  71           HA2      GLY  71 -11.305   4.338 -12.767
  544    H    SER  72           HN       SER  72 -11.197   1.433 -14.579
  545    HA   SER  72           HA       SER  72 -13.735   0.479 -13.416
  546   1HB   SER  72           HB2      SER  72 -12.867   0.070 -15.889
  547   2HB   SER  72           HB1      SER  72 -11.901  -1.217 -15.142
  548    HG   SER  72           HG       SER  72 -13.681  -2.245 -14.554
  549    H    GLY  73           HN       GLY  73 -12.988   0.437 -11.232
  550   1HA   GLY  73           HA1      GLY  73 -12.290  -0.779  -9.344
  551   2HA   GLY  73           HA2      GLY  73 -12.054  -2.159 -10.407
  552    H    THR  74           HN       THR  74 -10.018  -2.310 -11.561
  553    HA   THR  74           HA       THR  74  -7.823  -0.789 -10.211
  554    HB   THR  74           HB       THR  74  -6.449  -2.954 -10.591
  555    HG1  THR  74           HG1      THR  74  -8.090  -3.647 -12.147
  556   1HG2  THR  74          HG23      THR  74  -8.753  -2.596  -8.707
  557   2HG2  THR  74          HG21      THR  74  -8.241  -4.266  -8.931
  558   3HG2  THR  74          HG22      THR  74  -7.096  -3.067  -8.341
  559    H    ASP  75           HN       ASP  75  -9.307  -0.704 -12.922
  560    HA   ASP  75           HA       ASP  75  -6.806  -0.546 -14.564
  561   1HB   ASP  75           HB2      ASP  75  -9.212  -2.067 -15.024
  562   2HB   ASP  75           HB1      ASP  75  -9.154  -0.792 -16.237
  563    H    PHE  76           HN       PHE  76  -6.400   1.374 -15.486
  564    HA   PHE  76           HA       PHE  76  -8.648   3.306 -15.768
  565   1HB   PHE  76           HB2      PHE  76  -5.931   4.053 -14.590
  566   2HB   PHE  76           HB1      PHE  76  -7.388   5.047 -14.629
  567    HD1  PHE  76           HD1      PHE  76  -9.270   4.554 -13.130
  568    HD2  PHE  76           HD2      PHE  76  -5.733   2.196 -12.990
  569    HE1  PHE  76           HE1      PHE  76 -10.120   3.400 -11.135
  570    HE2  PHE  76           HE2      PHE  76  -6.547   1.100 -10.950
  571    HZ   PHE  76           HZ       PHE  76  -8.727   1.723 -10.004
  572    H    THR  77           HN       THR  77  -8.474   4.740 -17.451
  573    HA   THR  77           HA       THR  77  -5.976   4.675 -19.073
  574    HB   THR  77           HB       THR  77  -8.813   4.196 -20.163
  575    HG1  THR  77           HG1      THR  77  -6.545   2.529 -20.298
  576   1HG2  THR  77          HG22      THR  77  -6.845   5.394 -21.614
  577   2HG2  THR  77          HG23      THR  77  -6.231   3.745 -21.686
  578   3HG2  THR  77          HG21      THR  77  -7.825   4.118 -22.331
  579    H    LEU  78           HN       LEU  78  -5.363   6.732 -19.170
  580    HA   LEU  78           HA       LEU  78  -7.301   8.928 -19.043
  581   1HB   LEU  78           HB2      LEU  78  -5.008   9.018 -17.978
  582   2HB   LEU  78           HB1      LEU  78  -4.294   8.981 -19.584
  583    HG   LEU  78           HG       LEU  78  -6.385  11.059 -19.044
  584   1HD1  LEU  78          HD11      LEU  78  -3.527  11.188 -18.032
  585   2HD1  LEU  78          HD12      LEU  78  -4.624  12.563 -18.109
  586   3HD1  LEU  78          HD13      LEU  78  -4.984  11.209 -17.043
  587   1HD2  LEU  78          HD21      LEU  78  -4.046  10.598 -20.831
  588   2HD2  LEU  78          HD22      LEU  78  -5.600  11.339 -21.190
  589   3HD2  LEU  78          HD23      LEU  78  -4.353  12.266 -20.363
  590    H    LYS  79           HN       LYS  79  -8.519   9.026 -20.873
  591    HA   LYS  79           HA       LYS  79  -7.147   8.916 -23.497
  592   1HB   LYS  79           HB2      LYS  79 -10.120   9.258 -22.915
  593   2HB   LYS  79           HB1      LYS  79  -9.391   8.741 -24.431
  594   1HG   LYS  79           HG1      LYS  79  -8.519   6.706 -23.321
  595   2HG   LYS  79           HG2      LYS  79  -9.242   7.222 -21.803
  596   1HD   LYS  79           HD1      LYS  79 -11.324   7.377 -23.701
  597   2HD   LYS  79           HD2      LYS  79 -10.489   5.870 -24.055
  598   1HE   LYS  79           HE1      LYS  79 -10.563   5.676 -21.367
  599   2HE   LYS  79           HE2      LYS  79 -11.993   6.674 -21.605
  600   1HZ   LYS  79           HZ1      LYS  79 -12.836   5.030 -23.164
  601   2HZ   LYS  79           HZ2      LYS  79 -11.456   4.068 -22.925
  602    H    ILE  80           HN       ILE  80  -6.808  10.630 -24.759
  603    HA   ILE  80           HA       ILE  80  -7.878  13.261 -23.827
  604    HB   ILE  80           HB       ILE  80  -5.457  12.926 -25.626
  605   1HG1  ILE  80          HG11      ILE  80  -5.320  13.014 -22.597
  606   2HG1  ILE  80          HG12      ILE  80  -5.206  11.519 -23.513
  607   1HG2  ILE  80          HG22      ILE  80  -6.318  14.996 -23.539
  608   2HG2  ILE  80          HG23      ILE  80  -4.861  15.111 -24.521
  609   3HG2  ILE  80          HG21      ILE  80  -6.445  15.194 -25.283
  610   1HD1  ILE  80          HD11      ILE  80  -3.435  13.688 -24.477
  611   2HD1  ILE  80          HD12      ILE  80  -3.049  13.078 -22.873
  612   3HD1  ILE  80          HD13      ILE  80  -3.092  11.978 -24.245
  613    H    SER  81           HN       SER  81  -8.950  14.526 -25.166
  614    HA   SER  81           HA       SER  81  -9.716  13.285 -27.690
  615   1HB   SER  81           HB2      SER  81 -11.572  14.252 -26.503
  616   2HB   SER  81           HB1      SER  81 -10.684  15.755 -26.193
  617    HG   SER  81           HG       SER  81 -11.251  16.426 -28.097
  618    NH1  ARG  82           NH1      ARG  82  -9.800  15.579 -31.622
  619    NH2  ARG  82           NH2      ARG  82 -10.622  17.402 -32.702
  620    H    ARG  82           HN       ARG  82  -8.162  16.306 -26.666
  621    HA   ARG  82           HA       ARG  82  -7.224  16.610 -29.493
  622   1HB   ARG  82           HB2      ARG  82  -8.140  18.715 -27.488
  623   2HB   ARG  82           HB1      ARG  82  -7.220  19.131 -28.927
  624   1HG   ARG  82           HG1      ARG  82  -9.617  17.384 -29.306
  625   2HG   ARG  82           HG2      ARG  82  -9.912  19.075 -28.922
  626   1HD   ARG  82           HD1      ARG  82  -9.692  19.338 -31.196
  627   2HD   ARG  82           HD2      ARG  82  -7.972  19.356 -30.814
  628    HE   ARG  82           HE       ARG  82  -7.780  17.224 -31.832
  629   1HH1  ARG  82          HH11      ARG  82  -9.076  15.168 -31.069
  630   2HH1  ARG  82          HH12      ARG  82 -10.586  15.032 -31.906
  631   1HH2  ARG  82          HH21      ARG  82 -10.518  18.362 -32.960
  632   2HH2  ARG  82          HH22      ARG  82 -11.421  16.886 -33.007
  633    H    VAL  83           HN       VAL  83  -5.187  15.875 -29.339
  634    HA   VAL  83           HA       VAL  83  -3.489  16.677 -27.061
  635    HB   VAL  83           HB       VAL  83  -2.990  14.935 -29.522
  636   1HG1  VAL  83          HG12      VAL  83  -1.172  16.007 -27.419
  637   2HG1  VAL  83          HG13      VAL  83  -0.990  14.297 -27.797
  638   3HG1  VAL  83          HG11      VAL  83  -0.807  15.504 -29.067
  639   1HG2  VAL  83          HG23      VAL  83  -4.545  14.076 -27.712
  640   2HG2  VAL  83          HG21      VAL  83  -3.111  13.085 -27.957
  641   3HG2  VAL  83          HG22      VAL  83  -3.196  14.186 -26.586
  642    H    GLU  84           HN       GLU  84  -2.851  18.749 -27.213
  643    HA   GLU  84           HA       GLU  84  -1.805  19.741 -29.825
  644   1HB   GLU  84           HB2      GLU  84  -2.798  21.081 -27.283
  645   2HB   GLU  84           HB1      GLU  84  -1.831  21.981 -28.441
  646   1HG   GLU  84           HG1      GLU  84  -3.568  22.170 -29.894
  647   2HG   GLU  84           HG2      GLU  84  -3.986  20.467 -29.738
  648    H    ALA  85           HN       ALA  85   0.048  21.441 -29.410
  649    HA   ALA  85           HA       ALA  85   2.351  20.022 -28.629
  650   1HB   ALA  85           HB3      ALA  85   1.811  23.024 -28.731
  651   2HB   ALA  85           HB1      ALA  85   3.421  22.343 -28.521
  652   3HB   ALA  85           HB2      ALA  85   2.522  22.036 -30.004
  653    H    GLU  86           HN       GLU  86   0.117  21.841 -26.679
  654    HA   GLU  86           HA       GLU  86   1.895  21.991 -24.362
  655   1HB   GLU  86           HB2      GLU  86  -1.080  22.471 -24.807
  656   2HB   GLU  86           HB1      GLU  86  -0.356  22.587 -23.206
  657   1HG   GLU  86           HG1      GLU  86   0.644  24.125 -25.617
  658   2HG   GLU  86           HG2      GLU  86  -0.479  24.788 -24.435
  659    H    ASP  87           HN       ASP  87  -0.798  19.988 -25.395
  660    HA   ASP  87           HA       ASP  87  -1.144  18.454 -23.040
  661   1HB   ASP  87           HB2      ASP  87  -1.423  17.673 -25.980
  662   2HB   ASP  87           HB1      ASP  87  -2.030  16.693 -24.649
  663    H    LEU  88           HN       LEU  88   1.435  18.443 -25.304
  664    HA   LEU  88           HA       LEU  88   2.411  15.779 -24.983
  665   1HB   LEU  88           HB2      LEU  88   3.912  18.393 -25.472
  666   2HB   LEU  88           HB1      LEU  88   4.600  16.791 -25.706
  667    HG   LEU  88           HG       LEU  88   2.135  17.832 -27.144
  668   1HD1  LEU  88          HD11      LEU  88   4.287  18.978 -27.774
  669   2HD1  LEU  88          HD12      LEU  88   4.957  17.403 -28.187
  670   3HD1  LEU  88          HD13      LEU  88   3.590  18.042 -29.092
  671   1HD2  LEU  88          HD21      LEU  88   3.436  15.208 -26.877
  672   2HD2  LEU  88          HD22      LEU  88   1.831  15.601 -27.479
  673   3HD2  LEU  88          HD23      LEU  88   3.224  15.703 -28.550
  674    H    GLY  89           HN       GLY  89   4.487  15.224 -23.891
  675   1HA   GLY  89           HA1      GLY  89   6.039  16.035 -22.011
  676   2HA   GLY  89           HA2      GLY  89   4.558  16.456 -21.161
  677    H    ILE  90           HN       ILE  90   5.989  14.933 -19.708
  678    HA   ILE  90           HA       ILE  90   5.509  12.071 -20.258
  679    HB   ILE  90           HB       ILE  90   6.575  13.181 -17.643
  680   1HG1  ILE  90          HG11      ILE  90   7.780  14.472 -19.335
  681   2HG1  ILE  90          HG12      ILE  90   8.852  13.266 -18.640
  682   1HG2  ILE  90          HG21      ILE  90   7.115  10.736 -19.392
  683   2HG2  ILE  90          HG22      ILE  90   8.075  11.117 -17.966
  684   3HG2  ILE  90          HG23      ILE  90   6.359  10.757 -17.803
  685   1HD1  ILE  90          HD11      ILE  90   7.326  12.895 -21.242
  686   2HD1  ILE  90          HD12      ILE  90   9.013  13.386 -21.140
  687   3HD1  ILE  90          HD13      ILE  90   8.524  11.796 -20.567
  688    OH   TYR  91           OH       TYR  91  -2.787  15.318 -19.481
  689    H    TYR  91           HN       TYR  91   3.569  11.243 -19.760
  690    HA   TYR  91           HA       TYR  91   1.924  12.601 -17.725
  691   1HB   TYR  91           HB2      TYR  91   1.446  10.902 -20.042
  692   2HB   TYR  91           HB1      TYR  91   0.595  10.258 -18.638
  693    HD1  TYR  91           HD1      TYR  91  -0.869  11.870 -17.282
  694    HD2  TYR  91           HD2      TYR  91   0.655  12.875 -21.124
  695    HE1  TYR  91           HE1      TYR  91  -2.515  13.673 -17.464
  696    HE2  TYR  91           HE2      TYR  91  -0.990  14.687 -21.301
  697    HH   TYR  91           HH       TYR  91  -2.978  15.464 -20.409
  698    H    PHE  92           HN       PHE  92   1.226  11.756 -15.851
  699    HA   PHE  92           HA       PHE  92   2.284   9.101 -15.008
  700   1HB   PHE  92           HB2      PHE  92   2.725  11.821 -13.783
  701   2HB   PHE  92           HB1      PHE  92   2.534  10.452 -12.691
  702    HD1  PHE  92           HD1      PHE  92   4.644  11.932 -15.321
  703    HD2  PHE  92           HD2      PHE  92   4.187   8.641 -12.656
  704    HE1  PHE  92           HE1      PHE  92   6.977  11.279 -15.722
  705    HE2  PHE  92           HE2      PHE  92   6.521   7.993 -13.059
  706    HZ   PHE  92           HZ       PHE  92   7.916   9.306 -14.596
  707    H    CYS  93           HN       CYS  93   1.132   8.202 -13.169
  708    HA   CYS  93           HA       CYS  93  -1.491   9.482 -12.609
  709   1HB   CYS  93           HB2      CYS  93  -2.732   7.556 -13.189
  710   2HB   CYS  93           HB1      CYS  93  -1.593   7.731 -14.495
  711    H    SER  94           HN       SER  94  -2.543   8.680 -10.720
  712    HA   SER  94           HA       SER  94  -0.989   6.923  -8.931
  713   1HB   SER  94           HB2      SER  94  -0.158   9.349  -8.611
  714   2HB   SER  94           HB1      SER  94  -1.783   9.730  -8.010
  715    HG   SER  94           HG       SER  94   0.224   8.221  -6.862
  716    H    GLN  95           HN       GLN  95  -2.230   7.080  -6.648
  717    HA   GLN  95           HA       GLN  95  -5.153   6.967  -7.258
  718   1HB   GLN  95           HB2      GLN  95  -5.136   4.981  -5.582
  719   2HB   GLN  95           HB1      GLN  95  -4.475   4.671  -7.181
  720   1HG   GLN  95           HG1      GLN  95  -2.289   4.562  -6.411
  721   2HG   GLN  95           HG2      GLN  95  -2.591   5.662  -5.071
  722   1HE2  GLN  95          HE22      GLN  95  -2.903   2.952  -2.863
  723   2HE2  GLN  95          HE21      GLN  95  -2.340   4.527  -3.146
  724    H    THR  96           HN       THR  96  -6.111   8.468  -6.081
  725    HA   THR  96           HA       THR  96  -4.954   9.359  -3.543
  726    HB   THR  96           HB       THR  96  -5.968  11.002  -5.164
  727    HG1  THR  96           HG1      THR  96  -7.468  10.678  -2.769
  728   1HG2  THR  96          HG23      THR  96  -7.886   9.323  -5.751
  729   2HG2  THR  96          HG21      THR  96  -8.610   9.817  -4.227
  730   3HG2  THR  96          HG22      THR  96  -8.365  10.999  -5.507
  731    H    THR  97           HN       THR  97  -5.868   6.645  -3.627
  732    HA   THR  97           HA       THR  97  -8.293   6.685  -1.893
  733    HB   THR  97           HB       THR  97  -7.059   4.043  -2.568
  734    HG1  THR  97           HG1      THR  97  -7.724   6.032  -4.448
  735   1HG2  THR  97          HG21      THR  97  -9.717   5.317  -2.337
  736   2HG2  THR  97          HG22      THR  97  -9.579   4.372  -3.816
  737   3HG2  THR  97          HG23      THR  97  -9.316   3.605  -2.254
  738    H    HIS  98           HN       HIS  98  -5.428   4.614  -1.929
  739    HA   HIS  98           HA       HIS  98  -5.456   4.416   0.982
  740   1HB   HIS  98           HB2      HIS  98  -3.291   3.512  -0.977
  741   2HB   HIS  98           HB1      HIS  98  -3.553   2.900   0.653
  742    HD2  HIS  98           HD2      HIS  98  -5.303   2.770  -2.881
  743    HE1  HIS  98           HE1      HIS  98  -6.865  -0.234  -0.509
  744    H    VAL  99           HN       VAL  99  -3.548   4.884   2.304
  745    HA   VAL  99           HA       VAL  99  -1.884   7.125   1.263
  746    HB   VAL  99           HB       VAL  99  -3.345   7.087   3.950
  747   1HG1  VAL  99          HG12      VAL  99  -1.109   8.304   3.832
  748   2HG1  VAL  99          HG13      VAL  99  -1.837   9.367   2.631
  749   3HG1  VAL  99          HG11      VAL  99  -2.480   9.317   4.269
  750   1HG2  VAL  99          HG21      VAL  99  -3.870   8.619   1.381
  751   2HG2  VAL  99          HG22      VAL  99  -4.947   7.466   2.164
  752   3HG2  VAL  99          HG23      VAL  99  -4.616   9.019   2.925
  753    HA   PRO 100           HA       PRO 100  -0.262   8.279   1.781
  754   1HB   PRO 100           HB2      PRO 100   2.405   7.705   0.927
  755   2HB   PRO 100           HB1      PRO 100   1.939   8.778   2.247
  756   1HG   PRO 100           HG1      PRO 100   3.194   6.158   2.415
  757   2HG   PRO 100           HG2      PRO 100   2.846   7.287   3.725
  758   1HD   PRO 100           HD1      PRO 100   1.449   4.837   3.073
  759   2HD   PRO 100           HD2      PRO 100   1.122   5.953   4.410
  760    HA   PRO 101           HA       PRO 101  -1.026   6.784  -2.261
  761   1HB   PRO 101           HB2      PRO 101   0.363   8.933  -3.623
  762   2HB   PRO 101           HB1      PRO 101  -1.371   8.792  -3.332
  763   1HG   PRO 101           HG1      PRO 101   0.503  10.579  -2.042
  764   2HG   PRO 101           HG2      PRO 101  -1.236  10.459  -1.774
  765   1HD   PRO 101           HD1      PRO 101   0.884   9.578  -0.024
  766   2HD   PRO 101           HD2      PRO 101  -0.865   9.449   0.239
  767    H    THR 102           HN       THR 102  -0.004   5.744  -4.033
  768    HA   THR 102           HA       THR 102   2.834   5.101  -3.519
  769    HB   THR 102           HB       THR 102   2.403   3.333  -5.339
  770    HG1  THR 102           HG1      THR 102   0.205   3.250  -5.993
  771   1HG2  THR 102          HG21      THR 102   1.175   3.522  -2.710
  772   2HG2  THR 102          HG22      THR 102  -0.007   2.821  -3.809
  773   3HG2  THR 102          HG23      THR 102   1.564   2.053  -3.599
  774    H    PHE 103           HN       PHE 103   0.952   5.853  -6.460
  775    HA   PHE 103           HA       PHE 103   1.500   7.242  -8.280
  776   1HB   PHE 103           HB2      PHE 103   2.602   8.590  -6.220
  777   2HB   PHE 103           HB1      PHE 103   4.099   8.068  -6.985
  778    HD1  PHE 103           HD2      PHE 103   4.455   8.627  -9.454
  779    HD2  PHE 103           HD1      PHE 103   1.341  10.389  -7.143
  780    HE1  PHE 103           HE2      PHE 103   4.245  10.430 -11.106
  781    HE2  PHE 103           HE1      PHE 103   1.129  12.186  -8.804
  782    HZ   PHE 103           HZ       PHE 103   2.580  12.209 -10.786
  783    H    GLY 104           HN       GLY 104   2.708   7.019 -10.161
  784   1HA   GLY 104           HA1      GLY 104   5.276   6.001 -10.515
  785   2HA   GLY 104           HA2      GLY 104   4.265   4.569 -10.351
  786    H    GLY 105           HN       GLY 105   5.581   4.874 -12.679
  787   1HA   GLY 105           HA1      GLY 105   4.418   4.327 -14.846
  788   2HA   GLY 105           HA2      GLY 105   3.460   5.780 -14.582
  789    H    GLY 106           HN       GLY 106   4.169   6.553 -16.632
  790   1HA   GLY 106           HA1      GLY 106   5.932   8.557 -16.841
  791   2HA   GLY 106           HA2      GLY 106   7.042   7.192 -16.941
  792    H    THR 107           HN       THR 107   3.886   8.106 -18.334
  793    HA   THR 107           HA       THR 107   4.555   6.726 -20.832
  794    HB   THR 107           HB       THR 107   2.154   8.477 -20.026
  795    HG1  THR 107           HG1      THR 107   2.212   5.722 -20.556
  796   1HG2  THR 107          HG22      THR 107   2.973   7.158 -22.594
  797   2HG2  THR 107          HG23      THR 107   1.365   6.708 -22.034
  798   3HG2  THR 107          HG21      THR 107   1.750   8.399 -22.340
  799    H    LYS 108           HN       LYS 108   6.005   7.658 -22.110
  800    HA   LYS 108           HA       LYS 108   6.463  10.502 -22.221
  801   1HB   LYS 108           HB2      LYS 108   7.314   8.116 -23.899
  802   2HB   LYS 108           HB1      LYS 108   7.714   9.747 -24.421
  803   1HG   LYS 108           HG1      LYS 108   8.292   9.194 -21.569
  804   2HG   LYS 108           HG2      LYS 108   9.252   8.252 -22.704
  805   1HD   LYS 108           HD1      LYS 108   9.841  10.375 -23.904
  806   2HD   LYS 108           HD2      LYS 108   8.970  11.278 -22.671
  807   1HE   LYS 108           HE1      LYS 108  10.504   9.973 -20.991
  808   2HE   LYS 108           HE2      LYS 108  11.517   9.687 -22.401
  809   1HZ   LYS 108           HZ1      LYS 108  10.663  12.417 -22.144
  810   2HZ   LYS 108           HZ2      LYS 108  11.607  11.882 -20.835
  811    H    LEU 109           HN       LEU 109   4.463  11.451 -22.668
  812    HA   LEU 109           HA       LEU 109   3.003  10.713 -25.096
  813   1HB   LEU 109           HB2      LEU 109   2.171  11.795 -22.769
  814   2HB   LEU 109           HB1      LEU 109   2.500  13.298 -23.622
  815    HG   LEU 109           HG       LEU 109   1.146  12.112 -25.577
  816   1HD1  LEU 109          HD11      LEU 109   0.987   9.965 -24.246
  817   2HD1  LEU 109          HD12      LEU 109  -0.039  10.818 -23.098
  818   3HD1  LEU 109          HD13      LEU 109  -0.573  10.600 -24.762
  819   1HD2  LEU 109          HD21      LEU 109   0.501  14.198 -24.361
  820   2HD2  LEU 109          HD22      LEU 109  -0.892  13.188 -24.733
  821   3HD2  LEU 109          HD23      LEU 109  -0.232  13.210 -23.102
  822    H    GLU 110           HN       GLU 110   4.548  11.052 -26.689
  823    HA   GLU 110           HA       GLU 110   5.090  13.935 -27.279
  824   1HB   GLU 110           HB2      GLU 110   6.928  11.795 -26.924
  825   2HB   GLU 110           HB1      GLU 110   6.868  12.066 -28.662
  826   1HG   GLU 110           HG1      GLU 110   7.174  14.363 -26.710
  827   2HG   GLU 110           HG2      GLU 110   8.568  13.479 -27.322
  828    H    ILE 111           HN       ILE 111   4.730  14.637 -29.345
  829    HA   ILE 111           HA       ILE 111   3.016  12.879 -30.980
  830    HB   ILE 111           HB       ILE 111   3.738  15.816 -30.978
  831   1HG1  ILE 111          HG11      ILE 111   0.976  14.679 -31.250
  832   2HG1  ILE 111          HG12      ILE 111   1.785  14.532 -29.696
  833   1HG2  ILE 111          HG21      ILE 111   2.547  14.169 -33.234
  834   2HG2  ILE 111          HG22      ILE 111   2.082  15.854 -33.038
  835   3HG2  ILE 111          HG23      ILE 111   3.766  15.434 -33.336
  836   1HD1  ILE 111          HD12      ILE 111   2.231  17.194 -30.595
  837   2HD1  ILE 111          HD13      ILE 111   0.524  16.850 -30.844
  838   3HD1  ILE 111          HD11      ILE 111   1.230  16.673 -29.244
  839    H    LYS 112           HN       LYS 112   3.412  12.311 -33.076
  840    HA   LYS 112           HA       LYS 112   6.165  11.778 -33.743
  841   1HB   LYS 112           HB2      LYS 112   3.509  11.092 -34.749
  842   2HB   LYS 112           HB1      LYS 112   4.572  11.503 -36.090
  843   1HG   LYS 112           HG1      LYS 112   6.270   9.913 -35.228
  844   2HG   LYS 112           HG2      LYS 112   5.196   9.493 -33.898
  845   1HD   LYS 112           HD1      LYS 112   3.564   8.554 -35.399
  846   2HD   LYS 112           HD2      LYS 112   4.383   9.220 -36.807
  847   1HE   LYS 112           HE1      LYS 112   6.254   7.735 -36.530
  848   2HE   LYS 112           HE2      LYS 112   5.705   7.237 -34.934
  849   1HZ   LYS 112           HZ1      LYS 112   3.622   6.456 -36.187
  850   2HZ   LYS 112           HZ2      LYS 112   4.606   6.528 -37.571
  851    NH1  ARG 113           NH1      ARG 113  10.195  18.335 -30.528
  852    NH2  ARG 113           NH2      ARG 113   8.541  17.655 -29.127
  853    H    ARG 113           HN       ARG 113   7.424  13.482 -34.132
  854    HA   ARG 113           HA       ARG 113   6.639  15.270 -36.391
  855   1HB   ARG 113           HB2      ARG 113   7.787  17.140 -35.119
  856   2HB   ARG 113           HB1      ARG 113   6.354  16.535 -34.296
  857   1HG   ARG 113           HG1      ARG 113   7.818  15.053 -32.908
  858   2HG   ARG 113           HG2      ARG 113   9.230  15.755 -33.689
  859   1HD   ARG 113           HD1      ARG 113   8.716  17.949 -32.801
  860   2HD   ARG 113           HD2      ARG 113   7.151  17.396 -32.204
  861    HE   ARG 113           HE       ARG 113   8.941  15.720 -30.925
  862   1HH1  ARG 113          HH11      ARG 113  10.670  18.232 -31.401
  863   2HH1  ARG 113          HH12      ARG 113  10.495  19.026 -29.874
  864   1HH2  ARG 113          HH21      ARG 113   7.773  17.039 -28.947
  865   2HH2  ARG 113          HH22      ARG 113   8.810  18.332 -28.445
   
  Start of MODEL          14
 Raw file had  865 H/Q atoms
  Start of MODEL   14
    1   1H    ASP   1           HT1      ASP   1   2.801   1.131   0.090
    2   2H    ASP   1           HT2      ASP   1   2.024  -0.372  -0.059
    3   3H    ASP   1           HT3      ASP   1   3.680  -0.306   0.311
    4    HA   ASP   1           HA       ASP   1   4.286  -0.097  -1.798
    5   1HB   ASP   1           HB2      ASP   1   2.146  -1.744  -1.710
    6   2HB   ASP   1           HB1      ASP   1   1.441  -0.481  -2.715
    7    H    VAL   2           HN       VAL   2   3.918   0.899  -3.943
    8    HA   VAL   2           HA       VAL   2   3.689   3.691  -3.582
    9    HB   VAL   2           HB       VAL   2   3.461   2.084  -6.170
   10   1HG1  VAL   2          HG13      VAL   2   3.390   4.913  -5.630
   11   2HG1  VAL   2          HG11      VAL   2   4.880   4.539  -6.488
   12   3HG1  VAL   2          HG12      VAL   2   3.329   4.101  -7.189
   13   1HG2  VAL   2          HG22      VAL   2   5.824   3.003  -4.525
   14   2HG2  VAL   2          HG23      VAL   2   5.481   1.387  -5.134
   15   3HG2  VAL   2          HG21      VAL   2   5.978   2.659  -6.245
   16    H    VAL   3           HN       VAL   3   1.875   4.763  -3.149
   17    HA   VAL   3           HA       VAL   3  -0.757   3.713  -3.807
   18    HB   VAL   3           HB       VAL   3  -0.071   6.562  -2.945
   19   1HG1  VAL   3          HG11      VAL   3  -2.498   4.779  -2.827
   20   2HG1  VAL   3          HG12      VAL   3  -2.305   6.073  -1.649
   21   3HG1  VAL   3          HG13      VAL   3  -2.381   6.451  -3.367
   22   1HG2  VAL   3          HG21      VAL   3  -0.240   4.026  -1.287
   23   2HG2  VAL   3          HG22      VAL   3   1.112   5.149  -1.390
   24   3HG2  VAL   3          HG23      VAL   3  -0.377   5.636  -0.587
   25    H    MET   4           HN       MET   4  -2.368   5.199  -4.951
   26    HA   MET   4           HA       MET   4  -1.057   6.573  -7.256
   27   1HB   MET   4           HB2      MET   4  -3.386   4.606  -7.353
   28   2HB   MET   4           HB1      MET   4  -2.815   5.542  -8.729
   29   1HG   MET   4           HG1      MET   4  -0.533   4.327  -7.587
   30   2HG   MET   4           HG2      MET   4  -1.758   3.090  -7.613
   31   1HE   MET   4           HE2      MET   4  -0.563   5.984  -9.495
   32   2HE   MET   4           HE3      MET   4   0.052   5.393 -11.038
   33   3HE   MET   4           HE1      MET   4  -1.669   5.719 -10.843
   34    H    THR   5           HN       THR   5  -1.565   8.611  -6.690
   35    HA   THR   5           HA       THR   5  -4.323   9.306  -5.893
   36    HB   THR   5           HB       THR   5  -2.004  11.247  -6.408
   37    HG1  THR   5           HG1      THR   5  -2.113  10.630  -3.893
   38   1HG2  THR   5          HG21      THR   5  -4.359  12.102  -5.757
   39   2HG2  THR   5          HG22      THR   5  -4.208  11.166  -4.274
   40   3HG2  THR   5          HG23      THR   5  -3.108  12.504  -4.586
   41    H    GLN   6           HN       GLN   6  -5.670  10.680  -7.080
   42    HA   GLN   6           HA       GLN   6  -4.763  11.426  -9.803
   43   1HB   GLN   6           HB2      GLN   6  -5.940   9.665 -10.662
   44   2HB   GLN   6           HB1      GLN   6  -6.678   9.314  -9.107
   45   1HG   GLN   6           HG1      GLN   6  -7.668  11.645 -10.748
   46   2HG   GLN   6           HG2      GLN   6  -8.216  10.015 -11.103
   47   1HE2  GLN   6          HE22      GLN   6 -10.658  11.256  -8.677
   48   2HE2  GLN   6          HE21      GLN   6 -10.252  11.515 -10.304
   49    H    THR   7           HN       THR   7  -5.980  13.059 -10.791
   50    HA   THR   7           HA       THR   7  -8.155  14.373  -9.345
   51    HB   THR   7           HB       THR   7  -6.139  16.444  -9.768
   52    HG1  THR   7           HG1      THR   7  -5.335  14.432  -7.964
   53   1HG2  THR   7          HG21      THR   7  -7.337  15.105  -7.280
   54   2HG2  THR   7          HG22      THR   7  -6.254  16.490  -7.183
   55   3HG2  THR   7          HG23      THR   7  -7.821  16.652  -7.966
   56    HA   PRO   8           HA       PRO   8  -9.142  16.193  -9.432
   57   1HB   PRO   8           HB2      PRO   8 -11.555  16.862 -10.739
   58   2HB   PRO   8           HB1      PRO   8 -10.262  18.000 -10.356
   59   1HG   PRO   8           HG1      PRO   8 -11.063  16.958 -12.975
   60   2HG   PRO   8           HG2      PRO   8  -9.948  18.276 -12.613
   61   1HD   PRO   8           HD1      PRO   8  -9.299  15.566 -13.436
   62   2HD   PRO   8           HD2      PRO   8  -8.181  16.907 -13.109
   63    H    LEU   9           HN       LEU   9 -11.450  15.550  -8.623
   64    HA   LEU   9           HA       LEU   9 -11.711  12.678  -8.970
   65   1HB   LEU   9           HB2      LEU   9 -13.038  14.833  -7.353
   66   2HB   LEU   9           HB1      LEU   9 -13.995  13.388  -7.640
   67    HG   LEU   9           HG       LEU   9 -12.598  13.330  -5.523
   68   1HD1  LEU   9          HD13      LEU   9 -12.530  11.299  -7.716
   69   2HD1  LEU   9          HD11      LEU   9 -11.479  11.024  -6.331
   70   3HD1  LEU   9          HD12      LEU   9 -13.216  11.181  -6.100
   71   1HD2  LEU   9          HD22      LEU   9 -10.619  14.484  -6.671
   72   2HD2  LEU   9          HD23      LEU   9 -10.219  13.092  -5.672
   73   3HD2  LEU   9          HD21      LEU   9 -10.271  12.931  -7.423
   74    H    SER  10           HN       SER  10 -13.230  15.475 -10.320
   75    HA   SER  10           HA       SER  10 -14.843  13.703 -12.091
   76   1HB   SER  10           HB2      SER  10 -15.802  16.005 -10.349
   77   2HB   SER  10           HB1      SER  10 -16.654  15.633 -11.861
   78    HG   SER  10           HG       SER  10 -15.911  13.617 -10.019
   79    H    LEU  11           HN       LEU  11 -15.225  14.564 -14.166
   80    HA   LEU  11           HA       LEU  11 -13.836  17.136 -14.764
   81   1HB   LEU  11           HB2      LEU  11 -12.624  14.788 -15.280
   82   2HB   LEU  11           HB1      LEU  11 -13.636  14.855 -16.712
   83    HG   LEU  11           HG       LEU  11 -12.746  17.315 -16.925
   84   1HD1  LEU  11          HD12      LEU  11 -10.794  16.008 -15.013
   85   2HD1  LEU  11          HD13      LEU  11 -10.327  17.360 -16.039
   86   3HD1  LEU  11          HD11      LEU  11 -11.603  17.563 -14.843
   87   1HD2  LEU  11          HD22      LEU  11 -11.328  14.739 -17.556
   88   2HD2  LEU  11          HD23      LEU  11 -12.099  15.881 -18.654
   89   3HD2  LEU  11          HD21      LEU  11 -10.539  16.265 -17.936
   90    HA   PRO  12           HA       PRO  12 -17.940  17.126 -16.763
   91   1HB   PRO  12           HB2      PRO  12 -18.223  19.912 -16.289
   92   2HB   PRO  12           HB1      PRO  12 -18.929  18.627 -15.303
   93   1HG   PRO  12           HG1      PRO  12 -16.665  20.389 -14.657
   94   2HG   PRO  12           HG2      PRO  12 -17.581  19.328 -13.586
   95   1HD   PRO  12           HD1      PRO  12 -14.947  18.877 -14.624
   96   2HD   PRO  12           HD2      PRO  12 -15.924  17.749 -13.664
   97    H    VAL  13           HN       VAL  13 -17.231  16.949 -18.862
   98    HA   VAL  13           HA       VAL  13 -16.209  19.457 -20.137
   99    HB   VAL  13           HB       VAL  13 -14.815  18.029 -21.615
  100   1HG1  VAL  13          HG11      VAL  13 -14.219  18.651 -19.073
  101   2HG1  VAL  13          HG12      VAL  13 -14.226  16.898 -18.908
  102   3HG1  VAL  13          HG13      VAL  13 -13.139  17.669 -20.058
  103   1HG2  VAL  13          HG23      VAL  13 -16.048  15.758 -20.016
  104   2HG2  VAL  13          HG21      VAL  13 -16.237  16.050 -21.742
  105   3HG2  VAL  13          HG22      VAL  13 -14.672  15.567 -21.096
  106    H    SER  14           HN       SER  14 -16.331  19.046 -22.683
  107    HA   SER  14           HA       SER  14 -19.147  18.173 -23.204
  108   1HB   SER  14           HB2      SER  14 -17.677  20.636 -23.848
  109   2HB   SER  14           HB1      SER  14 -18.344  19.886 -25.311
  110    HG   SER  14           HG       SER  14 -20.034  20.978 -24.454
  111    H    LEU  15           HN       LEU  15 -19.444  17.729 -25.655
  112    HA   LEU  15           HA       LEU  15 -17.444  15.669 -26.340
  113   1HB   LEU  15           HB2      LEU  15 -20.192  16.394 -27.415
  114   2HB   LEU  15           HB1      LEU  15 -19.170  15.179 -28.174
  115    HG   LEU  15           HG       LEU  15 -19.675  15.028 -25.213
  116   1HD1  LEU  15          HD11      LEU  15 -21.889  15.268 -26.486
  117   2HD1  LEU  15          HD12      LEU  15 -21.488  13.745 -27.275
  118   3HD1  LEU  15          HD13      LEU  15 -21.708  13.802 -25.529
  119   1HD2  LEU  15          HD23      LEU  15 -18.034  13.593 -26.676
  120   2HD2  LEU  15          HD21      LEU  15 -19.050  12.780 -25.493
  121   3HD2  LEU  15          HD22      LEU  15 -19.499  12.768 -27.195
  122    H    GLY  16           HN       GLY  16 -15.737  16.991 -26.987
  123   1HA   GLY  16           HA1      GLY  16 -15.085  17.346 -29.560
  124   2HA   GLY  16           HA2      GLY  16 -16.146  18.735 -29.350
  125    H    ASP  17           HN       ASP  17 -15.246  18.977 -26.506
  126    HA   ASP  17           HA       ASP  17 -13.002  20.761 -27.026
  127   1HB   ASP  17           HB2      ASP  17 -14.270  19.844 -24.398
  128   2HB   ASP  17           HB1      ASP  17 -13.177  21.214 -24.574
  129    H    GLN  18           HN       GLN  18 -11.418  20.533 -24.819
  130    HA   GLN  18           HA       GLN  18 -10.122  17.867 -25.241
  131   1HB   GLN  18           HB2      GLN  18  -8.919  20.588 -24.539
  132   2HB   GLN  18           HB1      GLN  18  -7.995  19.091 -24.606
  133   1HG   GLN  18           HG1      GLN  18  -8.796  18.820 -27.006
  134   2HG   GLN  18           HG2      GLN  18  -9.446  20.454 -26.898
  135   1HE2  GLN  18          HE22      GLN  18  -6.273  22.016 -27.117
  136   2HE2  GLN  18          HE21      GLN  18  -7.927  22.233 -26.804
  137    H    ALA  19           HN       ALA  19  -9.576  16.666 -23.501
  138    HA   ALA  19           HA       ALA  19 -10.273  17.795 -20.814
  139   1HB   ALA  19           HB3      ALA  19 -10.925  15.254 -22.183
  140   2HB   ALA  19           HB1      ALA  19 -10.296  15.014 -20.556
  141   3HB   ALA  19           HB2      ALA  19 -11.725  16.010 -20.809
  142    H    SER  20           HN       SER  20  -9.091  16.730 -18.989
  143    HA   SER  20           HA       SER  20  -6.516  15.477 -19.590
  144   1HB   SER  20           HB2      SER  20  -5.248  17.420 -18.421
  145   2HB   SER  20           HB1      SER  20  -5.868  17.799 -20.040
  146    HG   SER  20           HG       SER  20  -7.251  18.240 -17.595
  147    H    ILE  21           HN       ILE  21  -6.918  13.887 -18.159
  148    HA   ILE  21           HA       ILE  21  -7.622  14.633 -15.357
  149    HB   ILE  21           HB       ILE  21  -7.492  11.950 -16.824
  150   1HG1  ILE  21          HG11      ILE  21  -9.934  13.305 -15.663
  151   2HG1  ILE  21          HG12      ILE  21  -9.379  13.671 -17.290
  152   1HG2  ILE  21          HG22      ILE  21  -8.392  12.649 -13.983
  153   2HG2  ILE  21          HG23      ILE  21  -8.562  11.062 -14.725
  154   3HG2  ILE  21          HG21      ILE  21  -6.961  11.711 -14.397
  155   1HD1  ILE  21          HD13      ILE  21  -9.412  11.162 -17.746
  156   2HD1  ILE  21          HD11      ILE  21 -10.244  10.976 -16.205
  157   3HD1  ILE  21          HD12      ILE  21 -10.992  11.898 -17.503
  158    H    SER  22           HN       SER  22  -6.286  14.162 -13.671
  159    HA   SER  22           HA       SER  22  -3.481  13.470 -14.394
  160   1HB   SER  22           HB2      SER  22  -4.513  14.723 -11.791
  161   2HB   SER  22           HB1      SER  22  -2.836  14.690 -12.376
  162    HG   SER  22           HG       SER  22  -5.014  16.194 -13.253
  163    H    CYS  23           HN       CYS  23  -2.399  11.835 -13.448
  164    HA   CYS  23           HA       CYS  23  -3.616  10.322 -11.217
  165   1HB   CYS  23           HB2      CYS  23  -4.553   9.306 -13.279
  166   2HB   CYS  23           HB1      CYS  23  -2.950   9.129 -13.938
  167    NH1  ARG  24           NH2      ARG  24   2.692  14.123  -9.312
  168    NH2  ARG  24           NH1      ARG  24   3.178  12.706  -7.604
  169    H    ARG  24           HN       ARG  24  -1.850  10.837  -9.976
  170    HA   ARG  24           HA       ARG  24   0.803   9.963 -10.979
  171   1HB   ARG  24           HB2      ARG  24   1.492  11.308  -8.777
  172   2HB   ARG  24           HB1      ARG  24   1.142  12.156 -10.276
  173   1HG   ARG  24           HG1      ARG  24  -1.281  12.245  -9.468
  174   2HG   ARG  24           HG2      ARG  24  -0.661  11.770  -7.897
  175   1HD   ARG  24           HD1      ARG  24   0.194  14.220  -9.488
  176   2HD   ARG  24           HD2      ARG  24  -0.826  14.235  -8.053
  177    HE   ARG  24           HE       ARG  24   1.117  13.945  -6.728
  178   1HH1  ARG  24          HH21      ARG  24   2.044  14.747  -9.749
  179   2HH1  ARG  24          HH22      ARG  24   3.581  13.947  -9.733
  180   1HH2  ARG  24          HH11      ARG  24   2.898  12.262  -6.753
  181   2HH2  ARG  24          HH12      ARG  24   4.078  12.512  -8.000
  182    H    SER  25           HN       SER  25   2.289   9.020  -9.413
  183    HA   SER  25           HA       SER  25   0.852   7.280  -7.445
  184   1HB   SER  25           HB2      SER  25   2.519   6.580  -9.703
  185   2HB   SER  25           HB1      SER  25   3.385   6.120  -8.226
  186    HG   SER  25           HG       SER  25   1.457   5.124  -7.505
  187    H    SER  26           HN       SER  26   2.314   6.492  -5.664
  188    HA   SER  26           HA       SER  26   3.545   8.734  -4.368
  189   1HB   SER  26           HB2      SER  26   4.055   5.788  -3.715
  190   2HB   SER  26           HB1      SER  26   4.065   7.161  -2.591
  191    HG   SER  26           HG       SER  26   1.835   7.512  -3.378
  192    H    GLN  27           HN       GLN  27   5.208   5.689  -5.175
  193    HA   GLN  27           HA       GLN  27   7.742   7.176  -5.391
  194   1HB   GLN  27           HB2      GLN  27   7.230   4.744  -4.373
  195   2HB   GLN  27           HB1      GLN  27   7.474   4.240  -6.040
  196   1HG   GLN  27           HG1      GLN  27   9.607   5.942  -5.670
  197   2HG   GLN  27           HG2      GLN  27   9.442   5.233  -4.067
  198   1HE2  GLN  27          HE22      GLN  27  10.286   2.731  -7.222
  199   2HE2  GLN  27          HE21      GLN  27   9.433   4.168  -7.514
  200    H    SER  28           HN       SER  28   9.183   6.802  -7.231
  201    HA   SER  28           HA       SER  28   7.978   7.506  -9.704
  202   1HB   SER  28           HB2      SER  28  10.309   6.820 -10.630
  203   2HB   SER  28           HB1      SER  28  10.353   7.988  -9.295
  204    HG   SER  28           HG       SER  28  10.462   5.157  -9.024
  205    H    LEU  29           HN       LEU  29   7.054   6.341 -11.268
  206    HA   LEU  29           HA       LEU  29   6.875   3.427 -10.921
  207   1HB   LEU  29           HB2      LEU  29   5.693   5.264 -13.053
  208   2HB   LEU  29           HB1      LEU  29   5.255   3.577 -12.813
  209    HG   LEU  29           HG       LEU  29   4.934   5.770 -10.735
  210   1HD1  LEU  29          HD11      LEU  29   3.327   5.051 -12.998
  211   2HD1  LEU  29          HD12      LEU  29   2.470   4.553 -11.543
  212   3HD1  LEU  29          HD13      LEU  29   2.963   6.230 -11.744
  213   1HD2  LEU  29          HD22      LEU  29   4.184   2.831 -10.783
  214   2HD2  LEU  29          HD23      LEU  29   5.264   3.634  -9.649
  215   3HD2  LEU  29          HD21      LEU  29   3.537   3.971  -9.610
  216    H    VAL  30           HN       VAL  30   9.442   4.495 -11.582
  217    HA   VAL  30           HA       VAL  30   9.853   3.647 -14.400
  218    HB   VAL  30           HB       VAL  30  11.755   4.868 -12.335
  219   1HG1  VAL  30          HG13      VAL  30  12.102   4.045 -15.225
  220   2HG1  VAL  30          HG11      VAL  30  13.117   5.289 -14.503
  221   3HG1  VAL  30          HG12      VAL  30  13.128   3.654 -13.849
  222   1HG2  VAL  30          HG21      VAL  30   9.879   6.339 -13.209
  223   2HG2  VAL  30          HG22      VAL  30  11.496   6.929 -13.583
  224   3HG2  VAL  30          HG23      VAL  30  10.545   6.119 -14.824
  225    H    HIS  31           HN       HIS  31  10.197   1.530 -14.700
  226    HA   HIS  31           HA       HIS  31  10.973  -0.249 -12.574
  227   1HB   HIS  31           HB2      HIS  31   9.723  -0.818 -14.769
  228   2HB   HIS  31           HB1      HIS  31  11.296  -0.779 -15.557
  229    HD2  HIS  31           HD2      HIS  31   9.210  -3.044 -13.190
  230    HE1  HIS  31           HE1      HIS  31  12.877  -4.870 -13.747
  231    H    SER  32           HN       SER  32  12.931  -1.730 -12.839
  232    HA   SER  32           HA       SER  32  15.303  -0.185 -12.546
  233   1HB   SER  32           HB2      SER  32  14.875  -2.571 -11.678
  234   2HB   SER  32           HB1      SER  32  15.209  -3.140 -13.325
  235    HG   SER  32           HG       SER  32  17.130  -1.617 -13.059
  236    H    ASN  33           HN       ASN  33  13.747  -1.301 -15.394
  237    HA   ASN  33           HA       ASN  33  16.211  -1.205 -17.007
  238   1HB   ASN  33           HB2      ASN  33  14.447  -1.503 -18.916
  239   2HB   ASN  33           HB1      ASN  33  14.626  -2.832 -17.776
  240   1HD2  ASN  33          HD22      ASN  33  11.243  -2.680 -16.908
  241   2HD2  ASN  33          HD21      ASN  33  12.642  -3.613 -17.130
  242    H    GLY  34           HN       GLY  34  14.131   1.068 -15.773
  243   1HA   GLY  34           HA1      GLY  34  14.434   3.436 -16.135
  244   2HA   GLY  34           HA2      GLY  34  15.116   3.084 -17.717
  245    H    ASN  35           HN       ASN  35  12.696   1.170 -18.036
  246    HA   ASN  35           HA       ASN  35  11.033   3.149 -19.397
  247   1HB   ASN  35           HB2      ASN  35  10.621   0.154 -18.939
  248   2HB   ASN  35           HB1      ASN  35   9.700   1.143 -20.068
  249   1HD2  ASN  35          HD22      ASN  35  12.282   1.257 -22.498
  250   2HD2  ASN  35          HD21      ASN  35  10.813   1.938 -21.991
  251    H    THR  36           HN       THR  36   9.286   4.128 -18.636
  252    HA   THR  36           HA       THR  36   8.382   3.585 -15.911
  253    HB   THR  36           HB       THR  36   6.742   5.378 -17.697
  254    HG1  THR  36           HG1      THR  36   9.519   5.612 -17.165
  255   1HG2  THR  36          HG22      THR  36   8.256   5.687 -15.045
  256   2HG2  THR  36          HG23      THR  36   7.322   6.983 -15.784
  257   3HG2  THR  36          HG21      THR  36   6.513   5.524 -15.220
  258    OH   TYR  37           OH       TYR  37   9.828  -2.657 -18.506
  259    H    TYR  37           HN       TYR  37   6.784   2.233 -15.354
  260    HA   TYR  37           HA       TYR  37   5.047   1.204 -17.551
  261   1HB   TYR  37           HB2      TYR  37   5.731   0.041 -14.815
  262   2HB   TYR  37           HB1      TYR  37   4.611  -0.706 -15.945
  263    HD1  TYR  37           HD1      TYR  37   6.306   0.178 -18.465
  264    HD2  TYR  37           HD2      TYR  37   7.279  -1.853 -14.855
  265    HE1  TYR  37           HE1      TYR  37   8.172  -0.930 -19.591
  266    HE2  TYR  37           HE2      TYR  37   9.142  -2.967 -15.991
  267    HH   TYR  37           HH       TYR  37   9.579  -2.791 -19.424
  268    H    LEU  38           HN       LEU  38   3.321   2.460 -17.660
  269    HA   LEU  38           HA       LEU  38   1.474   2.439 -15.357
  270   1HB   LEU  38           HB2      LEU  38   2.782   4.579 -15.138
  271   2HB   LEU  38           HB1      LEU  38   2.296   5.024 -16.770
  272    HG   LEU  38           HG       LEU  38  -0.026   4.236 -15.200
  273   1HD1  LEU  38          HD12      LEU  38   1.905   6.197 -13.997
  274   2HD1  LEU  38          HD13      LEU  38   0.177   6.478 -13.815
  275   3HD1  LEU  38          HD11      LEU  38   0.898   4.994 -13.197
  276   1HD2  LEU  38          HD23      LEU  38   0.892   6.726 -16.660
  277   2HD2  LEU  38          HD21      LEU  38  -0.308   5.547 -17.178
  278   3HD2  LEU  38          HD22      LEU  38  -0.667   6.640 -15.846
  279    H    ASN  39           HN       ASN  39  -0.491   1.990 -16.047
  280    HA   ASN  39           HA       ASN  39  -1.119   2.516 -18.921
  281   1HB   ASN  39           HB2      ASN  39  -1.490   0.253 -18.988
  282   2HB   ASN  39           HB1      ASN  39  -1.292   0.120 -17.246
  283   1HD2  ASN  39          HD22      ASN  39  -4.964  -0.120 -18.826
  284   2HD2  ASN  39          HD21      ASN  39  -3.551  -0.139 -19.765
  285    CH2  TRP  40           CH2      TRP  40  -5.240   9.314 -16.005
  286    H    TRP  40           HN       TRP  40  -3.415   2.777 -19.397
  287    HA   TRP  40           HA       TRP  40  -4.886   4.165 -17.192
  288   1HB   TRP  40           HB2      TRP  40  -4.350   4.926 -20.078
  289   2HB   TRP  40           HB1      TRP  40  -5.832   5.490 -19.314
  290    HD1  TRP  40           HD1      TRP  40  -1.994   5.882 -19.105
  291    HE1  TRP  40           HE1      TRP  40  -1.605   7.959 -17.717
  292    HE3  TRP  40           HE3      TRP  40  -6.643   6.692 -17.590
  293    HZ2  TRP  40           HZ2      TRP  40  -3.165   9.822 -16.063
  294    HZ3  TRP  40           HZ3      TRP  40  -7.241   8.575 -16.126
  295    HH2  TRP  40           HH2      TRP  40  -5.504  10.146 -15.370
  296    OH   TYR  41           OH       TYR  41  -5.398  -3.088 -18.281
  297    H    TYR  41           HN       TYR  41  -7.248   4.125 -17.458
  298    HA   TYR  41           HA       TYR  41  -8.248   2.050 -19.336
  299   1HB   TYR  41           HB2      TYR  41  -8.290   1.947 -16.313
  300   2HB   TYR  41           HB1      TYR  41  -9.625   1.221 -17.203
  301    HD1  TYR  41           HD1      TYR  41  -8.623  -0.128 -19.428
  302    HD2  TYR  41           HD2      TYR  41  -6.641   0.418 -15.704
  303    HE1  TYR  41           HE1      TYR  41  -7.255  -2.115 -19.864
  304    HE2  TYR  41           HE2      TYR  41  -5.275  -1.573 -16.139
  305    HH   TYR  41           HH       TYR  41  -4.475  -2.822 -18.228
  306    H    LEU  42           HN       LEU  42 -10.401   2.184 -19.837
  307    HA   LEU  42           HA       LEU  42 -11.853   4.555 -18.735
  308   1HB   LEU  42           HB2      LEU  42 -11.112   4.989 -21.059
  309   2HB   LEU  42           HB1      LEU  42 -11.790   3.463 -21.595
  310    HG   LEU  42           HG       LEU  42 -14.051   4.230 -21.132
  311   1HD1  LEU  42          HD13      LEU  42 -12.598   6.531 -19.813
  312   2HD1  LEU  42          HD11      LEU  42 -14.268   6.697 -20.344
  313   3HD1  LEU  42          HD12      LEU  42 -13.846   5.493 -19.131
  314   1HD2  LEU  42          HD22      LEU  42 -12.228   6.004 -22.713
  315   2HD2  LEU  42          HD23      LEU  42 -13.572   5.009 -23.264
  316   3HD2  LEU  42          HD21      LEU  42 -13.884   6.544 -22.460
  317    H    GLN  43           HN       GLN  43 -12.741   3.030 -17.219
  318    HA   GLN  43           HA       GLN  43 -14.414   0.849 -18.230
  319   1HB   GLN  43           HB2      GLN  43 -13.338   1.739 -15.663
  320   2HB   GLN  43           HB1      GLN  43 -15.054   1.382 -15.509
  321   1HG   GLN  43           HG1      GLN  43 -13.048  -0.502 -16.798
  322   2HG   GLN  43           HG2      GLN  43 -13.567  -0.621 -15.120
  323   1HE2  GLN  43          HE22      GLN  43 -16.568  -2.254 -15.930
  324   2HE2  GLN  43          HE21      GLN  43 -15.473  -1.765 -14.728
  325    H    LYS  44           HN       LYS  44 -16.633   0.737 -18.222
  326    HA   LYS  44           HA       LYS  44 -18.077   3.290 -17.658
  327   1HB   LYS  44           HB2      LYS  44 -17.591   2.246 -20.177
  328   2HB   LYS  44           HB1      LYS  44 -19.154   1.543 -19.800
  329   1HG   LYS  44           HG1      LYS  44 -20.183   3.667 -19.547
  330   2HG   LYS  44           HG2      LYS  44 -18.638   4.488 -19.366
  331   1HD   LYS  44           HD1      LYS  44 -19.451   3.064 -21.919
  332   2HD   LYS  44           HD2      LYS  44 -19.762   4.774 -21.640
  333   1HE   LYS  44           HE1      LYS  44 -17.178   4.810 -21.018
  334   2HE   LYS  44           HE2      LYS  44 -17.139   3.361 -22.017
  335   1HZ   LYS  44           HZ1      LYS  44 -17.958   6.094 -22.791
  336   2HZ   LYS  44           HZ2      LYS  44 -16.729   5.131 -23.459
  337    H    ALA  45           HN       ALA  45 -20.508   2.873 -17.558
  338    HA   ALA  45           HA       ALA  45 -21.003   0.915 -15.513
  339   1HB   ALA  45           HB3      ALA  45 -22.289   3.060 -15.791
  340   2HB   ALA  45           HB1      ALA  45 -22.998   2.421 -17.270
  341   3HB   ALA  45           HB2      ALA  45 -23.357   1.663 -15.722
  342    H    GLY  46           HN       GLY  46 -20.548  -1.136 -16.234
  343   1HA   GLY  46           HA1      GLY  46 -21.042  -3.219 -17.200
  344   2HA   GLY  46           HA2      GLY  46 -22.650  -2.584 -17.523
  345    H    GLN  47           HN       GLN  47 -19.422  -1.684 -18.731
  346    HA   GLN  47           HA       GLN  47 -20.329  -2.413 -21.470
  347   1HB   GLN  47           HB2      GLN  47 -20.394   0.178 -20.610
  348   2HB   GLN  47           HB1      GLN  47 -18.723   0.091 -21.147
  349   1HG   GLN  47           HG1      GLN  47 -19.590   0.544 -23.218
  350   2HG   GLN  47           HG2      GLN  47 -20.043  -1.158 -23.226
  351   1HE2  GLN  47          HE22      GLN  47 -23.427  -0.164 -21.937
  352   2HE2  GLN  47          HE21      GLN  47 -22.155  -1.095 -21.309
  353    H    SER  48           HN       SER  48 -18.247  -1.780 -22.964
  354    HA   SER  48           HA       SER  48 -16.108  -3.511 -21.879
  355   1HB   SER  48           HB2      SER  48 -17.114  -3.744 -24.254
  356   2HB   SER  48           HB1      SER  48 -16.241  -2.253 -24.659
  357    HG   SER  48           HG       SER  48 -15.272  -4.782 -24.021
  358    HA   PRO  49           HA       PRO  49 -13.871   0.214 -20.820
  359   1HB   PRO  49           HB2      PRO  49 -11.640  -1.382 -19.948
  360   2HB   PRO  49           HB1      PRO  49 -12.871  -0.636 -18.929
  361   1HG   PRO  49           HG1      PRO  49 -12.537  -3.451 -19.575
  362   2HG   PRO  49           HG2      PRO  49 -13.691  -2.720 -18.459
  363   1HD   PRO  49           HD1      PRO  49 -14.227  -3.823 -21.067
  364   2HD   PRO  49           HD2      PRO  49 -15.378  -3.046 -19.965
  365    H    LYS  50           HN       LYS  50 -12.306   1.360 -21.918
  366    HA   LYS  50           HA       LYS  50 -10.875  -0.137 -24.077
  367   1HB   LYS  50           HB2      LYS  50 -12.587   1.781 -24.594
  368   2HB   LYS  50           HB1      LYS  50 -11.331   2.868 -24.013
  369   1HG   LYS  50           HG1      LYS  50 -10.936   2.743 -26.349
  370   2HG   LYS  50           HG2      LYS  50  -9.762   1.625 -25.667
  371   1HD   LYS  50           HD1      LYS  50 -10.676   0.237 -27.279
  372   2HD   LYS  50           HD2      LYS  50 -11.803  -0.099 -25.970
  373   1HE   LYS  50           HE1      LYS  50 -13.325   1.660 -26.846
  374   2HE   LYS  50           HE2      LYS  50 -12.203   1.959 -28.169
  375   1HZ   LYS  50           HZ1      LYS  50 -13.681  -0.553 -27.621
  376   2HZ   LYS  50           HZ2      LYS  50 -13.911   0.507 -28.929
  377    H    LEU  51           HN       LEU  51  -8.709   0.055 -24.314
  378    HA   LEU  51           HA       LEU  51  -7.264   1.463 -22.119
  379   1HB   LEU  51           HB2      LEU  51  -6.678  -0.901 -22.324
  380   2HB   LEU  51           HB1      LEU  51  -6.478  -0.758 -24.064
  381    HG   LEU  51           HG       LEU  51  -4.526   0.720 -23.747
  382   1HD1  LEU  51          HD11      LEU  51  -5.326   0.440 -20.847
  383   2HD1  LEU  51          HD12      LEU  51  -3.662   0.816 -21.287
  384   3HD1  LEU  51          HD13      LEU  51  -4.963   1.909 -21.746
  385   1HD2  LEU  51          HD22      LEU  51  -4.641  -1.973 -22.430
  386   2HD2  LEU  51          HD23      LEU  51  -3.749  -1.469 -23.862
  387   3HD2  LEU  51          HD21      LEU  51  -3.166  -1.027 -22.260
  388    H    LEU  52           HN       LEU  52  -6.379   3.358 -22.584
  389    HA   LEU  52           HA       LEU  52  -5.882   4.054 -25.435
  390   1HB   LEU  52           HB2      LEU  52  -6.127   5.626 -22.844
  391   2HB   LEU  52           HB1      LEU  52  -5.422   6.372 -24.268
  392    HG   LEU  52           HG       LEU  52  -7.457   6.679 -25.228
  393   1HD1  LEU  52          HD13      LEU  52  -8.194   3.873 -24.324
  394   2HD1  LEU  52          HD11      LEU  52  -9.201   4.892 -25.342
  395   3HD1  LEU  52          HD12      LEU  52  -7.641   4.336 -25.931
  396   1HD2  LEU  52          HD21      LEU  52  -8.399   5.696 -22.516
  397   2HD2  LEU  52          HD22      LEU  52  -7.995   7.357 -22.940
  398   3HD2  LEU  52          HD23      LEU  52  -9.401   6.581 -23.662
  399    H    ILE  53           HN       ILE  53  -4.241   4.554 -22.328
  400    HA   ILE  53           HA       ILE  53  -1.638   4.251 -23.777
  401    HB   ILE  53           HB       ILE  53  -2.234   5.610 -21.124
  402   1HG1  ILE  53          HG11      ILE  53  -3.281   6.778 -23.047
  403   2HG1  ILE  53          HG12      ILE  53  -2.020   7.731 -22.273
  404   1HG2  ILE  53          HG21      ILE  53   0.233   5.192 -22.808
  405   2HG2  ILE  53          HG22      ILE  53   0.110   6.662 -21.846
  406   3HG2  ILE  53          HG23      ILE  53   0.065   5.089 -21.059
  407   1HD1  ILE  53          HD12      ILE  53  -0.410   6.839 -23.991
  408   2HD1  ILE  53          HD13      ILE  53  -1.780   6.103 -24.809
  409   3HD1  ILE  53          HD11      ILE  53  -1.679   7.854 -24.666
  410    OH   TYR  54           OH       TYR  54   3.542   0.880 -26.526
  411    H    TYR  54           HN       TYR  54  -0.347   2.620 -23.175
  412    HA   TYR  54           HA       TYR  54  -1.181   1.060 -20.763
  413   1HB   TYR  54           HB2      TYR  54  -0.017  -0.871 -21.859
  414   2HB   TYR  54           HB1      TYR  54  -1.270  -0.214 -22.907
  415    HD1  TYR  54           HD2      TYR  54  -0.664   1.143 -24.870
  416    HD2  TYR  54           HD1      TYR  54   2.341  -0.607 -22.427
  417    HE1  TYR  54           HE2      TYR  54   0.991   1.516 -26.638
  418    HE2  TYR  54           HE1      TYR  54   3.998  -0.234 -24.196
  419    HH   TYR  54           HH       TYR  54   3.176   0.557 -27.353
  420    H    LYS  55           HN       LYS  55   1.194   3.044 -22.059
  421    HA   LYS  55           HA       LYS  55   2.888   2.657 -19.688
  422   1HB   LYS  55           HB2      LYS  55   3.542   1.573 -22.332
  423   2HB   LYS  55           HB1      LYS  55   4.758   2.732 -21.812
  424   1HG   LYS  55           HG1      LYS  55   5.123   1.517 -19.748
  425   2HG   LYS  55           HG2      LYS  55   3.768   0.445 -20.081
  426   1HD   LYS  55           HD1      LYS  55   5.941  -0.627 -20.648
  427   2HD   LYS  55           HD2      LYS  55   4.927  -0.433 -22.071
  428   1HE   LYS  55           HE1      LYS  55   6.686   1.878 -21.496
  429   2HE   LYS  55           HE2      LYS  55   7.540   0.398 -21.913
  430   1HZ   LYS  55           HZ1      LYS  55   6.441   0.263 -23.962
  431   2HZ   LYS  55           HZ2      LYS  55   5.282   1.430 -23.529
  432    H    VAL  56           HN       VAL  56   2.944   4.651 -19.004
  433    HA   VAL  56           HA       VAL  56   2.978   6.964 -18.940
  434    HB   VAL  56           HB       VAL  56   5.313   6.746 -18.912
  435   1HG1  VAL  56          HG11      VAL  56   5.416   4.875 -20.573
  436   2HG1  VAL  56          HG12      VAL  56   5.319   6.061 -21.868
  437   3HG1  VAL  56          HG13      VAL  56   6.699   6.055 -20.784
  438   1HG2  VAL  56          HG22      VAL  56   4.324   8.930 -20.074
  439   2HG2  VAL  56          HG23      VAL  56   6.061   8.681 -19.940
  440   3HG2  VAL  56          HG21      VAL  56   5.237   8.328 -21.454
  441    H    SER  57           HN       SER  57   3.916   6.633 -22.409
  442    HA   SER  57           HA       SER  57   1.479   8.252 -22.994
  443   1HB   SER  57           HB2      SER  57   3.541   9.736 -22.822
  444   2HB   SER  57           HB1      SER  57   4.219   8.853 -24.203
  445    HG   SER  57           HG       SER  57   1.794  10.319 -24.066
  446    H    ASN  58           HN       ASN  58   3.561   5.699 -24.014
  447    HA   ASN  58           HA       ASN  58   2.927   5.836 -26.823
  448   1HB   ASN  58           HB2      ASN  58   3.240   3.094 -26.219
  449   2HB   ASN  58           HB1      ASN  58   4.507   4.179 -26.768
  450   1HD2  ASN  58          HD22      ASN  58   5.811   4.661 -23.427
  451   2HD2  ASN  58          HD21      ASN  58   5.545   5.516 -24.869
  452    NH1  ARG  59           NH2      ARG  59   1.452   8.652 -28.074
  453    NH2  ARG  59           NH1      ARG  59   0.775  10.812 -28.281
  454    H    ARG  59           HN       ARG  59   0.987   5.755 -27.631
  455    HA   ARG  59           HA       ARG  59  -1.283   4.718 -26.177
  456   1HB   ARG  59           HB2      ARG  59  -0.886   5.637 -29.055
  457   2HB   ARG  59           HB1      ARG  59  -2.455   5.159 -28.416
  458   1HG   ARG  59           HG1      ARG  59  -2.688   7.093 -27.230
  459   2HG   ARG  59           HG2      ARG  59  -1.019   7.055 -26.678
  460   1HD   ARG  59           HD1      ARG  59  -0.573   7.645 -29.270
  461   2HD   ARG  59           HD2      ARG  59  -2.182   8.350 -29.100
  462    HE   ARG  59           HE       ARG  59  -1.247   9.694 -27.186
  463   1HH1  ARG  59          HH21      ARG  59   1.217   7.698 -27.899
  464   2HH1  ARG  59          HH22      ARG  59   2.401   8.911 -28.245
  465   1HH2  ARG  59          HH11      ARG  59   0.031  11.480 -28.261
  466   2HH2  ARG  59          HH12      ARG  59   1.711  11.111 -28.460
  467    H    PHE  60           HN       PHE  60  -2.455   2.894 -26.493
  468    HA   PHE  60           HA       PHE  60  -1.023   0.584 -27.473
  469   1HB   PHE  60           HB2      PHE  60  -2.841   0.722 -25.613
  470   2HB   PHE  60           HB1      PHE  60  -4.017   0.740 -26.924
  471    HD1  PHE  60           HD1      PHE  60  -0.939  -1.190 -25.955
  472    HD2  PHE  60           HD2      PHE  60  -4.883  -1.332 -27.559
  473    HE1  PHE  60           HE1      PHE  60  -0.782  -3.635 -26.134
  474    HE2  PHE  60           HE2      PHE  60  -4.722  -3.776 -27.736
  475    HZ   PHE  60           HZ       PHE  60  -2.673  -4.930 -27.021
  476    H    SER  61           HN       SER  61  -2.310  -0.979 -28.984
  477    HA   SER  61           HA       SER  61  -2.336   0.189 -31.586
  478   1HB   SER  61           HB2      SER  61  -3.464  -2.047 -32.215
  479   2HB   SER  61           HB1      SER  61  -1.964  -2.231 -31.283
  480    HG   SER  61           HG       SER  61  -3.229  -3.243 -29.921
  481    H    GLY  62           HN       GLY  62  -5.066  -0.924 -29.587
  482   1HA   GLY  62           HA1      GLY  62  -7.010   0.237 -31.448
  483   2HA   GLY  62           HA2      GLY  62  -7.387  -0.551 -29.921
  484    H    VAL  63           HN       VAL  63  -5.903   2.422 -31.196
  485    HA   VAL  63           HA       VAL  63  -7.366   3.920 -29.080
  486    HB   VAL  63           HB       VAL  63  -4.419   4.311 -29.793
  487   1HG1  VAL  63          HG11      VAL  63  -6.002   6.290 -28.977
  488   2HG1  VAL  63          HG12      VAL  63  -5.789   5.526 -27.407
  489   3HG1  VAL  63          HG13      VAL  63  -4.388   6.111 -28.301
  490   1HG2  VAL  63          HG21      VAL  63  -5.761   3.144 -27.328
  491   2HG2  VAL  63          HG22      VAL  63  -4.768   2.264 -28.483
  492   3HG2  VAL  63          HG23      VAL  63  -4.042   3.496 -27.458
  493    HA   PRO  64           HA       PRO  64  -8.331   6.302 -32.687
  494   1HB   PRO  64           HB2      PRO  64  -9.615   8.303 -31.052
  495   2HB   PRO  64           HB1      PRO  64 -10.399   7.014 -31.964
  496   1HG   PRO  64           HG1      PRO  64 -10.089   7.219 -29.096
  497   2HG   PRO  64           HG2      PRO  64 -10.894   5.941 -30.005
  498   1HD   PRO  64           HD1      PRO  64  -8.325   5.831 -28.665
  499   2HD   PRO  64           HD2      PRO  64  -9.167   4.530 -29.529
  500    H    ASP  65           HN       ASP  65  -5.978   6.802 -30.725
  501    HA   ASP  65           HA       ASP  65  -4.235   8.322 -30.512
  502   1HB   ASP  65           HB2      ASP  65  -5.475   9.557 -33.011
  503   2HB   ASP  65           HB1      ASP  65  -3.806   9.729 -32.480
  504    NH1  ARG  66           NH2      ARG  66  -9.612  10.074 -33.750
  505    NH2  ARG  66           NH1      ARG  66 -11.834  10.513 -33.968
  506    H    ARG  66           HN       ARG  66  -7.437   9.396 -30.295
  507    HA   ARG  66           HA       ARG  66  -6.837  12.200 -29.809
  508   1HB   ARG  66           HB2      ARG  66  -9.250  10.420 -29.262
  509   2HB   ARG  66           HB1      ARG  66  -9.235  12.132 -28.849
  510   1HG   ARG  66           HG1      ARG  66  -8.897  12.762 -31.159
  511   2HG   ARG  66           HG2      ARG  66  -8.626  11.089 -31.632
  512   1HD   ARG  66           HD1      ARG  66 -11.176  11.495 -30.222
  513   2HD   ARG  66           HD2      ARG  66 -11.066  12.394 -31.733
  514    HE   ARG  66           HE       ARG  66 -11.163   9.477 -31.470
  515   1HH1  ARG  66          HH21      ARG  66  -8.829   9.908 -33.152
  516   2HH1  ARG  66          HH22      ARG  66  -9.492  10.069 -34.741
  517   1HH2  ARG  66          HH11      ARG  66 -12.719  10.678 -33.534
  518   2HH2  ARG  66          HH12      ARG  66 -11.758  10.511 -34.964
  519    H    PHE  67           HN       PHE  67  -5.536   9.938 -28.218
  520    HA   PHE  67           HA       PHE  67  -5.934  11.221 -25.558
  521   1HB   PHE  67           HB2      PHE  67  -5.817   8.222 -26.146
  522   2HB   PHE  67           HB1      PHE  67  -5.801   8.918 -24.526
  523    HD1  PHE  67           HD2      PHE  67  -7.836   8.516 -27.598
  524    HD2  PHE  67           HD1      PHE  67  -7.826   9.758 -23.525
  525    HE1  PHE  67           HE2      PHE  67 -10.288   8.652 -27.630
  526    HE2  PHE  67           HE1      PHE  67 -10.276   9.890 -23.558
  527    HZ   PHE  67           HZ       PHE  67 -11.510   9.331 -25.612
  528    H    SER  68           HN       SER  68  -4.074  11.595 -24.483
  529    HA   SER  68           HA       SER  68  -1.640  10.103 -25.270
  530   1HB   SER  68           HB2      SER  68  -2.120  13.073 -25.670
  531   2HB   SER  68           HB1      SER  68  -0.475  12.490 -25.345
  532    HG   SER  68           HG       SER  68  -2.258  11.713 -27.409
  533    H    GLY  69           HN       GLY  69  -1.435   9.236 -23.257
  534   1HA   GLY  69           HA1      GLY  69  -1.604  10.863 -20.843
  535   2HA   GLY  69           HA2      GLY  69  -1.064   9.186 -20.918
  536    H    SER  70           HN       SER  70   0.189  11.514 -19.532
  537    HA   SER  70           HA       SER  70   2.893  11.026 -20.596
  538   1HB   SER  70           HB2      SER  70   1.446  13.673 -20.804
  539   2HB   SER  70           HB1      SER  70   3.194  13.690 -20.496
  540    HG   SER  70           HG       SER  70   1.886  12.175 -22.519
  541    H    GLY  71           HN       GLY  71   3.963  10.463 -18.864
  542   1HA   GLY  71           HA1      GLY  71   3.964  12.259 -16.515
  543   2HA   GLY  71           HA2      GLY  71   3.524  10.578 -16.233
  544    H    SER  72           HN       SER  72   5.917  12.413 -15.619
  545    HA   SER  72           HA       SER  72   8.110  10.914 -16.904
  546   1HB   SER  72           HB2      SER  72   9.517  12.515 -15.398
  547   2HB   SER  72           HB1      SER  72   8.496  13.311 -16.611
  548    HG   SER  72           HG       SER  72   7.303  14.079 -15.058
  549    H    GLY  73           HN       GLY  73   8.074  11.911 -13.528
  550   1HA   GLY  73           HA1      GLY  73   8.992   9.197 -12.781
  551   2HA   GLY  73           HA2      GLY  73   9.053  10.623 -11.750
  552    H    THR  74           HN       THR  74   6.622  11.546 -11.525
  553    HA   THR  74           HA       THR  74   4.744   9.304 -11.044
  554    HB   THR  74           HB       THR  74   4.354  10.177  -8.666
  555    HG1  THR  74           HG1      THR  74   6.761  11.383  -8.541
  556   1HG2  THR  74          HG21      THR  74   6.085   8.297  -9.202
  557   2HG2  THR  74          HG22      THR  74   7.311   9.559  -9.144
  558   3HG2  THR  74          HG23      THR  74   6.367   9.181  -7.706
  559    H    ASP  75           HN       ASP  75   4.198  10.971 -13.010
  560    HA   ASP  75           HA       ASP  75   1.807  12.350 -12.057
  561   1HB   ASP  75           HB2      ASP  75   3.804  13.995 -11.753
  562   2HB   ASP  75           HB1      ASP  75   3.857  14.064 -13.512
  563    H    PHE  76           HN       PHE  76   1.181  10.583 -13.541
  564    HA   PHE  76           HA       PHE  76   1.558  11.234 -16.410
  565   1HB   PHE  76           HB2      PHE  76   0.043   8.882 -15.186
  566   2HB   PHE  76           HB1      PHE  76   0.693   8.995 -16.819
  567    HD1  PHE  76           HD1      PHE  76   1.707   8.896 -13.222
  568    HD2  PHE  76           HD2      PHE  76   2.940   8.327 -17.263
  569    HE1  PHE  76           HE1      PHE  76   3.849   7.984 -12.445
  570    HE2  PHE  76           HE2      PHE  76   5.074   7.401 -16.476
  571    HZ   PHE  76           HZ       PHE  76   5.528   7.229 -14.066
  572    H    THR  77           HN       THR  77   0.102  12.539 -17.333
  573    HA   THR  77           HA       THR  77  -2.688  12.522 -16.254
  574    HB   THR  77           HB       THR  77  -0.989  14.692 -17.580
  575    HG1  THR  77           HG1      THR  77  -0.859  14.997 -15.491
  576   1HG2  THR  77          HG23      THR  77  -3.873  14.329 -17.841
  577   2HG2  THR  77          HG21      THR  77  -3.584  15.631 -16.694
  578   3HG2  THR  77          HG22      THR  77  -2.929  15.732 -18.323
  579    H    LEU  78           HN       LEU  78  -4.283  11.857 -17.500
  580    HA   LEU  78           HA       LEU  78  -3.723  11.017 -20.267
  581   1HB   LEU  78           HB2      LEU  78  -5.072   9.633 -18.626
  582   2HB   LEU  78           HB1      LEU  78  -6.297  10.889 -18.615
  583    HG   LEU  78           HG       LEU  78  -5.631  10.082 -21.346
  584   1HD1  LEU  78          HD13      LEU  78  -5.139   7.930 -20.164
  585   2HD1  LEU  78          HD11      LEU  78  -6.775   7.958 -19.512
  586   3HD1  LEU  78          HD12      LEU  78  -6.522   7.818 -21.249
  587   1HD2  LEU  78          HD22      LEU  78  -8.095  10.241 -19.604
  588   2HD2  LEU  78          HD23      LEU  78  -7.656  11.269 -20.964
  589   3HD2  LEU  78          HD21      LEU  78  -8.172   9.610 -21.246
  590    H    LYS  79           HN       LYS  79  -3.531  12.919 -21.445
  591    HA   LYS  79           HA       LYS  79  -5.731  14.891 -21.313
  592   1HB   LYS  79           HB2      LYS  79  -3.123  14.802 -22.895
  593   2HB   LYS  79           HB1      LYS  79  -4.263  16.142 -22.961
  594   1HG   LYS  79           HG1      LYS  79  -4.031  16.058 -20.320
  595   2HG   LYS  79           HG2      LYS  79  -2.509  15.253 -20.686
  596   1HD   LYS  79           HD1      LYS  79  -1.592  17.136 -21.689
  597   2HD   LYS  79           HD2      LYS  79  -3.157  17.760 -22.196
  598   1HE   LYS  79           HE1      LYS  79  -3.285  19.043 -20.347
  599   2HE   LYS  79           HE2      LYS  79  -3.088  17.631 -19.317
  600   1HZ   LYS  79           HZ1      LYS  79  -1.214  19.661 -19.936
  601   2HZ   LYS  79           HZ2      LYS  79  -1.108  18.417 -18.782
  602    H    ILE  80           HN       ILE  80  -7.406  14.845 -22.626
  603    HA   ILE  80           HA       ILE  80  -7.294  13.105 -25.035
  604    HB   ILE  80           HB       ILE  80  -9.739  14.444 -23.803
  605   1HG1  ILE  80          HG11      ILE  80  -8.718  11.646 -23.211
  606   2HG1  ILE  80          HG12      ILE  80  -8.496  13.014 -22.131
  607   1HG2  ILE  80          HG23      ILE  80  -9.792  13.410 -26.161
  608   2HG2  ILE  80          HG21      ILE  80  -9.463  11.856 -25.407
  609   3HG2  ILE  80          HG22      ILE  80 -10.955  12.717 -25.038
  610   1HD1  ILE  80          HD12      ILE  80 -11.276  12.508 -23.100
  611   2HD1  ILE  80          HD13      ILE  80 -10.619  11.372 -21.928
  612   3HD1  ILE  80          HD11      ILE  80 -10.722  13.083 -21.532
  613    H    SER  81           HN       SER  81  -7.345  13.842 -26.996
  614    HA   SER  81           HA       SER  81  -7.247  16.720 -27.343
  615   1HB   SER  81           HB2      SER  81  -6.509  16.228 -29.600
  616   2HB   SER  81           HB1      SER  81  -5.849  14.899 -28.627
  617    HG   SER  81           HG       SER  81  -7.704  13.691 -29.129
  618    NH1  ARG  82           NH1      ARG  82 -15.294  14.657 -33.024
  619    NH2  ARG  82           NH2      ARG  82 -16.436  16.050 -31.635
  620    H    ARG  82           HN       ARG  82  -9.578  14.231 -27.694
  621    HA   ARG  82           HA       ARG  82 -11.628  16.210 -28.348
  622   1HB   ARG  82           HB2      ARG  82 -11.284  15.818 -30.617
  623   2HB   ARG  82           HB1      ARG  82 -10.513  14.266 -30.335
  624   1HG   ARG  82           HG1      ARG  82 -12.640  13.912 -31.483
  625   2HG   ARG  82           HG2      ARG  82 -12.761  13.272 -29.853
  626   1HD   ARG  82           HD1      ARG  82 -14.697  14.522 -29.821
  627   2HD   ARG  82           HD2      ARG  82 -13.590  15.834 -29.417
  628    HE   ARG  82           HE       ARG  82 -13.623  16.487 -31.810
  629   1HH1  ARG  82          HH11      ARG  82 -14.425  14.257 -33.306
  630   2HH1  ARG  82          HH12      ARG  82 -16.138  14.404 -33.496
  631   1HH2  ARG  82          HH21      ARG  82 -16.424  16.695 -30.873
  632   2HH2  ARG  82          HH22      ARG  82 -17.298  15.826 -32.088
  633    H    VAL  83           HN       VAL  83 -13.252  15.735 -27.069
  634    HA   VAL  83           HA       VAL  83 -13.510  13.025 -25.942
  635    HB   VAL  83           HB       VAL  83 -14.941  15.676 -25.455
  636   1HG1  VAL  83          HG11      VAL  83 -15.678  12.912 -24.657
  637   2HG1  VAL  83          HG12      VAL  83 -15.668  14.089 -23.349
  638   3HG1  VAL  83          HG13      VAL  83 -16.682  14.354 -24.763
  639   1HG2  VAL  83          HG21      VAL  83 -13.096  13.974 -23.741
  640   2HG2  VAL  83          HG22      VAL  83 -12.640  15.461 -24.568
  641   3HG2  VAL  83          HG23      VAL  83 -13.814  15.507 -23.257
  642    H    GLU  84           HN       GLU  84 -14.760  11.534 -26.810
  643    HA   GLU  84           HA       GLU  84 -16.970  12.398 -28.629
  644   1HB   GLU  84           HB2      GLU  84 -15.212   9.924 -28.468
  645   2HB   GLU  84           HB1      GLU  84 -16.753   9.856 -29.315
  646   1HG   GLU  84           HG1      GLU  84 -14.632  11.949 -29.899
  647   2HG   GLU  84           HG2      GLU  84 -14.759  10.433 -30.786
  648    H    ALA  85           HN       ALA  85 -18.824  10.743 -28.663
  649    HA   ALA  85           HA       ALA  85 -20.041  10.707 -26.089
  650   1HB   ALA  85           HB3      ALA  85 -20.584   9.157 -28.660
  651   2HB   ALA  85           HB1      ALA  85 -21.615   8.993 -27.242
  652   3HB   ALA  85           HB2      ALA  85 -21.460  10.555 -28.041
  653    H    GLU  86           HN       GLU  86 -18.062   8.333 -27.755
  654    HA   GLU  86           HA       GLU  86 -18.587   6.272 -25.726
  655   1HB   GLU  86           HB2      GLU  86 -16.921   4.949 -27.046
  656   2HB   GLU  86           HB1      GLU  86 -18.168   5.621 -28.087
  657   1HG   GLU  86           HG1      GLU  86 -16.722   7.156 -29.064
  658   2HG   GLU  86           HG2      GLU  86 -15.692   7.257 -27.639
  659    H    ASP  87           HN       ASP  87 -16.753   9.000 -25.764
  660    HA   ASP  87           HA       ASP  87 -14.429   7.869 -24.332
  661   1HB   ASP  87           HB2      ASP  87 -13.844   9.707 -25.761
  662   2HB   ASP  87           HB1      ASP  87 -15.256  10.638 -25.281
  663    H    LEU  88           HN       LEU  88 -17.507   9.175 -23.668
  664    HA   LEU  88           HA       LEU  88 -16.946  10.193 -21.008
  665   1HB   LEU  88           HB2      LEU  88 -19.621   9.199 -22.088
  666   2HB   LEU  88           HB1      LEU  88 -19.368  10.391 -20.820
  667    HG   LEU  88           HG       LEU  88 -18.330  10.845 -23.628
  668   1HD1  LEU  88          HD13      LEU  88 -20.828  10.379 -23.604
  669   2HD1  LEU  88          HD11      LEU  88 -21.007  11.769 -22.540
  670   3HD1  LEU  88          HD12      LEU  88 -20.390  11.985 -24.174
  671   1HD2  LEU  88          HD21      LEU  88 -19.070  12.663 -21.306
  672   2HD2  LEU  88          HD22      LEU  88 -17.441  12.305 -21.866
  673   3HD2  LEU  88          HD23      LEU  88 -18.540  13.229 -22.885
  674    H    GLY  89           HN       GLY  89 -17.135   9.207 -19.073
  675   1HA   GLY  89           HA1      GLY  89 -18.456   6.997 -18.191
  676   2HA   GLY  89           HA2      GLY  89 -17.096   6.271 -19.044
  677    H    ILE  90           HN       ILE  90 -15.946   5.493 -17.345
  678    HA   ILE  90           HA       ILE  90 -15.046   7.485 -15.301
  679    HB   ILE  90           HB       ILE  90 -15.713   4.527 -15.167
  680   1HG1  ILE  90          HG11      ILE  90 -16.681   5.382 -12.936
  681   2HG1  ILE  90          HG12      ILE  90 -16.361   7.001 -13.543
  682   1HG2  ILE  90          HG22      ILE  90 -13.714   6.084 -13.489
  683   2HG2  ILE  90          HG23      ILE  90 -14.593   4.727 -12.792
  684   3HG2  ILE  90          HG21      ILE  90 -13.536   4.471 -14.176
  685   1HD1  ILE  90          HD11      ILE  90 -17.796   5.122 -15.374
  686   2HD1  ILE  90          HD12      ILE  90 -18.697   5.752 -13.999
  687   3HD1  ILE  90          HD13      ILE  90 -17.996   6.860 -15.172
  688    OH   TYR  91           OH       TYR  91 -10.950   7.982 -22.687
  689    H    TYR  91           HN       TYR  91 -13.041   8.116 -15.728
  690    HA   TYR  91           HA       TYR  91 -11.203   6.304 -17.177
  691   1HB   TYR  91           HB2      TYR  91 -11.445   9.229 -16.698
  692   2HB   TYR  91           HB1      TYR  91  -9.786   8.637 -16.682
  693    HD1  TYR  91           HD1      TYR  91  -9.266   6.872 -18.643
  694    HD2  TYR  91           HD2      TYR  91 -12.348   9.802 -18.792
  695    HE1  TYR  91           HE1      TYR  91  -9.322   6.695 -21.082
  696    HE2  TYR  91           HE2      TYR  91 -12.397   9.615 -21.242
  697    HH   TYR  91           HH       TYR  91 -11.721   8.469 -22.999
  698    H    PHE  92           HN       PHE  92 -10.056   4.932 -16.018
  699    HA   PHE  92           HA       PHE  92  -8.928   5.850 -13.393
  700   1HB   PHE  92           HB2      PHE  92 -10.195   3.278 -14.292
  701   2HB   PHE  92           HB1      PHE  92  -8.804   3.133 -13.226
  702    HD1  PHE  92           HD1      PHE  92 -11.705   5.511 -13.383
  703    HD2  PHE  92           HD2      PHE  92  -9.450   2.777 -11.026
  704    HE1  PHE  92           HE1      PHE  92 -13.144   5.986 -11.448
  705    HE2  PHE  92           HE2      PHE  92 -10.890   3.253  -9.095
  706    HZ   PHE  92           HZ       PHE  92 -12.740   4.856  -9.304
  707    H    CYS  93           HN       CYS  93  -7.068   4.153 -12.848
  708    HA   CYS  93           HA       CYS  93  -5.399   3.541 -15.199
  709   1HB   CYS  93           HB2      CYS  93  -3.540   4.865 -13.664
  710   2HB   CYS  93           HB1      CYS  93  -4.332   5.550 -15.057
  711    H    SER  94           HN       SER  94  -3.100   2.815 -14.238
  712    HA   SER  94           HA       SER  94  -3.105   1.614 -11.612
  713   1HB   SER  94           HB2      SER  94  -3.263  -0.795 -12.389
  714   2HB   SER  94           HB1      SER  94  -4.769   0.084 -12.706
  715    HG   SER  94           HG       SER  94  -3.043   0.531 -14.702
  716    H    GLN  95           HN       GLN  95  -1.095   0.781 -11.070
  717    HA   GLN  95           HA       GLN  95   0.974   1.071 -13.218
  718   1HB   GLN  95           HB2      GLN  95   2.561   1.443 -11.304
  719   2HB   GLN  95           HB1      GLN  95   1.248   2.615 -11.288
  720   1HG   GLN  95           HG1      GLN  95   0.098   1.446  -9.535
  721   2HG   GLN  95           HG2      GLN  95   1.126   0.028  -9.708
  722   1HE2  GLN  95          HE22      GLN  95   2.201   2.801  -7.098
  723   2HE2  GLN  95          HE21      GLN  95   0.636   2.611  -7.723
  724    H    THR  96           HN       THR  96   2.756  -0.396 -13.202
  725    HA   THR  96           HA       THR  96   2.205  -2.984 -11.815
  726    HB   THR  96           HB       THR  96   2.805  -4.199 -13.918
  727    HG1  THR  96           HG1      THR  96   4.092  -3.042 -15.118
  728   1HG2  THR  96          HG22      THR  96   0.405  -3.162 -13.724
  729   2HG2  THR  96          HG23      THR  96   1.010  -1.861 -14.744
  730   3HG2  THR  96          HG21      THR  96   0.957  -3.510 -15.358
  731    H    THR  97           HN       THR  97   4.216  -0.573 -11.730
  732    HA   THR  97           HA       THR  97   6.782  -1.862 -12.231
  733    HB   THR  97           HB       THR  97   7.241   0.302 -10.446
  734    HG1  THR  97           HG1      THR  97   5.685   1.729 -11.833
  735   1HG2  THR  97          HG22      THR  97   7.937  -0.293 -13.049
  736   2HG2  THR  97          HG23      THR  97   6.747   0.971 -13.336
  737   3HG2  THR  97          HG21      THR  97   8.170   1.307 -12.357
  738    H    HIS  98           HN       HIS  98   4.746  -1.303  -9.418
  739    HA   HIS  98           HA       HIS  98   6.690  -2.878  -7.783
  740   1HB   HIS  98           HB2      HIS  98   4.446  -0.983  -6.931
  741   2HB   HIS  98           HB1      HIS  98   5.532  -1.822  -5.826
  742    HD2  HIS  98           HD2      HIS  98   5.746   0.943  -8.643
  743    HE1  HIS  98           HE1      HIS  98   9.100   1.211  -6.240
  744    H    VAL  99           HN       VAL  99   5.750  -4.319  -6.169
  745    HA   VAL  99           HA       VAL  99   3.140  -5.465  -7.050
  746    HB   VAL  99           HB       VAL  99   5.162  -6.798  -7.805
  747   1HG1  VAL  99          HG11      VAL  99   6.493  -6.167  -5.709
  748   2HG1  VAL  99          HG12      VAL  99   5.559  -7.396  -4.862
  749   3HG1  VAL  99          HG13      VAL  99   6.599  -7.852  -6.206
  750   1HG2  VAL  99          HG21      VAL  99   3.350  -8.090  -5.737
  751   2HG2  VAL  99          HG22      VAL  99   3.059  -7.985  -7.471
  752   3HG2  VAL  99          HG23      VAL  99   4.369  -8.987  -6.857
  753    HA   PRO 100           HA       PRO 100   1.702  -6.875  -6.427
  754   1HB   PRO 100           HB2      PRO 100  -0.747  -6.000  -5.225
  755   2HB   PRO 100           HB1      PRO 100  -0.088  -7.636  -5.196
  756   1HG   PRO 100           HG1      PRO 100  -0.251  -5.727  -3.009
  757   2HG   PRO 100           HG2      PRO 100   0.297  -7.402  -2.953
  758   1HD   PRO 100           HD1      PRO 100   1.908  -5.005  -2.834
  759   2HD   PRO 100           HD2      PRO 100   2.457  -6.689  -2.760
  760    HA   PRO 101           HA       PRO 101   0.937  -3.255  -8.758
  761   1HB   PRO 101           HB2      PRO 101  -1.512  -4.219  -9.976
  762   2HB   PRO 101           HB1      PRO 101   0.104  -4.223 -10.679
  763   1HG   PRO 101           HG1      PRO 101  -1.408  -6.485  -9.688
  764   2HG   PRO 101           HG2      PRO 101   0.191  -6.496 -10.433
  765   1HD   PRO 101           HD1      PRO 101  -0.455  -6.905  -7.654
  766   2HD   PRO 101           HD2      PRO 101   1.155  -6.877  -8.398
  767    H    THR 102           HN       THR 102   0.137  -1.426  -7.884
  768    HA   THR 102           HA       THR 102  -2.364  -1.575  -6.304
  769    HB   THR 102           HB       THR 102  -1.694   0.792  -5.615
  770    HG1  THR 102           HG1      THR 102   0.671   0.979  -6.520
  771   1HG2  THR 102          HG21      THR 102   0.498  -1.358  -5.570
  772   2HG2  THR 102          HG22      THR 102   0.641   0.163  -4.696
  773   3HG2  THR 102          HG23      THR 102  -0.622  -0.984  -4.264
  774    H    PHE 103           HN       PHE 103  -4.247  -0.723  -6.916
  775    HA   PHE 103           HA       PHE 103  -4.752  -0.068  -9.631
  776   1HB   PHE 103           HB2      PHE 103  -6.240  -0.187  -7.124
  777   2HB   PHE 103           HB1      PHE 103  -6.716   1.253  -8.019
  778    HD1  PHE 103           HD1      PHE 103  -5.799  -2.279  -8.929
  779    HD2  PHE 103           HD2      PHE 103  -8.592   0.908  -9.366
  780    HE1  PHE 103           HE1      PHE 103  -7.148  -3.666 -10.442
  781    HE2  PHE 103           HE2      PHE 103  -9.940  -0.484 -10.876
  782    HZ   PHE 103           HZ       PHE 103  -9.218  -2.770 -11.417
  783    H    GLY 104           HN       GLY 104  -4.823   1.775 -10.745
  784   1HA   GLY 104           HA1      GLY 104  -3.299   4.026  -9.765
  785   2HA   GLY 104           HA2      GLY 104  -4.107   3.941 -11.318
  786    H    GLY 105           HN       GLY 105  -4.705   6.145 -10.935
  787   1HA   GLY 105           HA1      GLY 105  -6.441   6.876  -8.739
  788   2HA   GLY 105           HA2      GLY 105  -6.133   7.835 -10.178
  789    H    GLY 106           HN       GLY 106  -8.385   8.366 -10.175
  790   1HA   GLY 106           HA1      GLY 106  -9.950   6.803 -11.964
  791   2HA   GLY 106           HA2      GLY 106 -10.512   6.503 -10.324
  792    H    THR 107           HN       THR 107 -10.455   8.707 -12.948
  793    HA   THR 107           HA       THR 107 -11.900  10.772 -11.338
  794    HB   THR 107           HB       THR 107 -10.429  10.886 -14.033
  795    HG1  THR 107           HG1      THR 107  -9.727  12.645 -12.167
  796   1HG2  THR 107          HG22      THR 107 -12.132  12.928 -12.514
  797   2HG2  THR 107          HG23      THR 107 -10.818  13.457 -13.561
  798   3HG2  THR 107          HG21      THR 107 -12.183  12.570 -14.237
  799    H    LYS 108           HN       LYS 108 -13.929  11.456 -11.965
  800    HA   LYS 108           HA       LYS 108 -15.375   9.607 -13.753
  801   1HB   LYS 108           HB2      LYS 108 -16.136  10.625 -11.416
  802   2HB   LYS 108           HB1      LYS 108 -16.632  12.000 -12.394
  803   1HG   LYS 108           HG1      LYS 108 -17.425   9.297 -13.384
  804   2HG   LYS 108           HG2      LYS 108 -18.250   9.882 -11.944
  805   1HD   LYS 108           HD1      LYS 108 -17.978  11.918 -14.062
  806   2HD   LYS 108           HD2      LYS 108 -18.949  10.531 -14.535
  807   1HE   LYS 108           HE1      LYS 108 -19.365  11.991 -11.915
  808   2HE   LYS 108           HE2      LYS 108 -20.218  12.433 -13.388
  809   1HZ   LYS 108           HZ1      LYS 108 -21.607  10.758 -13.121
  810   2HZ   LYS 108           HZ2      LYS 108 -20.345   9.636 -12.956
  811    H    LEU 109           HN       LEU 109 -16.088  10.075 -15.735
  812    HA   LEU 109           HA       LEU 109 -15.903  12.909 -16.688
  813   1HB   LEU 109           HB2      LEU 109 -14.035  11.203 -17.442
  814   2HB   LEU 109           HB1      LEU 109 -15.296  10.504 -18.451
  815    HG   LEU 109           HG       LEU 109 -15.603  13.167 -19.023
  816   1HD1  LEU 109          HD13      LEU 109 -13.211  13.119 -17.617
  817   2HD1  LEU 109          HD11      LEU 109 -12.676  13.030 -19.292
  818   3HD1  LEU 109          HD12      LEU 109 -13.690  14.369 -18.762
  819   1HD2  LEU 109          HD22      LEU 109 -13.913  11.004 -20.293
  820   2HD2  LEU 109          HD23      LEU 109 -15.507  11.570 -20.778
  821   3HD2  LEU 109          HD21      LEU 109 -14.095  12.583 -21.049
  822    H    GLU 110           HN       GLU 110 -18.179  13.120 -16.458
  823    HA   GLU 110           HA       GLU 110 -19.717  11.559 -18.502
  824   1HB   GLU 110           HB2      GLU 110 -20.308  12.144 -15.607
  825   2HB   GLU 110           HB1      GLU 110 -21.667  12.092 -16.722
  826   1HG   GLU 110           HG1      GLU 110 -21.153   9.835 -17.384
  827   2HG   GLU 110           HG2      GLU 110 -19.594   9.883 -16.565
  828    H    ILE 111           HN       ILE 111 -18.787  13.738 -19.486
  829    HA   ILE 111           HA       ILE 111 -19.340  15.781 -20.474
  830    HB   ILE 111           HB       ILE 111 -22.142  14.996 -19.560
  831   1HG1  ILE 111          HG11      ILE 111 -20.927  13.322 -21.021
  832   2HG1  ILE 111          HG12      ILE 111 -22.452  13.924 -21.656
  833   1HG2  ILE 111          HG21      ILE 111 -21.049  17.053 -21.499
  834   2HG2  ILE 111          HG22      ILE 111 -22.688  16.435 -21.675
  835   3HG2  ILE 111          HG23      ILE 111 -22.226  17.297 -20.208
  836   1HD1  ILE 111          HD13      ILE 111 -19.766  15.124 -22.362
  837   2HD1  ILE 111          HD11      ILE 111 -20.567  13.898 -23.342
  838   3HD1  ILE 111          HD12      ILE 111 -21.317  15.475 -23.111
  839    H    LYS 112           HN       LYS 112 -20.164  17.985 -20.006
  840    HA   LYS 112           HA       LYS 112 -19.740  18.552 -17.167
  841   1HB   LYS 112           HB2      LYS 112 -19.432  20.839 -17.832
  842   2HB   LYS 112           HB1      LYS 112 -18.683  19.878 -19.101
  843   1HG   LYS 112           HG1      LYS 112 -21.125  19.950 -20.105
  844   2HG   LYS 112           HG2      LYS 112 -21.236  21.407 -19.134
  845   1HD   LYS 112           HD1      LYS 112 -18.743  21.144 -20.725
  846   2HD   LYS 112           HD2      LYS 112 -20.209  21.345 -21.676
  847   1HE   LYS 112           HE1      LYS 112 -19.382  23.557 -21.217
  848   2HE   LYS 112           HE2      LYS 112 -20.783  23.322 -20.179
  849   1HZ   LYS 112           HZ1      LYS 112 -19.077  22.521 -18.474
  850   2HZ   LYS 112           HZ2      LYS 112 -17.924  23.289 -19.459
  851    NH1  ARG 113           NH2      ARG 113 -22.783  15.909 -12.818
  852    NH2  ARG 113           NH1      ARG 113 -23.594  13.797 -13.039
  853    H    ARG 113           HN       ARG 113 -21.404  18.252 -15.907
  854    HA   ARG 113           HA       ARG 113 -23.845  19.796 -16.422
  855   1HB   ARG 113           HB2      ARG 113 -25.341  17.948 -16.513
  856   2HB   ARG 113           HB1      ARG 113 -23.988  17.394 -17.487
  857   1HG   ARG 113           HG1      ARG 113 -24.334  16.765 -14.532
  858   2HG   ARG 113           HG2      ARG 113 -24.792  15.678 -15.834
  859   1HD   ARG 113           HD1      ARG 113 -22.445  15.669 -16.648
  860   2HD   ARG 113           HD2      ARG 113 -21.987  16.731 -15.322
  861    HE   ARG 113           HE       ARG 113 -22.069  13.965 -15.060
  862   1HH1  ARG 113          HH21      ARG 113 -22.300  16.686 -13.223
  863   2HH1  ARG 113          HH22      ARG 113 -23.124  15.965 -11.881
  864   1HH2  ARG 113          HH11      ARG 113 -23.721  12.984 -13.606
  865   2HH2  ARG 113          HH12      ARG 113 -23.950  13.816 -12.106
   
  Start of MODEL          15
 Raw file had  865 H/Q atoms
  Start of MODEL   15
    1   1H    ASP   1           HT3      ASP   1   0.895   1.657  -0.192
    2   2H    ASP   1           HT1      ASP   1   0.594   1.601  -1.865
    3   3H    ASP   1           HT2      ASP   1  -0.039   0.396  -0.847
    4    HA   ASP   1           HA       ASP   1   2.174  -0.382  -0.333
    5   1HB   ASP   1           HB2      ASP   1   2.545  -0.316  -3.230
    6   2HB   ASP   1           HB1      ASP   1   2.100  -1.687  -2.218
    7    H    VAL   2           HN       VAL   2   4.312  -0.179  -0.352
    8    HA   VAL   2           HA       VAL   2   5.285   2.371  -1.502
    9    HB   VAL   2           HB       VAL   2   6.189   0.967   1.048
   10   1HG1  VAL   2          HG11      VAL   2   7.188   3.370  -0.453
   11   2HG1  VAL   2          HG12      VAL   2   7.301   3.348   1.304
   12   3HG1  VAL   2          HG13      VAL   2   8.108   2.104   0.353
   13   1HG2  VAL   2          HG22      VAL   2   4.486   3.419   0.529
   14   2HG2  VAL   2          HG23      VAL   2   4.049   1.981   1.444
   15   3HG2  VAL   2          HG21      VAL   2   5.240   3.106   2.089
   16    H    VAL   3           HN       VAL   3   7.046   2.272  -2.803
   17    HA   VAL   3           HA       VAL   3   8.049  -0.310  -3.622
   18    HB   VAL   3           HB       VAL   3   9.127   2.514  -4.106
   19   1HG1  VAL   3          HG11      VAL   3   9.840  -0.165  -5.339
   20   2HG1  VAL   3          HG12      VAL   3  10.242   1.373  -6.096
   21   3HG1  VAL   3          HG13      VAL   3  10.923   0.961  -4.525
   22   1HG2  VAL   3          HG23      VAL   3   6.813   2.019  -4.969
   23   2HG2  VAL   3          HG21      VAL   3   7.973   2.355  -6.250
   24   3HG2  VAL   3          HG22      VAL   3   7.493   0.695  -5.909
   25    H    MET   4           HN       MET   4   9.960  -1.335  -3.104
   26    HA   MET   4           HA       MET   4  11.668  -0.005  -1.052
   27   1HB   MET   4           HB2      MET   4  10.160  -2.586  -0.912
   28   2HB   MET   4           HB1      MET   4  11.793  -2.610  -0.253
   29   1HG   MET   4           HG1      MET   4  11.263  -0.638   1.120
   30   2HG   MET   4           HG2      MET   4   9.648  -0.604   0.466
   31   1HE   MET   4           HE2      MET   4  10.918  -0.445   3.257
   32   2HE   MET   4           HE3      MET   4  10.446  -1.718   4.382
   33   3HE   MET   4           HE1      MET   4  11.884  -1.913   3.383
   34    H    THR   5           HN       THR   5  13.500   0.293  -2.130
   35    HA   THR   5           HA       THR   5  14.561  -1.902  -3.839
   36    HB   THR   5           HB       THR   5  15.258   1.071  -3.522
   37    HG1  THR   5           HG1      THR   5  14.573  -0.565  -5.741
   38   1HG2  THR   5          HG21      THR   5  16.630  -1.127  -5.174
   39   2HG2  THR   5          HG22      THR   5  16.877   0.596  -5.440
   40   3HG2  THR   5          HG23      THR   5  17.408  -0.147  -3.935
   41    H    GLN   6           HN       GLN   6  15.799  -3.336  -2.772
   42    HA   GLN   6           HA       GLN   6  17.362  -2.388  -0.441
   43   1HB   GLN   6           HB2      GLN   6  15.893  -4.584  -0.598
   44   2HB   GLN   6           HB1      GLN   6  17.317  -5.256  -1.385
   45   1HG   GLN   6           HG1      GLN   6  18.706  -4.647   0.546
   46   2HG   GLN   6           HG2      GLN   6  17.331  -3.870   1.321
   47   1HE2  GLN   6          HE22      GLN   6  17.517  -7.962   1.220
   48   2HE2  GLN   6          HE21      GLN   6  18.444  -7.056   0.124
   49    H    THR   7           HN       THR   7  19.543  -2.725  -0.203
   50    HA   THR   7           HA       THR   7  21.191  -3.784  -2.367
   51    HB   THR   7           HB       THR   7  22.202  -1.087  -1.940
   52    HG1  THR   7           HG1      THR   7  19.825  -0.994  -1.361
   53   1HG2  THR   7          HG21      THR   7  21.186  -2.789  -4.183
   54   2HG2  THR   7          HG22      THR   7  20.907  -1.068  -4.422
   55   3HG2  THR   7          HG23      THR   7  22.544  -1.668  -4.186
   56    HA   PRO   8           HA       PRO   8  23.445  -3.098  -2.885
   57   1HB   PRO   8           HB2      PRO   8  25.504  -5.048  -2.489
   58   2HB   PRO   8           HB1      PRO   8  25.727  -3.306  -2.644
   59   1HG   PRO   8           HG1      PRO   8  26.013  -4.942  -0.265
   60   2HG   PRO   8           HG2      PRO   8  26.335  -3.218  -0.443
   61   1HD   PRO   8           HD1      PRO   8  24.076  -4.482   0.875
   62   2HD   PRO   8           HD2      PRO   8  24.437  -2.750   0.740
   63    H    LEU   9           HN       LEU   9  23.907  -5.033  -4.432
   64    HA   LEU   9           HA       LEU   9  21.730  -6.951  -4.006
   65   1HB   LEU   9           HB2      LEU   9  23.758  -6.774  -6.284
   66   2HB   LEU   9           HB1      LEU   9  22.223  -7.634  -6.323
   67    HG   LEU   9           HG       LEU   9  22.494  -4.636  -5.893
   68   1HD1  LEU   9          HD13      LEU   9  23.189  -5.326  -8.174
   69   2HD1  LEU   9          HD11      LEU   9  21.671  -6.197  -8.367
   70   3HD1  LEU   9          HD12      LEU   9  21.667  -4.443  -8.210
   71   1HD2  LEU   9          HD21      LEU   9  20.152  -6.528  -6.239
   72   2HD2  LEU   9          HD22      LEU   9  20.449  -5.406  -4.914
   73   3HD2  LEU   9          HD23      LEU   9  20.002  -4.793  -6.503
   74    H    SER  10           HN       SER  10  25.076  -6.859  -3.432
   75    HA   SER  10           HA       SER  10  25.031  -9.740  -2.720
   76   1HB   SER  10           HB2      SER  10  26.857  -8.404  -4.744
   77   2HB   SER  10           HB1      SER  10  27.481  -9.757  -3.781
   78    HG   SER  10           HG       SER  10  25.299  -9.676  -5.561
   79    H    LEU  11           HN       LEU  11  26.089 -10.152  -0.865
   80    HA   LEU  11           HA       LEU  11  27.904  -8.031   0.210
   81   1HB   LEU  11           HB2      LEU  11  25.386  -8.524   1.160
   82   2HB   LEU  11           HB1      LEU  11  26.292  -9.679   2.121
   83    HG   LEU  11           HG       LEU  11  27.894  -7.443   2.293
   84   1HD1  LEU  11          HD11      LEU  11  25.734  -6.367   1.117
   85   2HD1  LEU  11          HD12      LEU  11  25.163  -6.320   2.781
   86   3HD1  LEU  11          HD13      LEU  11  26.650  -5.488   2.337
   87   1HD2  LEU  11          HD21      LEU  11  25.576  -8.234   4.094
   88   2HD2  LEU  11          HD22      LEU  11  27.204  -8.906   4.156
   89   3HD2  LEU  11          HD23      LEU  11  26.932  -7.217   4.573
   90    HA   PRO  12           HA       PRO  12  29.956 -12.198   0.242
   91   1HB   PRO  12           HB2      PRO  12  32.357 -10.957  -0.736
   92   2HB   PRO  12           HB1      PRO  12  31.272 -12.015  -1.638
   93   1HG   PRO  12           HG1      PRO  12  31.623  -9.143  -1.916
   94   2HG   PRO  12           HG2      PRO  12  30.633 -10.221  -2.900
   95   1HD   PRO  12           HD1      PRO  12  29.735  -8.315  -0.933
   96   2HD   PRO  12           HD2      PRO  12  28.744  -9.424  -1.898
   97    H    VAL  13           HN       VAL  13  30.323 -12.424   2.396
   98    HA   VAL  13           HA       VAL  13  32.643 -10.953   3.548
   99    HB   VAL  13           HB       VAL  13  31.402 -10.417   5.587
  100   1HG1  VAL  13          HG11      VAL  13  31.070  -8.959   3.502
  101   2HG1  VAL  13          HG12      VAL  13  29.510  -9.753   3.316
  102   3HG1  VAL  13          HG13      VAL  13  29.846  -8.799   4.757
  103   1HG2  VAL  13          HG22      VAL  13  29.152 -12.009   4.303
  104   2HG2  VAL  13          HG23      VAL  13  30.032 -12.428   5.770
  105   3HG2  VAL  13          HG21      VAL  13  28.959 -11.031   5.754
  106    H    SER  14           HN       SER  14  33.105 -11.875   5.824
  107    HA   SER  14           HA       SER  14  33.110 -14.838   5.539
  108   1HB   SER  14           HB2      SER  14  35.182 -14.786   6.649
  109   2HB   SER  14           HB1      SER  14  35.185 -13.092   6.129
  110    HG   SER  14           HG       SER  14  34.751 -12.483   8.103
  111    H    LEU  15           HN       LEU  15  32.768 -16.111   7.538
  112    HA   LEU  15           HA       LEU  15  30.378 -15.163   8.882
  113   1HB   LEU  15           HB2      LEU  15  32.101 -17.614   9.472
  114   2HB   LEU  15           HB1      LEU  15  30.454 -17.348  10.036
  115    HG   LEU  15           HG       LEU  15  31.382 -17.720   7.170
  116   1HD1  LEU  15          HD11      LEU  15  29.499 -19.215   9.014
  117   2HD1  LEU  15          HD12      LEU  15  29.629 -19.537   7.289
  118   3HD1  LEU  15          HD13      LEU  15  31.015 -19.804   8.340
  119   1HD2  LEU  15          HD21      LEU  15  28.860 -16.540   8.305
  120   2HD2  LEU  15          HD22      LEU  15  29.751 -16.073   6.860
  121   3HD2  LEU  15          HD23      LEU  15  28.754 -17.524   6.850
  122    H    GLY  16           HN       GLY  16  31.023 -13.346   9.925
  123   1HA   GLY  16           HA1      GLY  16  31.423 -13.262  12.593
  124   2HA   GLY  16           HA2      GLY  16  33.082 -13.484  12.034
  125    H    ASP  17           HN       ASP  17  32.326 -11.963   9.529
  126    HA   ASP  17           HA       ASP  17  33.166  -9.356  10.465
  127   1HB   ASP  17           HB2      ASP  17  32.017 -10.220   7.762
  128   2HB   ASP  17           HB1      ASP  17  32.869  -8.711   8.063
  129    H    GLN  18           HN       GLN  18  31.909  -7.364   9.715
  130    HA   GLN  18           HA       GLN  18  29.150  -7.664  10.757
  131   1HB   GLN  18           HB2      GLN  18  30.868  -5.211  10.142
  132   2HB   GLN  18           HB1      GLN  18  29.237  -5.128  10.798
  133   1HG   GLN  18           HG1      GLN  18  29.955  -5.632  12.890
  134   2HG   GLN  18           HG2      GLN  18  30.932  -6.978  12.310
  135   1HE2  GLN  18          HE22      GLN  18  32.640  -3.279  12.755
  136   2HE2  GLN  18          HE21      GLN  18  30.950  -3.432  12.745
  137    H    ALA  19           HN       ALA  19  27.357  -7.274   9.582
  138    HA   ALA  19           HA       ALA  19  27.755  -6.631   6.684
  139   1HB   ALA  19           HB2      ALA  19  25.691  -8.320   8.157
  140   2HB   ALA  19           HB3      ALA  19  25.448  -7.808   6.492
  141   3HB   ALA  19           HB1      ALA  19  26.809  -8.846   6.905
  142    H    SER  20           HN       SER  20  25.927  -5.472   5.652
  143    HA   SER  20           HA       SER  20  24.081  -3.993   7.362
  144   1HB   SER  20           HB2      SER  20  25.094  -1.724   6.581
  145   2HB   SER  20           HB1      SER  20  26.048  -2.607   7.788
  146    HG   SER  20           HG       SER  20  26.341  -2.783   4.966
  147    H    ILE  21           HN       ILE  21  22.456  -4.662   6.013
  148    HA   ILE  21           HA       ILE  21  22.656  -4.218   3.112
  149    HB   ILE  21           HB       ILE  21  20.280  -5.031   4.872
  150   1HG1  ILE  21          HG11      ILE  21  21.227  -7.182   3.272
  151   2HG1  ILE  21          HG12      ILE  21  22.643  -6.470   4.035
  152   1HG2  ILE  21          HG23      ILE  21  20.776  -4.910   1.873
  153   2HG2  ILE  21          HG21      ILE  21  19.605  -6.049   2.529
  154   3HG2  ILE  21          HG22      ILE  21  19.380  -4.319   2.768
  155   1HD1  ILE  21          HD13      ILE  21  20.112  -7.217   5.536
  156   2HD1  ILE  21          HD11      ILE  21  21.531  -8.252   5.428
  157   3HD1  ILE  21          HD12      ILE  21  21.639  -6.693   6.239
  158    H    SER  22           HN       SER  22  20.820  -2.961   2.043
  159    HA   SER  22           HA       SER  22  19.986  -0.636   3.703
  160   1HB   SER  22           HB2      SER  22  22.125  -0.069   2.456
  161   2HB   SER  22           HB1      SER  22  21.266  -0.363   0.930
  162    HG   SER  22           HG       SER  22  19.613   1.111   1.909
  163    H    CYS  23           HN       CYS  23  17.860  -0.683   3.583
  164    HA   CYS  23           HA       CYS  23  16.584  -1.075   0.900
  165   1HB   CYS  23           HB2      CYS  23  16.125  -2.821   2.704
  166   2HB   CYS  23           HB1      CYS  23  15.388  -1.561   3.657
  167    NH1  ARG  24           NH1      ARG  24  20.486   4.330   1.695
  168    NH2  ARG  24           NH2      ARG  24  20.069   6.193   0.458
  169    H    ARG  24           HN       ARG  24  15.490   0.646   0.146
  170    HA   ARG  24           HA       ARG  24  14.813   2.794   2.120
  171   1HB   ARG  24           HB2      ARG  24  15.448   3.049  -0.857
  172   2HB   ARG  24           HB1      ARG  24  15.129   4.388   0.240
  173   1HG   ARG  24           HG1      ARG  24  17.097   3.659   1.621
  174   2HG   ARG  24           HG2      ARG  24  17.451   2.436   0.406
  175   1HD   ARG  24           HD1      ARG  24  17.458   4.377  -1.300
  176   2HD   ARG  24           HD2      ARG  24  17.529   5.446   0.100
  177    HE   ARG  24           HE       ARG  24  19.656   3.522  -0.698
  178   1HH1  ARG  24          HH11      ARG  24  20.365   3.347   1.826
  179   2HH1  ARG  24          HH12      ARG  24  21.027   4.857   2.347
  180   1HH2  ARG  24          HH21      ARG  24  19.633   6.610  -0.338
  181   2HH2  ARG  24          HH22      ARG  24  20.598   6.757   1.089
  182    H    SER  25           HN       SER  25  12.890   3.921   1.878
  183    HA   SER  25           HA       SER  25  10.832   2.489   0.251
  184   1HB   SER  25           HB2      SER  25   9.265   2.949   1.996
  185   2HB   SER  25           HB1      SER  25  10.757   2.780   2.934
  186    HG   SER  25           HG       SER  25  11.014   5.136   2.374
  187    H    SER  26           HN       SER  26  10.167   3.557  -1.501
  188    HA   SER  26           HA       SER  26  10.840   6.362  -1.893
  189   1HB   SER  26           HB2      SER  26   9.158   4.382  -3.506
  190   2HB   SER  26           HB1      SER  26   9.526   6.026  -4.061
  191    HG   SER  26           HG       SER  26  11.761   5.517  -3.662
  192    H    GLN  27           HN       GLN  27   8.848   5.517   0.261
  193    HA   GLN  27           HA       GLN  27   6.958   7.703  -0.308
  194   1HB   GLN  27           HB2      GLN  27   6.215   5.103  -0.848
  195   2HB   GLN  27           HB1      GLN  27   5.696   5.256   0.828
  196   1HG   GLN  27           HG1      GLN  27   4.652   7.507   0.077
  197   2HG   GLN  27           HG2      GLN  27   4.849   6.890  -1.559
  198   1HE2  GLN  27          HE22      GLN  27   2.458   4.218  -1.055
  199   2HE2  GLN  27          HE21      GLN  27   3.922   4.550  -1.844
  200    H    SER  28           HN       SER  28   9.048   6.313   1.758
  201    HA   SER  28           HA       SER  28   9.523   6.687   4.014
  202   1HB   SER  28           HB2      SER  28   8.868   8.782   4.780
  203   2HB   SER  28           HB1      SER  28   8.090   8.966   3.198
  204    HG   SER  28           HG       SER  28   6.212   8.086   4.047
  205    H    LEU  29           HN       LEU  29   8.877   5.940   6.069
  206    HA   LEU  29           HA       LEU  29   6.331   4.375   5.994
  207   1HB   LEU  29           HB2      LEU  29   8.878   3.797   7.556
  208   2HB   LEU  29           HB1      LEU  29   7.456   2.773   7.512
  209    HG   LEU  29           HG       LEU  29   9.148   3.512   5.104
  210   1HD1  LEU  29          HD11      LEU  29  10.163   1.897   6.799
  211   2HD1  LEU  29          HD12      LEU  29   8.819   0.815   6.455
  212   3HD1  LEU  29          HD13      LEU  29   9.958   1.237   5.180
  213   1HD2  LEU  29          HD22      LEU  29   6.682   1.793   5.466
  214   2HD2  LEU  29          HD23      LEU  29   6.892   3.156   4.374
  215   3HD2  LEU  29          HD21      LEU  29   7.737   1.644   4.066
  216    H    VAL  30           HN       VAL  30   6.735   7.147   6.930
  217    HA   VAL  30           HA       VAL  30   6.342   6.858   9.858
  218    HB   VAL  30           HB       VAL  30   6.470   9.351   8.086
  219   1HG1  VAL  30          HG12      VAL  30   6.189   8.915  11.066
  220   2HG1  VAL  30          HG13      VAL  30   6.933  10.385  10.443
  221   3HG1  VAL  30          HG11      VAL  30   5.268   9.995  10.023
  222   1HG2  VAL  30          HG21      VAL  30   8.568   7.752   8.556
  223   2HG2  VAL  30          HG22      VAL  30   8.738   9.504   8.579
  224   3HG2  VAL  30          HG23      VAL  30   8.577   8.615  10.090
  225    H    HIS  31           HN       HIS  31   4.358   6.466  10.535
  226    HA   HIS  31           HA       HIS  31   2.013   6.713   8.931
  227   1HB   HIS  31           HB2      HIS  31   2.561   5.455  11.259
  228   2HB   HIS  31           HB1      HIS  31   1.810   6.902  11.928
  229    HD2  HIS  31           HD2      HIS  31   0.840   3.636  10.119
  230    HE1  HIS  31           HE1      HIS  31  -2.582   5.942  10.379
  231    H    SER  32           HN       SER  32   0.068   8.018   9.824
  232    HA   SER  32           HA       SER  32   0.270  10.681   9.201
  233   1HB   SER  32           HB2      SER  32  -1.487   9.592  11.463
  234   2HB   SER  32           HB1      SER  32  -1.830  11.004  10.445
  235    HG   SER  32           HG       SER  32  -2.321   8.442   9.915
  236    H    ASN  33           HN       ASN  33   2.216  11.499   9.943
  237    HA   ASN  33           HA       ASN  33   3.737  12.451  11.466
  238   1HB   ASN  33           HB2      ASN  33   2.505  14.195  12.937
  239   2HB   ASN  33           HB1      ASN  33   2.243  14.329  11.203
  240   1HD2  ASN  33          HD22      ASN  33  -0.845  13.213  13.635
  241   2HD2  ASN  33          HD21      ASN  33   0.743  13.236  14.235
  242    H    GLY  34           HN       GLY  34   3.459   9.953  12.273
  243   1HA   GLY  34           HA1      GLY  34   3.278  10.208  15.248
  244   2HA   GLY  34           HA2      GLY  34   2.583   8.818  14.426
  245    H    ASN  35           HN       ASN  35   3.829   7.072  14.300
  246    HA   ASN  35           HA       ASN  35   6.775   7.417  14.695
  247   1HB   ASN  35           HB2      ASN  35   4.818   5.208  15.434
  248   2HB   ASN  35           HB1      ASN  35   6.552   4.908  15.396
  249   1HD2  ASN  35          HD22      ASN  35   6.884   6.179  18.642
  250   2HD2  ASN  35          HD21      ASN  35   7.321   5.007  17.494
  251    H    THR  36           HN       THR  36   7.922   5.291  13.876
  252    HA   THR  36           HA       THR  36   7.086   4.934  11.024
  253    HB   THR  36           HB       THR  36   9.861   4.916  12.347
  254    HG1  THR  36           HG1      THR  36   8.587   6.865  11.705
  255   1HG2  THR  36          HG23      THR  36   8.859   3.984   9.646
  256   2HG2  THR  36          HG21      THR  36  10.340   4.935   9.664
  257   3HG2  THR  36          HG22      THR  36  10.260   3.415  10.549
  258    OH   TYR  37           OH       TYR  37   2.613   3.008  15.166
  259    H    TYR  37           HN       TYR  37   6.909   2.893  10.213
  260    HA   TYR  37           HA       TYR  37   7.557   0.654  12.096
  261   1HB   TYR  37           HB2      TYR  37   5.255   0.822  10.090
  262   2HB   TYR  37           HB1      TYR  37   5.577  -0.531  11.158
  263    HD1  TYR  37           HD1      TYR  37   5.347  -0.248  13.626
  264    HD2  TYR  37           HD2      TYR  37   4.172   2.813  10.918
  265    HE1  TYR  37           HE1      TYR  37   4.035   0.817  15.402
  266    HE2  TYR  37           HE2      TYR  37   2.861   3.880  12.699
  267    HH   TYR  37           HH       TYR  37   1.707   2.702  15.080
  268    H    LEU  38           HN       LEU  38   8.789  -0.944  11.315
  269    HA   LEU  38           HA       LEU  38   8.943  -1.478   8.431
  270   1HB   LEU  38           HB2      LEU  38  10.551   0.364   8.619
  271   2HB   LEU  38           HB1      LEU  38  11.292  -0.367  10.035
  272    HG   LEU  38           HG       LEU  38  11.541  -2.413   8.225
  273   1HD1  LEU  38          HD11      LEU  38  10.595  -0.929   6.434
  274   2HD1  LEU  38          HD12      LEU  38  11.956   0.161   6.672
  275   3HD1  LEU  38          HD13      LEU  38  12.231  -1.476   6.085
  276   1HD2  LEU  38          HD22      LEU  38  13.331  -0.112   8.978
  277   2HD2  LEU  38          HD23      LEU  38  13.434  -1.797   9.473
  278   3HD2  LEU  38          HD21      LEU  38  13.894  -1.330   7.839
  279    H    ASN  39           HN       ASN  39   9.622  -3.509   7.979
  280    HA   ASN  39           HA       ASN  39  10.603  -5.161  10.275
  281   1HB   ASN  39           HB2      ASN  39   8.296  -5.509   8.423
  282   2HB   ASN  39           HB1      ASN  39   9.293  -6.950   8.595
  283   1HD2  ASN  39          HD22      ASN  39   7.758  -7.725  11.644
  284   2HD2  ASN  39          HD21      ASN  39   8.432  -8.266  10.182
  285    CH2  TRP  40           CH2      TRP  40  17.703  -4.503   5.331
  286    H    TRP  40           HN       TRP  40  12.074  -6.778   9.789
  287    HA   TRP  40           HA       TRP  40  13.341  -6.573   7.085
  288   1HB   TRP  40           HB2      TRP  40  14.413  -6.778   9.890
  289   2HB   TRP  40           HB1      TRP  40  15.333  -7.588   8.624
  290    HD1  TRP  40           HD1      TRP  40  14.402  -4.092   9.896
  291    HE1  TRP  40           HE1      TRP  40  15.820  -2.482   8.553
  292    HE3  TRP  40           HE3      TRP  40  16.154  -7.248   6.510
  293    HZ2  TRP  40           HZ2      TRP  40  17.553  -2.544   6.170
  294    HZ3  TRP  40           HZ3      TRP  40  17.666  -6.543   4.707
  295    HH2  TRP  40           HH2      TRP  40  18.378  -4.200   4.551
  296    OH   TYR  41           OH       TYR  41   7.738 -11.881   8.571
  297    H    TYR  41           HN       TYR  41  14.389  -8.571   6.309
  298    HA   TYR  41           HA       TYR  41  13.460 -11.060   7.602
  299   1HB   TYR  41           HB2      TYR  41  12.375  -9.917   5.060
  300   2HB   TYR  41           HB1      TYR  41  12.739 -11.640   5.023
  301    HD1  TYR  41           HD1      TYR  41  11.860 -13.023   7.091
  302    HD2  TYR  41           HD2      TYR  41  10.321  -9.219   5.974
  303    HE1  TYR  41           HE1      TYR  41   9.804 -13.487   8.343
  304    HE2  TYR  41           HE2      TYR  41   8.264  -9.685   7.226
  305    HH   TYR  41           HH       TYR  41   7.412 -12.742   8.296
  306    H    LEU  42           HN       LEU  42  14.424 -12.964   6.762
  307    HA   LEU  42           HA       LEU  42  16.720 -12.585   4.920
  308   1HB   LEU  42           HB2      LEU  42  17.852 -12.355   7.009
  309   2HB   LEU  42           HB1      LEU  42  16.805 -13.514   7.811
  310    HG   LEU  42           HG       LEU  42  17.820 -15.357   6.520
  311   1HD1  LEU  42          HD12      LEU  42  19.261 -13.057   5.194
  312   2HD1  LEU  42          HD13      LEU  42  19.974 -14.664   5.218
  313   3HD1  LEU  42          HD11      LEU  42  18.421 -14.405   4.436
  314   1HD2  LEU  42          HD22      LEU  42  19.564 -13.471   8.085
  315   2HD2  LEU  42          HD23      LEU  42  18.993 -15.077   8.524
  316   3HD2  LEU  42          HD21      LEU  42  20.289 -14.895   7.347
  317    H    GLN  43           HN       GLN  43  16.359 -14.009   3.374
  318    HA   GLN  43           HA       GLN  43  14.849 -16.478   3.898
  319   1HB   GLN  43           HB2      GLN  43  14.830 -14.855   1.783
  320   2HB   GLN  43           HB1      GLN  43  16.212 -15.818   1.280
  321   1HG   GLN  43           HG1      GLN  43  14.714 -17.879   1.757
  322   2HG   GLN  43           HG2      GLN  43  13.373 -16.736   1.772
  323   1HE2  GLN  43          HE22      GLN  43  13.708 -15.965  -1.740
  324   2HE2  GLN  43          HE21      GLN  43  13.286 -15.257  -0.257
  325    H    LYS  44           HN       LYS  44  15.758 -18.384   4.344
  326    HA   LYS  44           HA       LYS  44  18.696 -18.640   4.098
  327   1HB   LYS  44           HB2      LYS  44  16.928 -19.434   6.056
  328   2HB   LYS  44           HB1      LYS  44  17.085 -20.927   5.139
  329   1HG   LYS  44           HG1      LYS  44  19.661 -20.417   5.246
  330   2HG   LYS  44           HG2      LYS  44  19.222 -19.360   6.581
  331   1HD   LYS  44           HD1      LYS  44  18.035 -22.094   6.631
  332   2HD   LYS  44           HD2      LYS  44  19.769 -21.996   6.912
  333   1HE   LYS  44           HE1      LYS  44  19.384 -20.316   8.691
  334   2HE   LYS  44           HE2      LYS  44  17.650 -20.418   8.411
  335   1HZ   LYS  44           HZ1      LYS  44  17.830 -22.828   8.929
  336   2HZ   LYS  44           HZ2      LYS  44  19.439 -22.558   9.416
  337    H    ALA  45           HN       ALA  45  19.107 -21.267   3.753
  338    HA   ALA  45           HA       ALA  45  18.757 -21.591   0.912
  339   1HB   ALA  45           HB1      ALA  45  19.657 -23.566   3.063
  340   2HB   ALA  45           HB2      ALA  45  19.840 -23.824   1.331
  341   3HB   ALA  45           HB3      ALA  45  20.713 -22.516   2.123
  342    H    GLY  46           HN       GLY  46  16.508 -21.565   0.575
  343   1HA   GLY  46           HA1      GLY  46  14.423 -22.579   0.208
  344   2HA   GLY  46           HA2      GLY  46  15.264 -24.115   0.368
  345    H    GLN  47           HN       GLN  47  14.612 -21.489   2.688
  346    HA   GLN  47           HA       GLN  47  13.103 -23.472   4.331
  347   1HB   GLN  47           HB2      GLN  47  15.642 -22.691   4.957
  348   2HB   GLN  47           HB1      GLN  47  14.744 -21.396   5.738
  349   1HG   GLN  47           HG1      GLN  47  13.266 -23.515   6.565
  350   2HG   GLN  47           HG2      GLN  47  14.825 -24.312   6.380
  351   1HE2  GLN  47          HE22      GLN  47  14.241 -21.675   9.416
  352   2HE2  GLN  47          HE21      GLN  47  13.034 -21.946   8.255
  353    H    SER  48           HN       SER  48  12.680 -21.637   6.482
  354    HA   SER  48           HA       SER  48  10.545 -20.022   5.242
  355   1HB   SER  48           HB2      SER  48   9.896 -19.653   7.695
  356   2HB   SER  48           HB1      SER  48   9.996 -21.370   7.261
  357    HG   SER  48           HG       SER  48  12.146 -19.824   8.301
  358    HA   PRO  49           HA       PRO  49  12.652 -16.197   5.389
  359   1HB   PRO  49           HB2      PRO  49  10.293 -14.701   6.153
  360   2HB   PRO  49           HB1      PRO  49  10.971 -14.876   4.535
  361   1HG   PRO  49           HG1      PRO  49   8.566 -16.089   5.601
  362   2HG   PRO  49           HG2      PRO  49   9.208 -16.215   3.964
  363   1HD   PRO  49           HD1      PRO  49   9.201 -18.245   6.007
  364   2HD   PRO  49           HD2      PRO  49   9.891 -18.354   4.377
  365    H    LYS  50           HN       LYS  50  13.971 -15.864   7.088
  366    HA   LYS  50           HA       LYS  50  12.989 -15.960   9.839
  367   1HB   LYS  50           HB2      LYS  50  15.281 -16.756   9.115
  368   2HB   LYS  50           HB1      LYS  50  15.709 -15.089   8.754
  369   1HG   LYS  50           HG1      LYS  50  15.517 -14.439  11.051
  370   2HG   LYS  50           HG2      LYS  50  14.700 -15.937  11.482
  371   1HD   LYS  50           HD1      LYS  50  17.290 -16.442  10.217
  372   2HD   LYS  50           HD2      LYS  50  17.455 -15.443  11.654
  373   1HE   LYS  50           HE1      LYS  50  15.781 -17.223  12.693
  374   2HE   LYS  50           HE2      LYS  50  16.405 -18.245  11.404
  375   1HZ   LYS  50           HZ1      LYS  50  18.383 -18.426  12.398
  376   2HZ   LYS  50           HZ2      LYS  50  18.426 -16.794  12.871
  377    H    LEU  51           HN       LEU  51  12.395 -14.301  11.080
  378    HA   LEU  51           HA       LEU  51  12.535 -11.569   9.913
  379   1HB   LEU  51           HB2      LEU  51  10.312 -12.218  10.638
  380   2HB   LEU  51           HB1      LEU  51  10.920 -12.848  12.162
  381    HG   LEU  51           HG       LEU  51  11.551 -10.555  12.866
  382   1HD1  LEU  51          HD13      LEU  51  10.594  -9.936  10.075
  383   2HD1  LEU  51          HD11      LEU  51  10.448  -8.715  11.336
  384   3HD1  LEU  51          HD12      LEU  51  12.031  -9.351  10.907
  385   1HD2  LEU  51          HD23      LEU  51   9.072 -11.639  12.890
  386   2HD2  LEU  51          HD21      LEU  51   9.413 -10.048  13.557
  387   3HD2  LEU  51          HD22      LEU  51   8.740 -10.197  11.937
  388    H    LEU  52           HN       LEU  52  14.067 -10.222  10.589
  389    HA   LEU  52           HA       LEU  52  15.495 -10.820  13.128
  390   1HB   LEU  52           HB2      LEU  52  16.132  -8.756  10.962
  391   2HB   LEU  52           HB1      LEU  52  17.194  -9.231  12.278
  392    HG   LEU  52           HG       LEU  52  18.005 -10.491  10.463
  393   1HD1  LEU  52          HD11      LEU  52  17.359 -11.875  12.515
  394   2HD1  LEU  52          HD12      LEU  52  15.937 -12.386  11.612
  395   3HD1  LEU  52          HD13      LEU  52  17.546 -12.778  11.015
  396   1HD2  LEU  52          HD21      LEU  52  15.561  -9.965   9.307
  397   2HD2  LEU  52          HD22      LEU  52  16.788 -11.019   8.615
  398   3HD2  LEU  52          HD23      LEU  52  15.473 -11.704   9.563
  399    H    ILE  53           HN       ILE  53  14.705  -7.770  11.520
  400    HA   ILE  53           HA       ILE  53  14.023  -6.617  14.189
  401    HB   ILE  53           HB       ILE  53  14.349  -5.200  11.515
  402   1HG1  ILE  53          HG11      ILE  53  16.361  -6.590  12.085
  403   2HG1  ILE  53          HG12      ILE  53  16.673  -4.865  11.946
  404   1HG2  ILE  53          HG22      ILE  53  14.465  -4.354  14.430
  405   2HG2  ILE  53          HG23      ILE  53  15.070  -3.326  13.135
  406   3HG2  ILE  53          HG21      ILE  53  13.366  -3.768  13.185
  407   1HD1  ILE  53          HD13      ILE  53  16.100  -6.276  14.556
  408   2HD1  ILE  53          HD11      ILE  53  17.718  -5.922  13.972
  409   3HD1  ILE  53          HD12      ILE  53  16.614  -4.611  14.352
  410    OH   TYR  54           OH       TYR  54   9.448  -6.496  19.755
  411    H    TYR  54           HN       TYR  54  11.925  -6.018  14.631
  412    HA   TYR  54           HA       TYR  54  10.035  -6.059  12.314
  413   1HB   TYR  54           HB2      TYR  54   8.331  -7.065  13.765
  414   2HB   TYR  54           HB1      TYR  54   9.788  -8.045  13.849
  415    HD1  TYR  54           HD1      TYR  54  11.289  -7.855  15.850
  416    HD2  TYR  54           HD2      TYR  54   7.511  -5.905  15.710
  417    HE1  TYR  54           HE1      TYR  54  11.320  -7.611  18.290
  418    HE2  TYR  54           HE2      TYR  54   7.543  -5.669  18.150
  419    HH   TYR  54           HH       TYR  54   9.385  -7.376  20.134
  420    H    LYS  55           HN       LYS  55  11.456  -3.843  13.845
  421    HA   LYS  55           HA       LYS  55   9.265  -1.973  13.705
  422   1HB   LYS  55           HB2      LYS  55   9.021  -3.239  16.004
  423   2HB   LYS  55           HB1      LYS  55  10.387  -2.251  16.509
  424   1HG   LYS  55           HG1      LYS  55   8.559  -0.909  17.119
  425   2HG   LYS  55           HG2      LYS  55   8.983  -0.259  15.541
  426   1HD   LYS  55           HD1      LYS  55   6.646  -0.567  15.382
  427   2HD   LYS  55           HD2      LYS  55   7.291  -2.006  14.604
  428   1HE   LYS  55           HE1      LYS  55   5.597  -2.780  16.109
  429   2HE   LYS  55           HE2      LYS  55   7.131  -3.156  16.880
  430   1HZ   LYS  55           HZ1      LYS  55   6.872  -0.952  18.055
  431   2HZ   LYS  55           HZ2      LYS  55   5.261  -0.956  17.515
  432    H    VAL  56           HN       VAL  56  11.211  -1.522  12.292
  433    HA   VAL  56           HA       VAL  56  12.808   0.051  11.687
  434    HB   VAL  56           HB       VAL  56  12.539   1.221  14.484
  435   1HG1  VAL  56          HG13      VAL  56  14.370   2.035  12.948
  436   2HG1  VAL  56          HG11      VAL  56  13.127   2.504  11.791
  437   3HG1  VAL  56          HG12      VAL  56  13.202   3.285  13.368
  438   1HG2  VAL  56          HG23      VAL  56  10.721   1.410  12.078
  439   2HG2  VAL  56          HG21      VAL  56  10.284   1.142  13.761
  440   3HG2  VAL  56          HG22      VAL  56  10.821   2.732  13.235
  441    H    SER  57           HN       SER  57  13.523  -0.420  15.185
  442    HA   SER  57           HA       SER  57  16.139  -1.549  14.307
  443   1HB   SER  57           HB2      SER  57  17.329  -0.079  15.950
  444   2HB   SER  57           HB1      SER  57  16.419   0.917  14.798
  445    HG   SER  57           HG       SER  57  15.784   0.216  17.455
  446    H    ASN  58           HN       ASN  58  13.532  -2.299  15.942
  447    HA   ASN  58           HA       ASN  58  14.657  -3.123  18.498
  448   1HB   ASN  58           HB2      ASN  58  12.478  -4.302  18.765
  449   2HB   ASN  58           HB1      ASN  58  12.202  -2.681  18.136
  450   1HD2  ASN  58          HD22      ASN  58  10.194  -4.902  16.005
  451   2HD2  ASN  58          HD21      ASN  58  10.179  -4.381  17.618
  452    NH1  ARG  59           NH1      ARG  59  17.541  -4.009  18.583
  453    NH2  ARG  59           NH2      ARG  59  19.710  -4.467  18.069
  454    H    ARG  59           HN       ARG  59  13.570  -5.794  18.579
  455    HA   ARG  59           HA       ARG  59  15.010  -7.303  16.495
  456   1HB   ARG  59           HB2      ARG  59  16.020  -6.878  19.279
  457   2HB   ARG  59           HB1      ARG  59  16.045  -8.550  18.730
  458   1HG   ARG  59           HG1      ARG  59  17.421  -8.006  16.840
  459   2HG   ARG  59           HG2      ARG  59  17.187  -6.279  17.079
  460   1HD   ARG  59           HD1      ARG  59  18.459  -8.023  19.200
  461   2HD   ARG  59           HD2      ARG  59  19.411  -7.260  17.929
  462    HE   ARG  59           HE       ARG  59  18.422  -5.917  20.252
  463   1HH1  ARG  59          HH11      ARG  59  16.694  -4.289  19.029
  464   2HH1  ARG  59          HH12      ARG  59  17.586  -3.138  18.096
  465   1HH2  ARG  59          HH21      ARG  59  20.488  -5.092  18.131
  466   2HH2  ARG  59          HH22      ARG  59  19.799  -3.604  17.572
  467    H    PHE  60           HN       PHE  60  13.653  -8.880  15.988
  468    HA   PHE  60           HA       PHE  60  11.424  -9.650  17.598
  469   1HB   PHE  60           HB2      PHE  60  11.779  -9.983  15.053
  470   2HB   PHE  60           HB1      PHE  60  12.741 -11.397  15.474
  471    HD1  PHE  60           HD2      PHE  60   9.392  -9.867  16.191
  472    HD2  PHE  60           HD1      PHE  60  11.647 -13.455  15.756
  473    HE1  PHE  60           HE2      PHE  60   7.342 -11.190  16.457
  474    HE2  PHE  60           HE1      PHE  60   9.593 -14.774  16.023
  475    HZ   PHE  60           HZ       PHE  60   7.440 -13.644  16.374
  476    H    SER  61           HN       SER  61  11.010 -11.721  18.588
  477    HA   SER  61           HA       SER  61  12.921 -12.474  20.512
  478   1HB   SER  61           HB2      SER  61  11.468 -14.654  20.604
  479   2HB   SER  61           HB1      SER  61  10.593 -13.126  20.827
  480    HG   SER  61           HG       SER  61  11.077 -14.062  18.226
  481    H    GLY  62           HN       GLY  62  14.539 -13.940  20.612
  482   1HA   GLY  62           HA1      GLY  62  15.878 -15.796  19.920
  483   2HA   GLY  62           HA2      GLY  62  14.905 -15.922  18.459
  484    H    VAL  63           HN       VAL  63  15.255 -12.976  17.986
  485    HA   VAL  63           HA       VAL  63  17.518 -13.153  16.248
  486    HB   VAL  63           HB       VAL  63  16.095 -10.688  17.363
  487   1HG1  VAL  63          HG13      VAL  63  17.901 -11.085  14.951
  488   2HG1  VAL  63          HG11      VAL  63  16.929  -9.643  15.225
  489   3HG1  VAL  63          HG12      VAL  63  18.219 -10.062  16.348
  490   1HG2  VAL  63          HG22      VAL  63  14.669 -12.418  16.166
  491   2HG2  VAL  63          HG23      VAL  63  14.695 -10.840  15.391
  492   3HG2  VAL  63          HG21      VAL  63  15.663 -12.155  14.737
  493    HA   PRO  64           HA       PRO  64  20.654 -12.639  19.357
  494   1HB   PRO  64           HB2      PRO  64  22.594 -12.265  17.225
  495   2HB   PRO  64           HB1      PRO  64  22.362 -13.693  18.235
  496   1HG   PRO  64           HG1      PRO  64  21.663 -13.375  15.458
  497   2HG   PRO  64           HG2      PRO  64  21.405 -14.792  16.475
  498   1HD   PRO  64           HD1      PRO  64  19.428 -12.916  15.508
  499   2HD   PRO  64           HD2      PRO  64  19.166 -14.359  16.507
  500    H    ASP  65           HN       ASP  65  21.724 -10.892  20.220
  501    HA   ASP  65           HA       ASP  65  20.893  -8.290  19.679
  502   1HB   ASP  65           HB2      ASP  65  22.109  -8.931  21.735
  503   2HB   ASP  65           HB1      ASP  65  23.573  -9.232  20.804
  504    NH1  ARG  66           NH2      ARG  66  26.414 -11.479  19.854
  505    NH2  ARG  66           NH1      ARG  66  24.353 -12.109  20.580
  506    H    ARG  66           HN       ARG  66  23.637  -9.998  18.239
  507    HA   ARG  66           HA       ARG  66  25.000  -7.912  17.005
  508   1HB   ARG  66           HB2      ARG  66  24.287 -10.636  15.824
  509   2HB   ARG  66           HB1      ARG  66  25.600  -9.606  15.259
  510   1HG   ARG  66           HG1      ARG  66  26.955 -10.201  16.989
  511   2HG   ARG  66           HG2      ARG  66  25.662 -10.034  18.165
  512   1HD   ARG  66           HD1      ARG  66  25.332 -12.342  16.348
  513   2HD   ARG  66           HD2      ARG  66  26.756 -12.441  17.381
  514    HE   ARG  66           HE       ARG  66  24.114 -12.903  18.280
  515   1HH1  ARG  66          HH21      ARG  66  27.066 -11.393  19.104
  516   2HH1  ARG  66          HH22      ARG  66  26.667 -11.183  20.774
  517   1HH2  ARG  66          HH11      ARG  66  23.457 -12.499  20.378
  518   2HH2  ARG  66          HH12      ARG  66  24.574 -11.818  21.511
  519    H    PHE  67           HN       PHE  67  21.836  -9.126  16.179
  520    HA   PHE  67           HA       PHE  67  21.813  -7.746  13.581
  521   1HB   PHE  67           HB2      PHE  67  19.808  -9.347  15.199
  522   2HB   PHE  67           HB1      PHE  67  19.272  -8.421  13.806
  523    HD1  PHE  67           HD2      PHE  67  21.769 -11.012  14.830
  524    HD2  PHE  67           HD1      PHE  67  19.526  -9.309  11.635
  525    HE1  PHE  67           HE2      PHE  67  22.514 -12.820  13.340
  526    HE2  PHE  67           HE1      PHE  67  20.264 -11.117  10.155
  527    HZ   PHE  67           HZ       PHE  67  21.768 -12.873  10.998
  528    H    SER  68           HN       SER  68  21.783  -5.586  13.675
  529    HA   SER  68           HA       SER  68  19.640  -4.321  15.319
  530   1HB   SER  68           HB2      SER  68  22.142  -4.160  16.233
  531   2HB   SER  68           HB1      SER  68  22.311  -2.924  14.970
  532    HG   SER  68           HG       SER  68  20.857  -1.699  15.945
  533    H    GLY  69           HN       GLY  69  18.299  -3.560  13.828
  534   1HA   GLY  69           HA1      GLY  69  19.416  -2.319  11.368
  535   2HA   GLY  69           HA2      GLY  69  17.752  -2.855  11.564
  536    H    SER  70           HN       SER  70  18.119  -0.427  10.541
  537    HA   SER  70           HA       SER  70  16.794   1.298  12.476
  538   1HB   SER  70           HB2      SER  70  19.365   1.496  12.945
  539   2HB   SER  70           HB1      SER  70  19.453   2.330  11.381
  540    HG   SER  70           HG       SER  70  18.396   3.173  13.756
  541    H    GLY  71           HN       GLY  71  17.173   3.758  11.237
  542   1HA   GLY  71           HA1      GLY  71  17.261   4.117   8.557
  543   2HA   GLY  71           HA2      GLY  71  15.741   3.249   8.705
  544    H    SER  72           HN       SER  72  17.123   6.251   8.600
  545    HA   SER  72           HA       SER  72  14.986   7.541  10.212
  546   1HB   SER  72           HB2      SER  72  17.645   8.456   9.063
  547   2HB   SER  72           HB1      SER  72  16.434   9.651   9.569
  548    HG   SER  72           HG       SER  72  17.517   9.162  11.411
  549    H    GLY  73           HN       GLY  73  13.154   7.574   8.978
  550   1HA   GLY  73           HA1      GLY  73  11.784   8.815   7.443
  551   2HA   GLY  73           HA2      GLY  73  13.234   9.332   6.600
  552    H    THR  74           HN       THR  74  13.524   8.475   4.662
  553    HA   THR  74           HA       THR  74  11.997   6.027   3.940
  554    HB   THR  74           HB       THR  74  12.614   6.759   1.560
  555    HG1  THR  74           HG1      THR  74  14.521   7.855   2.472
  556   1HG2  THR  74          HG22      THR  74  11.132   8.511   3.527
  557   2HG2  THR  74          HG23      THR  74  11.549   9.239   1.979
  558   3HG2  THR  74          HG21      THR  74  10.536   7.800   2.030
  559    H    ASP  75           HN       ASP  75  14.724   6.218   5.351
  560    HA   ASP  75           HA       ASP  75  16.051   4.259   3.521
  561   1HB   ASP  75           HB2      ASP  75  17.396   6.377   5.270
  562   2HB   ASP  75           HB1      ASP  75  18.241   5.203   4.265
  563    H    PHE  76           HN       PHE  76  16.716   2.412   4.453
  564    HA   PHE  76           HA       PHE  76  16.881   2.287   7.419
  565   1HB   PHE  76           HB2      PHE  76  15.341   0.295   5.682
  566   2HB   PHE  76           HB1      PHE  76  15.505   0.222   7.436
  567    HD1  PHE  76           HD1      PHE  76  13.937   2.030   4.631
  568    HD2  PHE  76           HD2      PHE  76  14.275   1.787   8.872
  569    HE1  PHE  76           HE1      PHE  76  12.023   3.550   4.876
  570    HE2  PHE  76           HE2      PHE  76  12.366   3.308   9.110
  571    HZ   PHE  76           HZ       PHE  76  11.237   4.189   7.115
  572    H    THR  77           HN       THR  77  18.189   0.583   8.223
  573    HA   THR  77           HA       THR  77  19.668  -1.019   6.203
  574    HB   THR  77           HB       THR  77  21.067   0.760   8.283
  575    HG1  THR  77           HG1      THR  77  20.209   1.032   5.639
  576   1HG2  THR  77          HG23      THR  77  22.121  -1.470   7.051
  577   2HG2  THR  77          HG21      THR  77  22.362  -0.281   5.772
  578   3HG2  THR  77          HG22      THR  77  23.086  -0.030   7.356
  579    H    LEU  78           HN       LEU  78  20.340  -2.956   6.915
  580    HA   LEU  78           HA       LEU  78  19.723  -3.653   9.756
  581   1HB   LEU  78           HB2      LEU  78  18.588  -4.912   7.858
  582   2HB   LEU  78           HB1      LEU  78  20.167  -5.472   7.337
  583    HG   LEU  78           HG       LEU  78  19.867  -5.991  10.169
  584   1HD1  LEU  78          HD13      LEU  78  17.679  -7.076   8.365
  585   2HD1  LEU  78          HD11      LEU  78  17.987  -7.604  10.016
  586   3HD1  LEU  78          HD12      LEU  78  17.444  -5.957   9.705
  587   1HD2  LEU  78          HD22      LEU  78  19.971  -7.813   7.739
  588   2HD2  LEU  78          HD23      LEU  78  21.373  -7.168   8.584
  589   3HD2  LEU  78          HD21      LEU  78  20.300  -8.300   9.399
  590    H    LYS  79           HN       LYS  79  21.655  -2.981  10.687
  591    HA   LYS  79           HA       LYS  79  24.211  -3.956   9.612
  592   1HB   LYS  79           HB2      LYS  79  23.295  -2.030  11.698
  593   2HB   LYS  79           HB1      LYS  79  24.822  -2.836  12.044
  594   1HG   LYS  79           HG1      LYS  79  25.708  -2.129   9.854
  595   2HG   LYS  79           HG2      LYS  79  24.172  -1.362   9.465
  596   1HD   LYS  79           HD1      LYS  79  24.507  -0.009  11.648
  597   2HD   LYS  79           HD2      LYS  79  26.174  -0.570  11.593
  598   1HE   LYS  79           HE1      LYS  79  24.830   0.814   9.255
  599   2HE   LYS  79           HE2      LYS  79  25.748   1.682  10.479
  600   1HZ   LYS  79           HZ1      LYS  79  26.888  -0.596   8.978
  601   2HZ   LYS  79           HZ2      LYS  79  26.986   1.004   8.412
  602    H    ILE  80           HN       ILE  80  24.919  -5.916  10.038
  603    HA   ILE  80           HA       ILE  80  24.153  -7.214  12.611
  604    HB   ILE  80           HB       ILE  80  25.378  -8.514  10.141
  605   1HG1  ILE  80          HG11      ILE  80  22.436  -8.355  10.881
  606   2HG1  ILE  80          HG12      ILE  80  23.198  -7.424   9.595
  607   1HG2  ILE  80          HG21      ILE  80  25.028  -9.473  12.728
  608   2HG2  ILE  80          HG22      ILE  80  23.545 -10.013  11.949
  609   3HG2  ILE  80          HG23      ILE  80  25.107 -10.500  11.301
  610   1HD1  ILE  80          HD12      ILE  80  24.011  -9.705   8.677
  611   2HD1  ILE  80          HD13      ILE  80  22.825 -10.421   9.763
  612   3HD1  ILE  80          HD11      ILE  80  22.302  -9.328   8.487
  613    H    SER  81           HN       SER  81  25.598  -7.561  14.103
  614    HA   SER  81           HA       SER  81  28.335  -6.758  13.478
  615   1HB   SER  81           HB2      SER  81  28.663  -6.708  15.911
  616   2HB   SER  81           HB1      SER  81  27.061  -6.015  15.595
  617    HG   SER  81           HG       SER  81  27.240  -7.811  17.193
  618    NH1  ARG  82           NH1      ARG  82  33.047 -11.953  16.004
  619    NH2  ARG  82           NH2      ARG  82  32.007 -13.488  17.324
  620    H    ARG  82           HN       ARG  82  26.944  -9.506  12.864
  621    HA   ARG  82           HA       ARG  82  29.359 -11.046  13.001
  622   1HB   ARG  82           HB2      ARG  82  27.657 -10.994  15.365
  623   2HB   ARG  82           HB1      ARG  82  27.707 -12.627  14.714
  624   1HG   ARG  82           HG1      ARG  82  30.310 -11.191  14.877
  625   2HG   ARG  82           HG2      ARG  82  29.574 -11.660  16.407
  626   1HD   ARG  82           HD1      ARG  82  29.674 -13.948  15.906
  627   2HD   ARG  82           HD2      ARG  82  29.701 -13.669  14.166
  628    HE   ARG  82           HE       ARG  82  32.044 -13.747  14.368
  629   1HH1  ARG  82          HH11      ARG  82  33.175 -11.556  15.095
  630   2HH1  ARG  82          HH12      ARG  82  33.563 -11.601  16.781
  631   1HH2  ARG  82          HH21      ARG  82  31.358 -14.242  17.405
  632   2HH2  ARG  82          HH22      ARG  82  32.500 -13.162  18.130
  633    H    VAL  83           HN       VAL  83  29.099 -12.135  11.146
  634    HA   VAL  83           HA       VAL  83  26.406 -13.201  10.462
  635    HB   VAL  83           HB       VAL  83  28.976 -12.828   8.856
  636   1HG1  VAL  83          HG13      VAL  83  26.554 -14.457   8.320
  637   2HG1  VAL  83          HG11      VAL  83  27.032 -13.387   7.008
  638   3HG1  VAL  83          HG12      VAL  83  28.166 -14.581   7.624
  639   1HG2  VAL  83          HG23      VAL  83  27.011 -11.013   9.526
  640   2HG2  VAL  83          HG21      VAL  83  28.035 -10.891   8.099
  641   3HG2  VAL  83          HG22      VAL  83  26.431 -11.610   7.974
  642    H    GLU  84           HN       GLU  84  26.011 -15.343  10.101
  643    HA   GLU  84           HA       GLU  84  28.228 -17.243  10.777
  644   1HB   GLU  84           HB2      GLU  84  25.278 -17.268  11.548
  645   2HB   GLU  84           HB1      GLU  84  26.295 -18.695  11.698
  646   1HG   GLU  84           HG1      GLU  84  27.888 -17.298  13.103
  647   2HG   GLU  84           HG2      GLU  84  26.671 -16.024  13.093
  648    H    ALA  85           HN       ALA  85  27.416 -19.586  10.128
  649    HA   ALA  85           HA       ALA  85  27.274 -19.595   7.261
  650   1HB   ALA  85           HB3      ALA  85  26.999 -21.707   9.424
  651   2HB   ALA  85           HB1      ALA  85  26.733 -22.130   7.736
  652   3HB   ALA  85           HB2      ALA  85  28.297 -21.508   8.252
  653    H    GLU  86           HN       GLU  86  24.867 -20.670   9.669
  654    HA   GLU  86           HA       GLU  86  22.773 -21.225   7.859
  655   1HB   GLU  86           HB2      GLU  86  22.618 -20.080  10.689
  656   2HB   GLU  86           HB1      GLU  86  21.275 -20.837   9.840
  657   1HG   GLU  86           HG1      GLU  86  23.020 -22.829   9.542
  658   2HG   GLU  86           HG2      GLU  86  23.764 -22.096  10.959
  659    H    ASP  87           HN       ASP  87  23.910 -18.180   9.113
  660    HA   ASP  87           HA       ASP  87  21.651 -16.574   8.422
  661   1HB   ASP  87           HB2      ASP  87  23.212 -15.460   9.798
  662   2HB   ASP  87           HB1      ASP  87  24.594 -16.103   8.922
  663    H    LEU  88           HN       LEU  88  24.442 -17.654   6.568
  664    HA   LEU  88           HA       LEU  88  24.301 -16.028   4.306
  665   1HB   LEU  88           HB2      LEU  88  24.674 -19.057   4.279
  666   2HB   LEU  88           HB1      LEU  88  25.255 -17.936   3.060
  667    HG   LEU  88           HG       LEU  88  26.106 -17.755   5.965
  668   1HD1  LEU  88          HD13      LEU  88  26.735 -19.967   4.976
  669   2HD1  LEU  88          HD11      LEU  88  27.547 -19.120   3.664
  670   3HD1  LEU  88          HD12      LEU  88  28.139 -18.961   5.314
  671   1HD2  LEU  88          HD22      LEU  88  26.605 -16.256   3.498
  672   2HD2  LEU  88          HD23      LEU  88  26.954 -15.808   5.163
  673   3HD2  LEU  88          HD21      LEU  88  28.096 -16.797   4.260
  674    H    GLY  89           HN       GLY  89  22.962 -15.766   2.648
  675   1HA   GLY  89           HA1      GLY  89  21.287 -17.541   1.353
  676   2HA   GLY  89           HA2      GLY  89  20.324 -16.997   2.725
  677    H    ILE  90           HN       ILE  90  18.831 -15.871   1.489
  678    HA   ILE  90           HA       ILE  90  19.902 -13.517  -0.019
  679    HB   ILE  90           HB       ILE  90  17.341 -15.151  -0.293
  680   1HG1  ILE  90          HG11      ILE  90  19.260 -14.395  -2.490
  681   2HG1  ILE  90          HG12      ILE  90  19.646 -15.729  -1.410
  682   1HG2  ILE  90          HG22      ILE  90  18.073 -12.386  -1.320
  683   2HG2  ILE  90          HG23      ILE  90  17.009 -13.415  -2.273
  684   3HG2  ILE  90          HG21      ILE  90  16.540 -12.932  -0.647
  685   1HD1  ILE  90          HD11      ILE  90  17.044 -15.487  -2.960
  686   2HD1  ILE  90          HD12      ILE  90  18.416 -16.466  -3.470
  687   3HD1  ILE  90          HD13      ILE  90  17.557 -16.860  -1.984
  688    OH   TYR  91           OH       TYR  91  21.058 -11.444   8.209
  689    H    TYR  91           HN       TYR  91  19.796 -11.742   1.176
  690    HA   TYR  91           HA       TYR  91  17.890 -11.476   3.367
  691   1HB   TYR  91           HB2      TYR  91  20.245 -10.010   2.315
  692   2HB   TYR  91           HB1      TYR  91  19.008  -8.960   3.001
  693    HD1  TYR  91           HD2      TYR  91  18.214  -9.392   5.370
  694    HD2  TYR  91           HD1      TYR  91  21.583 -11.408   3.722
  695    HE1  TYR  91           HE2      TYR  91  18.935 -10.036   7.622
  696    HE2  TYR  91           HE1      TYR  91  22.293 -12.055   5.978
  697    HH   TYR  91           HH       TYR  91  21.545 -12.269   8.142
  698    H    PHE  92           HN       PHE  92  16.099 -10.287   3.480
  699    HA   PHE  92           HA       PHE  92  15.295  -8.658   1.109
  700   1HB   PHE  92           HB2      PHE  92  14.063 -11.137   2.171
  701   2HB   PHE  92           HB1      PHE  92  12.912  -9.811   2.055
  702    HD1  PHE  92           HD2      PHE  92  15.770 -11.076  -0.040
  703    HD2  PHE  92           HD1      PHE  92  11.706  -9.815   0.063
  704    HE1  PHE  92           HE2      PHE  92  15.606 -11.408  -2.465
  705    HE2  PHE  92           HE1      PHE  92  11.541 -10.160  -2.363
  706    HZ   PHE  92           HZ       PHE  92  13.491 -10.956  -3.629
  707    H    CYS  93           HN       CYS  93  13.449  -7.221   1.629
  708    HA   CYS  93           HA       CYS  93  13.219  -6.591   4.534
  709   1HB   CYS  93           HB2      CYS  93  13.398  -4.160   3.928
  710   2HB   CYS  93           HB1      CYS  93  14.876  -5.047   3.678
  711    H    SER  94           HN       SER  94  11.245  -5.803   5.170
  712    HA   SER  94           HA       SER  94   9.235  -5.216   3.060
  713   1HB   SER  94           HB2      SER  94   9.177  -7.715   3.757
  714   2HB   SER  94           HB1      SER  94   8.611  -7.149   5.341
  715    HG   SER  94           HG       SER  94   6.775  -6.565   4.479
  716    H    GLN  95           HN       GLN  95   8.520  -3.267   3.605
  717    HA   GLN  95           HA       GLN  95   8.627  -2.189   6.264
  718   1HB   GLN  95           HB2      GLN  95   7.067  -0.416   5.239
  719   2HB   GLN  95           HB1      GLN  95   8.581  -0.655   4.379
  720   1HG   GLN  95           HG1      GLN  95   7.371  -1.078   2.510
  721   2HG   GLN  95           HG2      GLN  95   6.795  -2.552   3.281
  722   1HE2  GLN  95          HE22      GLN  95   3.682  -1.065   4.313
  723   2HE2  GLN  95          HE21      GLN  95   4.849  -2.186   4.819
  724    H    THR  96           HN       THR  96   6.952  -1.778   7.739
  725    HA   THR  96           HA       THR  96   4.481  -3.390   7.295
  726    HB   THR  96           HB       THR  96   6.075  -4.431   8.986
  727    HG1  THR  96           HG1      THR  96   3.645  -3.293   9.949
  728   1HG2  THR  96          HG23      THR  96   6.352  -1.784   9.843
  729   2HG2  THR  96          HG21      THR  96   5.224  -2.451  11.016
  730   3HG2  THR  96          HG22      THR  96   6.809  -3.187  10.801
  731    H    THR  97           HN       THR  97   5.074  -0.538   6.865
  732    HA   THR  97           HA       THR  97   3.430   0.830   8.919
  733    HB   THR  97           HB       THR  97   4.942   1.825   6.432
  734    HG1  THR  97           HG1      THR  97   6.267   1.287   8.106
  735   1HG2  THR  97          HG21      THR  97   3.408   3.305   8.636
  736   2HG2  THR  97          HG22      THR  97   4.605   4.085   7.608
  737   3HG2  THR  97          HG23      THR  97   3.124   3.443   6.903
  738    H    HIS  98           HN       HIS  98   3.213  -0.456   5.747
  739    HA   HIS  98           HA       HIS  98   0.407   0.550   5.538
  740   1HB   HIS  98           HB2      HIS  98   2.380   0.094   3.245
  741   2HB   HIS  98           HB1      HIS  98   0.744   0.732   3.092
  742    HD2  HIS  98           HD2      HIS  98   4.317   1.905   4.076
  743    HE1  HIS  98           HE1      HIS  98   1.776   5.140   4.497
  744    H    VAL  99           HN       VAL  99  -1.100  -0.937   5.059
  745    HA   VAL  99           HA       VAL  99  -0.146  -3.731   4.604
  746    HB   VAL  99           HB       VAL  99  -2.798  -2.701   5.730
  747   1HG1  VAL  99          HG11      VAL  99  -2.828  -4.968   4.573
  748   2HG1  VAL  99          HG12      VAL  99  -1.674  -5.520   5.784
  749   3HG1  VAL  99          HG13      VAL  99  -3.283  -5.003   6.273
  750   1HG2  VAL  99          HG21      VAL  99  -0.396  -3.945   7.118
  751   2HG2  VAL  99          HG22      VAL  99  -0.888  -2.259   7.237
  752   3HG2  VAL  99          HG23      VAL  99  -1.917  -3.525   7.899
  753    HA   PRO 100           HA       PRO 100  -0.792  -5.587   3.935
  754   1HB   PRO 100           HB2      PRO 100   0.047  -6.719   1.450
  755   2HB   PRO 100           HB1      PRO 100  -1.344  -7.223   2.410
  756   1HG   PRO 100           HG1      PRO 100  -1.330  -5.796  -0.128
  757   2HG   PRO 100           HG2      PRO 100  -2.716  -6.424   0.764
  758   1HD   PRO 100           HD1      PRO 100  -1.859  -3.671   0.522
  759   2HD   PRO 100           HD2      PRO 100  -3.268  -4.299   1.394
  760    HA   PRO 101           HA       PRO 101   3.383  -4.286   3.779
  761   1HB   PRO 101           HB2      PRO 101   4.529  -6.947   3.864
  762   2HB   PRO 101           HB1      PRO 101   4.301  -5.838   5.216
  763   1HG   PRO 101           HG1      PRO 101   2.829  -8.257   4.646
  764   2HG   PRO 101           HG2      PRO 101   2.606  -7.155   6.005
  765   1HD   PRO 101           HD1      PRO 101   0.898  -7.491   3.694
  766   2HD   PRO 101           HD2      PRO 101   0.664  -6.401   5.073
  767    H    THR 102           HN       THR 102   4.824  -3.822   2.181
  768    HA   THR 102           HA       THR 102   4.375  -4.741  -0.484
  769    HB   THR 102           HB       THR 102   6.645  -3.576  -0.916
  770    HG1  THR 102           HG1      THR 102   7.662  -2.824   0.894
  771   1HG2  THR 102          HG21      THR 102   4.320  -2.362   0.578
  772   2HG2  THR 102          HG22      THR 102   5.800  -1.411   0.543
  773   3HG2  THR 102          HG23      THR 102   5.012  -1.869  -0.964
  774    H    PHE 103           HN       PHE 103   7.012  -5.493   1.778
  775    HA   PHE 103           HA       PHE 103   8.520  -7.276   1.829
  776   1HB   PHE 103           HB2      PHE 103   6.130  -8.391   1.937
  777   2HB   PHE 103           HB1      PHE 103   6.475  -8.897   0.285
  778    HD1  PHE 103           HD2      PHE 103   8.524 -10.300  -0.166
  779    HD2  PHE 103           HD1      PHE 103   7.226  -9.446   3.800
  780    HE1  PHE 103           HE2      PHE 103   9.933 -12.120   0.689
  781    HE2  PHE 103           HE1      PHE 103   8.638 -11.267   4.651
  782    HZ   PHE 103           HZ       PHE 103   9.991 -12.605   3.098
  783    H    GLY 104           HN       GLY 104  10.141  -6.592   0.499
  784   1HA   GLY 104           HA1      GLY 104  10.733  -8.121  -1.809
  785   2HA   GLY 104           HA2      GLY 104  10.019  -6.612  -2.365
  786    H    GLY 105           HN       GLY 105  12.687  -7.991  -0.516
  787   1HA   GLY 105           HA1      GLY 105  14.112  -5.391  -0.576
  788   2HA   GLY 105           HA2      GLY 105  14.638  -6.824   0.304
  789    H    GLY 106           HN       GLY 106  16.506  -7.563  -0.552
  790   1HA   GLY 106           HA1      GLY 106  17.005  -8.835  -2.832
  791   2HA   GLY 106           HA2      GLY 106  16.968  -7.195  -3.462
  792    H    THR 107           HN       THR 107  18.619  -9.344  -1.226
  793    HA   THR 107           HA       THR 107  21.182  -8.052  -1.859
  794    HB   THR 107           HB       THR 107  20.117  -8.144   1.034
  795    HG1  THR 107           HG1      THR 107  20.696  -6.110  -0.873
  796   1HG2  THR 107          HG22      THR 107  22.815  -7.798  -0.187
  797   2HG2  THR 107          HG23      THR 107  22.344  -6.440   0.830
  798   3HG2  THR 107          HG21      THR 107  22.406  -8.066   1.505
  799    H    LYS 108           HN       LYS 108  22.249  -9.832  -2.466
  800    HA   LYS 108           HA       LYS 108  21.747 -12.421  -1.209
  801   1HB   LYS 108           HB2      LYS 108  23.428 -11.363  -3.460
  802   2HB   LYS 108           HB1      LYS 108  23.957 -12.868  -2.720
  803   1HG   LYS 108           HG1      LYS 108  21.436 -13.572  -2.975
  804   2HG   LYS 108           HG2      LYS 108  21.381 -12.278  -4.166
  805   1HD   LYS 108           HD1      LYS 108  22.160 -13.839  -5.630
  806   2HD   LYS 108           HD2      LYS 108  23.717 -13.592  -4.849
  807   1HE   LYS 108           HE1      LYS 108  21.659 -15.607  -3.889
  808   2HE   LYS 108           HE2      LYS 108  22.987 -16.012  -4.969
  809   1HZ   LYS 108           HZ1      LYS 108  23.808 -16.511  -2.888
  810   2HZ   LYS 108           HZ2      LYS 108  24.449 -14.969  -3.177
  811    H    LEU 109           HN       LEU 109  23.173 -13.660  -0.022
  812    HA   LEU 109           HA       LEU 109  25.726 -12.510   0.880
  813   1HB   LEU 109           HB2      LEU 109  23.667 -11.681   2.350
  814   2HB   LEU 109           HB1      LEU 109  23.737 -13.305   3.029
  815    HG   LEU 109           HG       LEU 109  26.240 -11.622   2.819
  816   1HD1  LEU 109          HD12      LEU 109  24.412 -10.354   4.046
  817   2HD1  LEU 109          HD13      LEU 109  24.363 -11.682   5.203
  818   3HD1  LEU 109          HD11      LEU 109  25.828 -10.721   5.025
  819   1HD2  LEU 109          HD23      LEU 109  25.297 -13.961   4.500
  820   2HD2  LEU 109          HD21      LEU 109  26.647 -13.919   3.371
  821   3HD2  LEU 109          HD22      LEU 109  26.746 -13.042   4.893
  822    H    GLU 110           HN       GLU 110  26.595 -14.382  -0.066
  823    HA   GLU 110           HA       GLU 110  26.051 -16.881   1.490
  824   1HB   GLU 110           HB2      GLU 110  26.822 -18.055  -0.690
  825   2HB   GLU 110           HB1      GLU 110  25.242 -17.284  -0.748
  826   1HG   GLU 110           HG1      GLU 110  26.175 -15.330  -1.871
  827   2HG   GLU 110           HG2      GLU 110  27.812 -15.954  -1.678
  828    H    ILE 111           HN       ILE 111  27.904 -14.921   2.197
  829    HA   ILE 111           HA       ILE 111  30.055 -14.874   3.066
  830    HB   ILE 111           HB       ILE 111  29.569 -17.621   2.593
  831   1HG1  ILE 111          HG11      ILE 111  32.079 -16.578   3.903
  832   2HG1  ILE 111          HG12      ILE 111  30.499 -16.300   4.623
  833   1HG2  ILE 111          HG21      ILE 111  31.133 -17.266   0.563
  834   2HG2  ILE 111          HG22      ILE 111  32.409 -16.913   1.725
  835   3HG2  ILE 111          HG23      ILE 111  31.653 -18.501   1.703
  836   1HD1  ILE 111          HD13      ILE 111  31.006 -19.087   3.731
  837   2HD1  ILE 111          HD11      ILE 111  31.986 -18.541   5.087
  838   3HD1  ILE 111          HD12      ILE 111  30.230 -18.503   5.198
  839    H    LYS 112           HN       LYS 112  32.383 -14.805   2.289
  840    HA   LYS 112           HA       LYS 112  32.673 -13.061   0.139
  841   1HB   LYS 112           HB2      LYS 112  34.603 -15.137   1.259
  842   2HB   LYS 112           HB1      LYS 112  35.098 -13.925   0.085
  843   1HG   LYS 112           HG1      LYS 112  33.654 -13.095   2.590
  844   2HG   LYS 112           HG2      LYS 112  35.380 -13.415   2.645
  845   1HD   LYS 112           HD1      LYS 112  34.150 -11.552   0.593
  846   2HD   LYS 112           HD2      LYS 112  34.682 -10.983   2.170
  847   1HE   LYS 112           HE1      LYS 112  36.687 -10.694   1.105
  848   2HE   LYS 112           HE2      LYS 112  36.874 -12.417   1.404
  849   1HZ   LYS 112           HZ1      LYS 112  35.426 -12.351  -0.881
  850   2HZ   LYS 112           HZ2      LYS 112  36.468 -11.022  -1.073
  851    NH1  ARG 113           NH1      ARG 113  29.606 -18.926  -4.230
  852    NH2  ARG 113           NH2      ARG 113  30.453 -20.715  -5.347
  853    H    ARG 113           HN       ARG 113  32.876 -16.578   0.061
  854    HA   ARG 113           HA       ARG 113  33.506 -16.659  -2.779
  855   1HB   ARG 113           HB2      ARG 113  33.912 -18.437  -0.832
  856   2HB   ARG 113           HB1      ARG 113  32.295 -18.981  -1.257
  857   1HG   ARG 113           HG1      ARG 113  34.113 -18.525  -3.559
  858   2HG   ARG 113           HG2      ARG 113  34.570 -19.854  -2.501
  859   1HD   ARG 113           HD1      ARG 113  33.105 -20.894  -4.029
  860   2HD   ARG 113           HD2      ARG 113  32.041 -20.532  -2.669
  861    HE   ARG 113           HE       ARG 113  32.153 -18.397  -4.672
  862   1HH1  ARG 113          HH11      ARG 113  29.768 -18.097  -3.689
  863   2HH1  ARG 113          HH12      ARG 113  28.672 -19.198  -4.452
  864   1HH2  ARG 113          HH21      ARG 113  31.252 -21.233  -5.647
  865   2HH2  ARG 113          HH22      ARG 113  29.536 -21.024  -5.589
   
   
  No H/Q in entry =         865